*HEADER    PROTEIN BINDING                         18-JUL-03   1Q10              
*TITLE     ENSEMBLE OF 40 STRUCTURES OF THE DIMERIC MUTANT OF THE B1             
*TITLE    2 DOMAIN OF STREPTOCOCCAL PROTEIN G                                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: IMMUNOGLOBULIN G BINDING PROTEIN G;                        
*COMPND   3 CHAIN: A, B;                                                         
*COMPND   4 FRAGMENT: B1 DOMAIN;                                                 
*COMPND   5 SYNONYM: IGG BINDING PROTEIN G;                                      
*COMPND   6 ENGINEERED: YES;                                                     
*COMPND   7 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS SP. (LANCEFIELD GROUP             
*SOURCE   3 G);                                                                  
*SOURCE   4 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   5 GENE: SPG;                                                           
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: HMS174(DE3);                               
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PET11A                                    
*KEYWDS    GB1, CORE MUTANTS, NMR STRUCTURE, DOMAIN-SWAPPING,                    
*KEYWDS   2 OLIGOMERIZATION                                                      
*EXPDTA    NMR, 40 STRUCTURES                                                    
*AUTHOR    I.J.BYEON, J.M.LOUIS, A.M.GRONENBORN                                  
*REVDAT   1   20-JUL-04 1Q10    0                                                

!NOE RESTRAINTS@ BEGIN_XPLR_NOE_FILE
!INTRAMOLECULAR NOES
!MONOMER UNIT A
! M1
assign (segid A and resid   1 and name   HA ) (segid A and resid   1 and name  HB# )  4.0  2.2  1.0 
assign (segid A and resid   1 and name   HA ) (segid A and resid   1 and name  HG# )  4.0  2.2  1.0 
assign (segid A and resid   1 and name   HA ) (segid A and resid   1 and name  HE# )  4.0  2.2  1.5 
assign (segid A and resid   1 and name   HA ) (segid A and resid   2 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid   1 and name  HB# ) (segid A and resid   2 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   1 and name  HG# ) (segid A and resid   2 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   1 and name  HE# ) (segid A and resid   2 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid   1 and name  HB1 ) (segid A and resid   3 and name  HE# )  3.0  1.2  0.8 
assign (segid A and resid   1 and name  HB2 ) (segid A and resid   3 and name  HE# )  3.0  1.2  0.8 
assign (segid A and resid   1 and name  HG1 ) (segid A and resid   3 and name  HE# )  4.0  2.2  1.5
assign (segid A and resid   1 and name  HG2 ) (segid A and resid   3 and name  HE# )  4.0  2.2  1.5 
assign (segid A and resid   1 and name  HE# ) (segid A and resid   3 and name  HE# )  4.0  2.2  3.0 
 
! Q2
assign (segid A and resid   2 and name   HA ) (segid A and resid   2 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid   2 and name  HG# ) (segid A and resid   2 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   2 and name  HG# ) (segid A and resid   2 and name HE2# )  4.0  2.2  1.0 
assign (segid A and resid   2 and name  HG# ) (segid A and resid   2 and name   HA )  3.0  1.2  0.3 
assign (segid A and resid   2 and name  HB# ) (segid A and resid   2 and name   HN )  3.0  1.2  0.3 
assign (segid A and resid   2 and name   HA ) (segid A and resid   3 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid   2 and name  HG# ) (segid A and resid   3 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid   2 and name  HB1 ) (segid A and resid   3 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   2 and name  HB2 ) (segid A and resid   3 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   2 and name   HN ) (segid A and resid   3 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   2 and name  HG# ) (segid A and resid  17 and name   HB )  4.0  2.2  1.0 
assign (segid A and resid   2 and name HE2# ) (segid A and resid  17 and name   HB )  4.0  2.2  2.5 
assign (segid A and resid   2 and name  HG# ) (segid A and resid  17 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid   2 and name  HB# ) (segid A and resid  17 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid   2 and name HE2# ) (segid A and resid  17 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid   2 and name  HG# ) (segid A and resid  18 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid   2 and name   HA ) (segid A and resid  19 and name   HA )  2.5  0.7  0.2 
assign (segid A and resid   2 and name  HG# ) (segid A and resid  19 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid   2 and name HE2# ) (segid A and resid  19 and name  HB# )  4.0  2.2  2.0 
assign (segid A and resid   2 and name   HN ) (segid A and resid  19 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid   2 and name   HA ) (segid A and resid  20 and name   HN )  4.0  2.2  1.0 

! Y3
assign (segid A and resid   3 and name   HA ) (segid A and resid   3 and name  HD# )  3.0  1.2  0.8 
assign (segid A and resid   3 and name   HA ) (segid A and resid   3 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   3 and name  HB# ) (segid A and resid   3 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid   3 and name  HD# ) (segid A and resid   3 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid   3 and name  HB# ) (segid A and resid   3 and name  HD# )  3.0  1.2  0.8 
assign (segid A and resid   3 and name   HA ) (segid A and resid   4 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid   3 and name  HB# ) (segid A and resid   4 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   3 and name  HD# ) (segid A and resid   4 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid   3 and name   HN ) (segid A and resid   4 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid   3 and name   HN ) (segid A and resid  17 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid   3 and name   HN ) (segid A and resid  17 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid   3 and name   HA ) (segid A and resid  18 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid   3 and name  HB# ) (segid A and resid  18 and name HG2# )  3.0  1.2  0.8 
assign (segid A and resid   3 and name  HD# ) (segid A and resid  18 and name HG2# )  3.0  1.2  1.3 
assign (segid A and resid   3 and name   HN ) (segid A and resid  18 and name HG2# )  3.0  1.2  1.0 
assign (segid A and resid   3 and name   HN ) (segid A and resid  18 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid   3 and name  HB# ) (segid A and resid  18 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   3 and name  HD# ) (segid A and resid  19 and name   HA )  4.0  2.2  1.5 
assign (segid A and resid   3 and name  HE# ) (segid A and resid  19 and name   HA )  4.0  2.2  1.5 
assign (segid A and resid   3 and name   HN ) (segid A and resid  19 and name   HA )  3.0  1.2  0.5 
assign (segid A and resid   3 and name  HD# ) (segid A and resid  20 and name  HB# )  3.0  1.2  1.3 
assign (segid A and resid   3 and name  HE# ) (segid A and resid  20 and name  HB# )  3.0  1.2  1.3 
assign (segid A and resid   3 and name  HE# ) (segid A and resid  20 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid   3 and name  HD# ) (segid A and resid  20 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid   3 and name  HD# ) (segid A and resid  23 and name   HA )  4.0  2.2  1.5 
assign (segid A and resid   3 and name  HE# ) (segid A and resid  23 and name   HA )  4.0  2.2  1.5 
assign (segid A and resid   3 and name  HE# ) (segid A and resid  23 and name  HB# )  3.0  1.2  1.3 
assign (segid A and resid   3 and name  HD# ) (segid A and resid  23 and name  HB# )  4.0  2.2  2.0 
assign (segid A and resid   3 and name  HE# ) (segid A and resid  23 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid   3 and name  HD# ) (segid A and resid  23 and name   HN )  4.0  2.2  2.5 
assign (segid A and resid   3 and name  HB# ) (segid A and resid  26 and name  HB# )  3.0  1.2  0.8 

! K4
assign (segid A and resid   4 and name   HA ) (segid A and resid   4 and name  HG# )  3.0  1.2  0.3 
assign (segid A and resid   4 and name   HA ) (segid A and resid   4 and name  HD# )  4.0  2.2  1.0 
assign (segid A and resid   4 and name  HE# ) (segid A and resid   4 and name  HB# )  4.0  2.2  1.5 
assign (segid A and resid   4 and name   HA ) (segid A and resid   4 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid   4 and name  HB# ) (segid A and resid   4 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid   4 and name  HG# ) (segid A and resid   4 and name  HE# )  4.0  2.2  2.0 
assign (segid A and resid   4 and name  HG# ) (segid A and resid   4 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   4 and name   HA ) (segid A and resid   5 and name  HG* )  4.0  2.2  1.5 
assign (segid A and resid   4 and name   HA ) (segid A and resid   5 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid   4 and name  HB# ) (segid A and resid   5 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   4 and name  HG# ) (segid A and resid   5 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid   4 and name   HN ) (segid A and resid   5 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   4 and name  HB# ) (segid A and resid   6 and name HD1# )  4.0  2.2  2.0 
assign (segid A and resid   4 and name  HE# ) (segid A and resid   6 and name HD1# )  4.0  2.2  2.5 
assign (segid A and resid   4 and name   HA ) (segid A and resid  16 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   4 and name   HA ) (segid A and resid  17 and name   HA )  3.0  1.2  0.3 
assign (segid A and resid   4 and name  HG# ) (segid A and resid  17 and name   HB )  4.0  2.2  2.0 
assign (segid A and resid   4 and name  HB# ) (segid A and resid  17 and name   HA )  4.0  2.2  2.5 
assign (segid A and resid   4 and name  HG# ) (segid A and resid  17 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid   4 and name   HA ) (segid A and resid  17 and name HG2# )  3.0  1.2  0.8 
assign (segid A and resid   4 and name   HA ) (segid A and resid  18 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   4 and name  HB# ) (segid A and resid  18 and name   HN )  4.0  2.2  2.5 

! V5
assign (segid A and resid   5 and name   HA ) (segid A and resid   5 and name  HG* )  4.0  2.2  1.5 
assign (segid A and resid   5 and name  HG* ) (segid A and resid   5 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid   5 and name   HB ) (segid A and resid   5 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid   5 and name   HA ) (segid A and resid   6 and name HG1# )  4.0  2.2  2.0 
assign (segid A and resid   5 and name   HA ) (segid A and resid   6 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid   5 and name  HG* ) (segid A and resid   6 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid   5 and name   HA ) (segid A and resid   6 and name HD1# )  4.0  2.2  2.5 
assign (segid A and resid   5 and name  HG* ) (segid A and resid   7 and name   HG )  4.0  2.2  1.5 
assign (segid A and resid   5 and name  HG* ) (segid A and resid   7 and name   HD* )  3.0  1.2  1.3 
assign (segid A and resid   5 and name  HG* ) (segid A and resid   7 and name   HN )  4.0  2.2  2.5 
assign (segid A and resid   5 and name   HN ) (segid A and resid  15 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid   5 and name   HB ) (segid A and resid  16 and name   HB )  4.0  2.2  1.0 
assign (segid A and resid   5 and name  HG* ) (segid A and resid  16 and name   HB )  4.0  2.2  1.5 
assign (segid A and resid   5 and name   HB ) (segid A and resid  16 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid   5 and name   HB ) (segid A and resid  16 and name  HG1 )  4.0  2.2  1.0 
assign (segid A and resid   5 and name  HG* ) (segid A and resid  16 and name  HG1 )  4.0  2.2  1.5 
assign (segid A and resid   5 and name  HG* ) (segid A and resid  16 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid   5 and name   HN ) (segid A and resid  16 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid   5 and name   HN ) (segid A and resid  16 and name  HG1 )  4.0  2.2  1.0 
assign (segid A and resid   5 and name   HN ) (segid A and resid  17 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid   5 and name   HN ) (segid A and resid  17 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid   5 and name   HB ) (segid A and resid  18 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid   5 and name   HA ) (segid A and resid  30 and name  HG* )  4.0  2.2  1.5 
assign (segid A and resid   5 and name   HB ) (segid A and resid  30 and name  HG* )  4.0  2.2  1.5 
assign (segid A and resid   5 and name  HG* ) (segid A and resid  33 and name  HB# )  4.0  2.2  2.5 
assign (segid A and resid   5 and name  HG* ) (segid A and resid  34 and name  HE# )  4.0  2.2  3.0 
assign (segid A and resid   5 and name  HG* ) (segid A and resid  34 and name   HZ )  4.0  2.2  2.5 

! I6
assign (segid A and resid   6 and name   HA ) (segid A and resid   6 and name HG1# )  3.0  1.2  0.3 
assign (segid A and resid   6 and name   HA ) (segid A and resid   6 and name HD1# )  4.0  2.2  1.5 
assign (segid A and resid   6 and name   HB ) (segid A and resid   6 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid   6 and name HG1# ) (segid A and resid   6 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid   6 and name HG2# ) (segid A and resid   6 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid   6 and name HG2# ) (segid A and resid   6 and name   HA )  3.0  1.2  0.8 
assign (segid A and resid   6 and name HD1# ) (segid A and resid   6 and name   HN )  4.0  2.2  2.5 
assign (segid A and resid   6 and name HD1# ) (segid A and resid   6 and name   HB )  3.0  1.2  0.8 
assign (segid A and resid   6 and name   HA ) (segid A and resid   7 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid   6 and name   HB ) (segid A and resid   7 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   6 and name HG1# ) (segid A and resid   7 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid   6 and name   HA ) (segid A and resid   7 and name  HD* )  4.0  2.2  2.5 
assign (segid A and resid   6 and name HG2# ) (segid A and resid   7 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid   6 and name HD1# ) (segid A and resid   7 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid   6 and name   HN ) (segid A and resid   7 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   6 and name HG2# ) (segid A and resid   8 and name  HB# )  4.0  2.2  1.5 
assign (segid A and resid   6 and name HG2# ) (segid A and resid   8 and name HD21 )  4.0  2.2  1.5 
assign (segid A and resid   6 and name HG2# ) (segid A and resid   8 and name   HA )  4.0  2.2  1.5 
assign (segid A and resid   6 and name HG2# ) (segid A and resid   8 and name HD22 )  4.0  2.2  1.5 
assign (segid A and resid   6 and name   HA ) (segid A and resid  15 and name  HG# )  4.0  2.2  1.0 
assign (segid A and resid   6 and name   HA ) (segid A and resid  15 and name   HA )  2.5  0.7  0.2 
assign (segid A and resid   6 and name HG2# ) (segid A and resid  15 and name   HA )  4.0  2.2  1.5 
assign (segid A and resid   6 and name HD1# ) (segid A and resid  15 and name   HA )  4.0  2.2  1.5 
assign (segid A and resid   6 and name HD1# ) (segid A and resid  15 and name  HG# )  3.0  1.2  0.8 
assign (segid A and resid   6 and name   HA ) (segid A and resid  15 and name  HB# )  4.0  2.2  2.0 
assign (segid A and resid   6 and name   HA ) (segid A and resid  16 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   6 and name HD1# ) (segid A and resid  16 and name   HN )  4.0  2.2  2.5 

! L7
assign (segid A and resid   7 and name  HB# ) (segid A and resid   7 and name  HD* )  3.0  1.2  0.8 
assign (segid A and resid   7 and name  HB# ) (segid A and resid   7 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid   7 and name   HG ) (segid A and resid   7 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid   7 and name   HG ) (segid A and resid   7 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid   7 and name  HD* ) (segid A and resid   7 and name   HA )  3.0  1.2  0.8 
assign (segid A and resid   7 and name  HD* ) (segid A and resid   7 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid   7 and name   HA ) (segid A and resid   8 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid   7 and name  HB# ) (segid A and resid   8 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   7 and name   HG ) (segid A and resid   8 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid   7 and name  HD* ) (segid A and resid   8 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid   7 and name   HN ) (segid A and resid   8 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   7 and name  HB1 ) (segid A and resid  12 and name  HD* )  4.0  2.2  1.5 
assign (segid A and resid   7 and name  HB2 ) (segid A and resid  12 and name  HD* )  4.0  2.2  1.5 
assign (segid A and resid   7 and name  HD* ) (segid A and resid  12 and name  HD* )  3.0  1.2  1.3 
assign (segid A and resid   7 and name  HB# ) (segid A and resid  13 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid   7 and name   HN ) (segid A and resid  13 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid   7 and name  HB# ) (segid A and resid  14 and name  HA# )  4.0  2.2  1.0 
assign (segid A and resid   7 and name  HD* ) (segid A and resid  14 and name  HA# )  4.0  2.2  1.5 
assign (segid A and resid   7 and name  HB# ) (segid A and resid  14 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid   7 and name  HD* ) (segid A and resid  14 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid   7 and name  HD* ) (segid A and resid  15 and name   HA )  4.0  2.2  1.5 
assign (segid A and resid   7 and name   HG ) (segid A and resid  15 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid   7 and name  HD* ) (segid A and resid  15 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid   7 and name   HN ) (segid A and resid  15 and name   HA )  3.0  1.2  0.5 
assign (segid A and resid   7 and name  HD* ) (segid A and resid  16 and name   HB )  4.0  2.2  1.5 
assign (segid A and resid   7 and name  HD* ) (segid A and resid  16 and name   HA )  4.0  2.2  2.5 
assign (segid A and resid   7 and name  HD* ) (segid A and resid  16 and name  HG1 )  4.0  2.2  1.5 
assign (segid A and resid   7 and name  HB# ) (segid A and resid  33 and name  HD# )  4.0  2.2  2.5 
assign (segid A and resid   7 and name  HB# ) (segid A and resid  33 and name  HE# )  4.0  2.2  2.5 
assign (segid A and resid   7 and name  HD* ) (segid A and resid  33 and name  HD# )  3.0  1.2  1.3 
assign (segid A and resid   7 and name  HD* ) (segid A and resid  33 and name  HE# )  3.0  1.2  1.3 
assign (segid A and resid   7 and name  HB# ) (segid A and resid  34 and name  HE# )  4.0  2.2  1.5 
assign (segid A and resid   7 and name  HB# ) (segid A and resid  34 and name   HZ )  4.0  2.2  1.0 
assign (segid A and resid   7 and name   HG ) (segid A and resid  34 and name  HE# )  4.0  2.2  1.5 
assign (segid A and resid   7 and name  HD* ) (segid A and resid  34 and name  HE# )  3.0  1.2  1.3 
assign (segid A and resid   7 and name  HD* ) (segid A and resid  34 and name   HZ )  3.0  1.2  0.8 
assign (segid A and resid   7 and name  HD* ) (segid A and resid  34 and name  HD# )  4.0  2.2  2.0 

! N8
assign (segid A and resid   8 and name  HB# ) (segid A and resid   8 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid   8 and name   HN ) (segid A and resid   8 and name HD2# )  4.0  2.2  2.0 
assign (segid A and resid   8 and name  HB# ) (segid A and resid   8 and name HD2# )  4.0  2.2  1.0 
assign (segid A and resid   8 and name   HA ) (segid A and resid   8 and name HD2# )  4.0  2.2  2.0 
assign (segid A and resid   8 and name   HA ) (segid A and resid   9 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid   8 and name  HB# ) (segid A and resid   9 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   8 and name   HN ) (segid A and resid   9 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   8 and name   HA ) (segid A and resid  12 and name  HD* )  4.0  2.2  1.5 
assign (segid A and resid   8 and name   HA ) (segid A and resid  13 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid   8 and name   HA ) (segid A and resid  13 and name  HD# )  4.0  2.2  1.0 
assign (segid A and resid   8 and name   HA ) (segid A and resid  13 and name  HG# )  4.0  2.2  1.0 
assign (segid A and resid   8 and name HD2# ) (segid A and resid  13 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid   8 and name   HA ) (segid A and resid  14 and name   HN )  4.0  2.2  1.0 

! G9
assign (segid A and resid   9 and name  HA# ) (segid A and resid  10 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid   9 and name   HN ) (segid A and resid  10 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   9 and name  HA# ) (segid A and resid  11 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   9 and name   HN ) (segid A and resid  11 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid   9 and name  HA# ) (segid A and resid  12 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid   9 and name  HA# ) (segid A and resid  12 and name   HG )  4.0  2.2  1.0 
assign (segid A and resid   9 and name   HN ) (segid A and resid  12 and name  HB# )  4.0  2.2  1.5 
assign (segid A and resid   9 and name  HA# ) (segid A and resid  12 and name  HD* )  4.0  2.2  1.5 
assign (segid A and resid   9 and name   HN ) (segid A and resid  12 and name  HD* )  4.0  2.2  1.5 
assign (segid A and resid   9 and name   HN ) (segid A and resid  12 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   9 and name   HN ) (segid A and resid  13 and name   HA )  3.0  1.2  0.5 
assign (segid A and resid   9 and name   HN ) (segid A and resid  13 and name  HD# )  4.0  2.2  1.0 
assign (segid A and resid   9 and name   HN ) (segid A and resid  13 and name  HG# )  4.0  2.2  1.0 

! K10
assign (segid A and resid  10 and name   HA ) (segid A and resid  10 and name  HG# )  3.0  1.2  0.3 
assign (segid A and resid  10 and name  HB# ) (segid A and resid  10 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  10 and name  HD# ) (segid A and resid  10 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid  10 and name  HD# ) (segid A and resid  10 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid  10 and name  HG# ) (segid A and resid  10 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  10 and name  HG# ) (segid A and resid  11 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid  10 and name   HA ) (segid A and resid  11 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  10 and name   HA ) (segid A and resid  11 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid  10 and name  HB# ) (segid A and resid  11 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid  10 and name  HB# ) (segid A and resid  11 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  10 and name   HN ) (segid A and resid  11 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  10 and name  HG# ) (segid A and resid  11 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  10 and name   HA ) (segid A and resid  12 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  10 and name  HB# ) (segid A and resid  12 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  10 and name   HN ) (segid A and resid  12 and name   HN )  4.0  2.2  1.0 

! T11
assign (segid A and resid  11 and name   HA ) (segid A and resid  11 and name HG2# )  2.5  0.7  0.7 
assign (segid A and resid  11 and name HG2# ) (segid A and resid  11 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  11 and name   HB ) (segid A and resid  12 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid  11 and name   HA ) (segid A and resid  12 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  11 and name HG2# ) (segid A and resid  12 and name   HN )  4.0  2.2  2.5 
assign (segid A and resid  11 and name   HN ) (segid A and resid  12 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  11 and name   HN ) (segid A and resid  12 and name  HD* )  4.0  2.2  1.5 

! L12
assign (segid A and resid  12 and name   HA ) (segid A and resid  12 and name  HD* )  4.0  2.2  1.5 
assign (segid A and resid  12 and name  HB# ) (segid A and resid  12 and name  HD* )  3.0  1.2  0.8 
assign (segid A and resid  12 and name  HB# ) (segid A and resid  12 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  12 and name   HG ) (segid A and resid  12 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid  12 and name   HG ) (segid A and resid  12 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  12 and name   HA ) (segid A and resid  13 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  12 and name  HD* ) (segid A and resid  13 and name   HA )  4.0  2.2  1.5 
assign (segid A and resid  12 and name  HB# ) (segid A and resid  13 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  12 and name   HG ) (segid A and resid  13 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid  12 and name  HD1#) (segid A and resid  13 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  12 and name  HD2#) (segid A and resid  13 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  12 and name   HN ) (segid A and resid  13 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  12 and name  HD* ) (segid A and resid  14 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  12 and name  HD* ) (segid A and resid  34 and name  HD# )  4.0  2.2  3.0 
assign (segid A and resid  12 and name  HD* ) (segid A and resid  34 and name  HE# )  4.0  2.2  2.0 
assign (segid A and resid  12 and name  HD* ) (segid A and resid  34 and name   HZ )  4.0  2.2  2.5 

! K13
assign (segid A and resid  13 and name   HA ) (segid A and resid  13 and name  HG# )  3.0  1.2  0.3 
assign (segid A and resid  13 and name  HB# ) (segid A and resid  13 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  13 and name  HD# ) (segid A and resid  13 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid  13 and name  HG# ) (segid A and resid  13 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  13 and name   HA ) (segid A and resid  14 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  13 and name  HB# ) (segid A and resid  14 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  13 and name  HG# ) (segid A and resid  14 and name   HN )  4.0  2.2  1.0 

! G14
assign (segid A and resid  14 and name  HA# ) (segid A and resid  15 and name   HN )  2.5  0.7  0.4 

! E15
assign (segid A and resid  15 and name  HG# ) (segid A and resid  15 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  15 and name  HG# ) (segid A and resid  15 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid  15 and name  HB# ) (segid A and resid  15 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  15 and name   HA ) (segid A and resid  16 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  15 and name   HA ) (segid A and resid  16 and name  HG1 )  4.0  2.2  2.0 
assign (segid A and resid  15 and name  HG# ) (segid A and resid  16 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  15 and name  HB# ) (segid A and resid  16 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  15 and name   HN ) (segid A and resid  16 and name   HN )  4.0  2.2  1.0 

! T16
assign (segid A and resid  16 and name   HB ) (segid A and resid  16 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  16 and name   HA ) (segid A and resid  16 and name HG2# )  3.0  1.2  0.8 
assign (segid A and resid  16 and name   HA ) (segid A and resid  16 and name  HG1 )  4.0  2.2  1.0 
assign (segid A and resid  16 and name HG2# ) (segid A and resid  16 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  16 and name  HG1 ) (segid A and resid  16 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  16 and name   HB ) (segid A and resid  17 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  16 and name   HA ) (segid A and resid  17 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  16 and name HG2# ) (segid A and resid  17 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  16 and name  HG1 ) (segid A and resid  17 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  16 and name HG2# ) (segid A and resid  30 and name  HG* )  3.0  1.2  1.3 
assign (segid A and resid  16 and name HG2# ) (segid A and resid  34 and name  HE# )  4.0  2.2  2.0 
assign (segid A and resid  16 and name HG2# ) (segid A and resid  34 and name   HZ )  4.0  2.2  1.5 

! T17
assign (segid A and resid  17 and name   HB ) (segid A and resid  17 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  17 and name   HA ) (segid A and resid  17 and name HG2# )  2.5  0.7  0.7 
assign (segid A and resid  17 and name HG2# ) (segid A and resid  17 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  17 and name   HB ) (segid A and resid  18 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  17 and name   HA ) (segid A and resid  18 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid  17 and name   HA ) (segid A and resid  18 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  17 and name HG2# ) (segid A and resid  18 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  17 and name   HA ) (segid A and resid  30 and name  HG* )  4.0  2.2  1.5 

! T18
assign (segid A and resid  18 and name   HB ) (segid A and resid  18 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  18 and name   HA ) (segid A and resid  18 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid  18 and name HG2# ) (segid A and resid  18 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  18 and name   HB ) (segid A and resid  19 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  18 and name   HA ) (segid A and resid  19 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  18 and name   HA ) (segid A and resid  19 and name  HB# )  4.0  2.2  1.0 
assign (segid A and resid  18 and name HG2# ) (segid A and resid  19 and name   HA )  4.0  2.2  1.5 
assign (segid A and resid  18 and name HG2# ) (segid A and resid  19 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  18 and name   HN ) (segid A and resid  19 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  18 and name  HG1 ) (segid A and resid  19 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  18 and name HG2# ) (segid A and resid  20 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  18 and name HG2# ) (segid A and resid  20 and name  HB# )  4.0  2.2  2.0 
assign (segid A and resid  18 and name HG2# ) (segid A and resid  26 and name   HA )  3.0  1.2  0.8 
assign (segid A and resid  18 and name  HG1 ) (segid A and resid  29 and name  HG* )  4.0  2.2  1.5 
assign (segid A and resid  18 and name   HB ) (segid A and resid  30 and name  HG* )  3.0  1.2  0.8 
assign (segid A and resid  18 and name   HN ) (segid A and resid  30 and name  HG* )  4.0  2.2  1.5 

! E19
assign (segid A and resid  19 and name   HA ) (segid A and resid  19 and name  HG# )  4.0  2.2  1.0 
assign (segid A and resid  19 and name  HG# ) (segid A and resid  19 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  19 and name  HB# ) (segid A and resid  19 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  19 and name   HA ) (segid A and resid  20 and name  HB# )  4.0  2.2  1.5 
assign (segid A and resid  19 and name   HA ) (segid A and resid  20 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  19 and name  HG# ) (segid A and resid  20 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  19 and name  HB# ) (segid A and resid  20 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  19 and name   HN ) (segid A and resid  20 and name   HN )  4.0  2.2  1.0 

! A20
assign (segid A and resid  20 and name  HB# ) (segid A and resid  20 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  20 and name  HB# ) (segid A and resid  21 and name   HA )  4.0  2.2  1.5 
assign (segid A and resid  20 and name   HA ) (segid A and resid  21 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  20 and name  HB# ) (segid A and resid  21 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  20 and name   HN ) (segid A and resid  21 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  20 and name  HB# ) (segid A and resid  22 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  20 and name   HN ) (segid A and resid  22 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  20 and name  HB# ) (segid A and resid  25 and name   HB )  3.0  1.2  0.8 
assign (segid A and resid  20 and name  HB# ) (segid A and resid  25 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  20 and name  HB# ) (segid A and resid  26 and name   HA )  3.0  1.2  0.8 
assign (segid A and resid  20 and name  HB# ) (segid A and resid  26 and name  HB# )  3.0  1.2  0.8 
assign (segid A and resid  20 and name  HB# ) (segid A and resid  26 and name   HN )  3.0  1.2  1.0 

! V21
assign (segid A and resid  21 and name   HA ) (segid A and resid  21 and name  HG* )  3.0  1.2  1.0 
assign (segid A and resid  21 and name   HB ) (segid A and resid  21 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  21 and name  HG* ) (segid A and resid  21 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  21 and name   HA ) (segid A and resid  22 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  21 and name   HB ) (segid A and resid  22 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  21 and name  HG* ) (segid A and resid  22 and name   HN )  2.5  0.7  0.9 
assign (segid A and resid  21 and name   HN ) (segid A and resid  22 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  21 and name  HG* ) (segid A and resid  25 and name   HB )  3.0  1.2  0.8 

! D22
assign (segid A and resid  22 and name  HB# ) (segid A and resid  22 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  22 and name  HB# ) (segid A and resid  23 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  22 and name   HA ) (segid A and resid  23 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  22 and name   HN ) (segid A and resid  23 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  22 and name   HA ) (segid A and resid  24 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  22 and name   HN ) (segid A and resid  24 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  22 and name  HB# ) (segid A and resid  24 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  22 and name   HN ) (segid A and resid  25 and name   HB )  3.0  1.2  0.5 
assign (segid A and resid  22 and name   HN ) (segid A and resid  25 and name HG2# )  3.0  1.2  1.0 
assign (segid A and resid  22 and name  HB# ) (segid A and resid  25 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  22 and name   HN ) (segid A and resid  25 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  22 and name   HN ) (segid A and resid  25 and name HG2* )  3.0  1.2  0.5 
assign (segid A and resid  22 and name   HN ) (segid A and resid  25 and name   HA )  4.0  2.2  1.0 

! A23
assign (segid A and resid  23 and name  HB# ) (segid A and resid  23 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  23 and name  HB# ) (segid A and resid  24 and name   HA )  4.0  2.2  1.5 
assign (segid A and resid  23 and name   HA ) (segid A and resid  24 and name  HB# )  4.0  2.2  1.5 
assign (segid A and resid  23 and name   HN ) (segid A and resid  24 and name  HB# )  4.0  2.2  1.5 
assign (segid A and resid  23 and name  HB# ) (segid A and resid  24 and name   HN )  2.5  0.7  0.9 
assign (segid A and resid  23 and name   HA ) (segid A and resid  24 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  23 and name   HA ) (segid A and resid  26 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  23 and name   HA ) (segid A and resid  26 and name  HB# )  2.5  0.7  0.7 

! A24
assign (segid A and resid  24 and name  HB# ) (segid A and resid  24 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  24 and name   HA ) (segid A and resid  25 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  24 and name  HB# ) (segid A and resid  25 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  24 and name   HN ) (segid A and resid  25 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  24 and name   HN ) (segid A and resid  26 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  24 and name   HA ) (segid A and resid  27 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  24 and name   HA ) (segid A and resid  27 and name  HB# )  3.0  1.2  0.3 
assign (segid A and resid  24 and name   HA ) (segid A and resid  27 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid  24 and name  HB# ) (segid A and resid  27 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  24 and name   HA ) (segid A and resid  28 and name   HN )  4.0  2.2  1.0 

! T25
assign (segid A and resid  25 and name   HA ) (segid A and resid  25 and name HG2* )  2.5  0.7  0.2 
assign (segid A and resid  25 and name HG2# ) (segid A and resid  25 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  25 and name HG2# ) (segid A and resid  25 and name   HA )  3.0  1.2  1.0 
assign (segid A and resid  25 and name   HB ) (segid A and resid  25 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  25 and name   HN ) (segid A and resid  26 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid  25 and name   HB ) (segid A and resid  26 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  25 and name   HA ) (segid A and resid  26 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  25 and name HG2# ) (segid A and resid  26 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  25 and name   HN ) (segid A and resid  26 and name  HB# )  4.0  2.2  1.5 
assign (segid A and resid  25 and name   HB ) (segid A and resid  26 and name  HB# )  4.0  2.2  2.5 
assign (segid A and resid  25 and name   HN ) (segid A and resid  26 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  25 and name   HA ) (segid A and resid  28 and name  HE# )  4.0  2.2  2.0 
assign (segid A and resid  25 and name   HA ) (segid A and resid  28 and name  HD# )  4.0  2.2  1.0 
assign (segid A and resid  25 and name   HA ) (segid A and resid  28 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  25 and name   HA ) (segid A and resid  28 and name  HB# )  2.5  0.7  0.2 
assign (segid A and resid  25 and name   HN ) (segid A and resid  28 and name  HB# )  4.0  2.2  1.0 

! A26
assign (segid A and resid  26 and name  HB# ) (segid A and resid  26 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  26 and name   HN ) (segid A and resid  27 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  26 and name  HB# ) (segid A and resid  27 and name   HN )  2.5  0.7  0.9 
assign (segid A and resid  26 and name   HA ) (segid A and resid  27 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  26 and name   HN ) (segid A and resid  28 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  26 and name   HA ) (segid A and resid  29 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  26 and name   HA ) (segid A and resid  29 and name   HB )  3.0  1.2  0.3 
assign (segid A and resid  26 and name   HA ) (segid A and resid  30 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid  26 and name   HA ) (segid A and resid  30 and name  HG* )  4.0  2.2  1.5 

! E27
assign (segid A and resid  27 and name   HA ) (segid A and resid  27 and name  HG# )  3.0  1.2  0.3 
assign (segid A and resid  27 and name  HB# ) (segid A and resid  27 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  27 and name  HG# ) (segid A and resid  27 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  27 and name   HA ) (segid A and resid  28 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  27 and name   HN ) (segid A and resid  28 and name  HB# )  4.0  2.2  1.0 
assign (segid A and resid  27 and name  HB# ) (segid A and resid  28 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  27 and name  HG# ) (segid A and resid  28 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  27 and name   HN ) (segid A and resid  28 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  27 and name   HN ) (segid A and resid  29 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  27 and name   HA ) (segid A and resid  29 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid  27 and name   HA ) (segid A and resid  30 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  27 and name   HA ) (segid A and resid  30 and name  HG* )  4.0  2.2  1.5 
assign (segid A and resid  27 and name   HA ) (segid A and resid  30 and name   HB )  4.0  2.2  1.0 
assign (segid A and resid  27 and name  HG# ) (segid A and resid  30 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid  27 and name  HB# ) (segid A and resid  30 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  27 and name   HA ) (segid A and resid  31 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  27 and name  HG# ) (segid A and resid  31 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid  27 and name  HG# ) (segid A and resid  31 and name  HE# )  4.0  2.2  2.0 
assign (segid A and resid  27 and name  HB# ) (segid A and resid  31 and name  HD# )  4.0  2.2  1.0 

! K28
assign (segid A and resid  28 and name   HA ) (segid A and resid  28 and name  HG# )  3.0  1.2  0.3 
assign (segid A and resid  28 and name  HB# ) (segid A and resid  28 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  28 and name  HG# ) (segid A and resid  28 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  28 and name   HA ) (segid A and resid  29 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  28 and name  HB# ) (segid A and resid  29 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  28 and name  HB# ) (segid A and resid  29 and name  HG* )  4.0  2.2  1.5 
assign (segid A and resid  28 and name  HD# ) (segid A and resid  29 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  28 and name   HN ) (segid A and resid  29 and name  HG* )  4.0  2.2  2.5 
assign (segid A and resid  28 and name  HG# ) (segid A and resid  29 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  28 and name   HN ) (segid A and resid  29 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  28 and name   HN ) (segid A and resid  30 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  28 and name   HA ) (segid A and resid  31 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  28 and name   HA ) (segid A and resid  31 and name  HG# )  4.0  2.2  1.0 
assign (segid A and resid  28 and name  HD# ) (segid A and resid  31 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid  28 and name  HB# ) (segid A and resid  32 and name   HN )  4.0  2.2  2.0 

! V29
assign (segid A and resid  29 and name   HA ) (segid A and resid  29 and name  HG* )  3.0  1.2  1.0 
assign (segid A and resid  29 and name   HB ) (segid A and resid  29 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  29 and name  HG* ) (segid A and resid  29 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  29 and name   HB ) (segid A and resid  30 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  29 and name  HG* ) (segid A and resid  30 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  29 and name  HG* ) (segid A and resid  30 and name   HB )  4.0  2.2  1.5 
assign (segid A and resid  29 and name   HA ) (segid A and resid  30 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  29 and name   HN ) (segid A and resid  30 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  29 and name   HA ) (segid A and resid  32 and name  HG# )  4.0  2.2  2.0 
assign (segid A and resid  29 and name   HA ) (segid A and resid  32 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  29 and name   HA ) (segid A and resid  32 and name  HB# )  3.0  1.2  0.3 
assign (segid A and resid  29 and name   HA ) (segid A and resid  33 and name   HN )  4.0  2.2  2.0 

! V30
assign (segid A and resid  30 and name   HA ) (segid A and resid  30 and name  HG* )  2.5  0.7  0.7 
assign (segid A and resid  30 and name  HG* ) (segid A and resid  30 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  30 and name   HB ) (segid A and resid  30 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  30 and name   HN ) (segid A and resid  31 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  30 and name   HA ) (segid A and resid  31 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  30 and name  HG* ) (segid A and resid  31 and name   HA )  4.0  2.2  2.5 
assign (segid A and resid  30 and name   HB ) (segid A and resid  31 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  30 and name  HG* ) (segid A and resid  31 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  30 and name   HA ) (segid A and resid  33 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  30 and name   HA ) (segid A and resid  33 and name  HB# )  4.0  2.2  1.0 
assign (segid A and resid  30 and name   HA ) (segid A and resid  33 and name  HD# )  4.0  2.2  1.5 
assign (segid A and resid  30 and name  HG* ) (segid A and resid  33 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  30 and name  HG* ) (segid A and resid  33 and name  HD# )  4.0  2.2  2.5 
assign (segid A and resid  30 and name   HA ) (segid A and resid  34 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid  30 and name  HG* ) (segid A and resid  34 and name  HD# )  4.0  2.2  2.0 
assign (segid A and resid  30 and name  HG* ) (segid A and resid  34 and name   HZ )  4.0  2.2  1.5 
assign (segid A and resid  30 and name  HG* ) (segid A and resid  34 and name  HE# )  4.0  2.2  2.0 

! K31
assign (segid A and resid  31 and name   HA ) (segid A and resid  31 and name  HG# )  4.0  2.2  1.0 
assign (segid A and resid  31 and name   HA ) (segid A and resid  31 and name  HD# )  4.0  2.2  1.0 
assign (segid A and resid  31 and name  HE# ) (segid A and resid  31 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid  31 and name  HE# ) (segid A and resid  31 and name  HB# )  4.0  2.2  1.0 
assign (segid A and resid  31 and name  HB# ) (segid A and resid  31 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  31 and name  HB# ) (segid A and resid  31 and name  HD# )  3.0  1.2  0.3 
assign (segid A and resid  31 and name  HD# ) (segid A and resid  31 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  31 and name  HG# ) (segid A and resid  31 and name  HE# )  4.0  2.2  1.0 
assign (segid A and resid  31 and name  HG# ) (segid A and resid  31 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  31 and name   HN ) (segid A and resid  32 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  31 and name  HG# ) (segid A and resid  32 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid  31 and name  HB# ) (segid A and resid  32 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid  31 and name  HB# ) (segid A and resid  32 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  31 and name  HD# ) (segid A and resid  32 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  31 and name   HA ) (segid A and resid  32 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  31 and name  HD# ) (segid A and resid  32 and name HE2# )  4.0  2.2  2.5 
assign (segid A and resid  31 and name   HA ) (segid A and resid  33 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  31 and name   HA ) (segid A and resid  34 and name  HB# )  4.0  2.2  1.0 
assign (segid A and resid  31 and name   HA ) (segid A and resid  34 and name  HD# )  4.0  2.2  1.5 
assign (segid A and resid  31 and name   HA ) (segid A and resid  34 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  31 and name   HA ) (segid A and resid  35 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid  31 and name  HG# ) (segid A and resid  35 and name HD2# )  4.0  2.2  1.5 
assign (segid A and resid  31 and name  HB# ) (segid A and resid  35 and name HD2# )  4.0  2.2  2.0 

! Q32
assign (segid A and resid  32 and name  HG# ) (segid A and resid  32 and name   HA )  3.0  1.2  0.3 
assign (segid A and resid  32 and name  HG# ) (segid A and resid  32 and name HE2# )  4.0  2.2  1.0 
assign (segid A and resid  32 and name  HG# ) (segid A and resid  32 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  32 and name  HB# ) (segid A and resid  32 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  32 and name  HB# ) (segid A and resid  32 and name HE2# )  4.0  2.2  1.5 
assign (segid A and resid  32 and name   HA ) (segid A and resid  32 and name HE2# )  4.0  2.2  2.0 
assign (segid A and resid  32 and name  HB# ) (segid A and resid  33 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid  32 and name   HA ) (segid A and resid  33 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  32 and name  HB# ) (segid A and resid  33 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  32 and name  HG# ) (segid A and resid  33 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  32 and name   HN ) (segid A and resid  33 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  32 and name   HA ) (segid A and resid  35 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  32 and name   HA ) (segid A and resid  35 and name HD2# )  4.0  2.2  1.0 
assign (segid A and resid  32 and name   HA ) (segid A and resid  35 and name  HB# )  3.0  1.2  0.3 
assign (segid A and resid  32 and name HE2# ) (segid A and resid  35 and name  HB# )  4.0  2.2  1.0 
assign (segid A and resid  32 and name   HA ) (segid A and resid  36 and name   HN )  4.0  2.2  1.0 

! F33
assign (segid A and resid  33 and name   HA ) (segid A and resid  33 and name  HD# )  3.0  1.2  0.8 
assign (segid A and resid  33 and name  HB# ) (segid A and resid  33 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  33 and name  HB# ) (segid A and resid  33 and name  HD# )  3.0  1.2  0.8 
assign (segid A and resid  33 and name  HD# ) (segid A and resid  33 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  33 and name   HA ) (segid A and resid  34 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  33 and name  HB# ) (segid A and resid  34 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  33 and name   HN ) (segid A and resid  34 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  33 and name  HD# ) (segid A and resid  34 and name  HD# )  3.0  1.2  1.3 
assign (segid A and resid  33 and name   HA ) (segid A and resid  36 and name  HB# )  4.0  2.2  1.0 
assign (segid A and resid  33 and name   HA ) (segid A and resid  36 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  33 and name   HA ) (segid A and resid  37 and name  HB# )  4.0  2.2  1.0 
assign (segid A and resid  33 and name   HA ) (segid A and resid  37 and name HD2# )  4.0  2.2  1.0 
assign (segid A and resid  33 and name   HA ) (segid A and resid  37 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  33 and name  HD# ) (segid A and resid  37 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid  33 and name  HD# ) (segid A and resid  37 and name HD2# )  4.0  2.2  1.5 
assign (segid A and resid  33 and name  HE# ) (segid A and resid  37 and name HD2# )  4.0  2.2  2.5 
assign (segid A and resid  33 and name  HD# ) (segid A and resid  54 and name  HG* )  4.0  2.2  2.0 
assign (segid A and resid  33 and name  HE# ) (segid A and resid  54 and name  HG* )  4.0  2.2  2.0 
assign (segid A and resid  33 and name  HD# ) (segid A and resid  56 and name  HB# )  4.0  2.2  1.5 
assign (segid A and resid  33 and name  HE# ) (segid A and resid  56 and name  HB# )  4.0  2.2  1.5 
assign (segid A and resid  33 and name   HZ ) (segid A and resid  56 and name  HB# )  4.0  2.2  1.0 
assign (segid A and resid  33 and name  HD# ) (segid A and resid  56 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  33 and name  HE# ) (segid A and resid  56 and name   HN )  4.0  2.2  1.5 

! F34
assign (segid A and resid  34 and name  HB# ) (segid A and resid  34 and name  HD# )  4.0  2.2  1.5 
assign (segid A and resid  34 and name  HB# ) (segid A and resid  34 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  34 and name   HA ) (segid A and resid  35 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  34 and name  HB# ) (segid A and resid  35 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid  34 and name  HB# ) (segid A and resid  35 and name  HB# )  4.0  2.2  2.0 
assign (segid A and resid  34 and name  HB# ) (segid A and resid  35 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  34 and name   HN ) (segid A and resid  35 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  34 and name   HA ) (segid A and resid  37 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  34 and name   HA ) (segid A and resid  37 and name  HB# )  4.0  2.2  2.0 
assign (segid A and resid  34 and name   HZ ) (segid A and resid  37 and name HD2# )  4.0  2.2  1.0 

! N35
assign (segid A and resid  35 and name   HA ) (segid A and resid  35 and name HD2# )  4.0  2.2  1.0 
assign (segid A and resid  35 and name  HB1 ) (segid A and resid  35 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  35 and name  HB2 ) (segid A and resid  35 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  35 and name  HB# ) (segid A and resid  35 and name HD2# )  4.0  2.2  1.0 
assign (segid A and resid  35 and name HD2# ) (segid A and resid  35 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid  35 and name  HB# ) (segid A and resid  36 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  35 and name   HN ) (segid A and resid  36 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  35 and name HD2# ) (segid A and resid  36 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  35 and name   HN ) (segid A and resid  37 and name   HN )  4.0  2.2  1.0 

! D36
assign (segid A and resid  36 and name  HB# ) (segid A and resid  36 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  36 and name   HA ) (segid A and resid  37 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  36 and name  HB# ) (segid A and resid  37 and name HD2# )  4.0  2.2  2.0 
assign (segid A and resid  36 and name  HB# ) (segid A and resid  37 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  36 and name   HN ) (segid A and resid  37 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  36 and name   HN ) (segid A and resid  37 and name HD2# )  4.0  2.2  1.0 
assign (segid A and resid  36 and name   HN ) (segid A and resid  38 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  36 and name  HB# ) (segid A and resid  38 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid  36 and name   HA ) (segid A and resid  39 and name   HN )  4.0  2.2  2.0 

! N37
assign (segid A and resid  37 and name  HB# ) (segid A and resid  37 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  37 and name  HB# ) (segid A and resid  37 and name HD2# )  4.0  2.2  1.0 
assign (segid A and resid  37 and name  HB# ) (segid A and resid  38 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  37 and name   HN ) (segid A and resid  38 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  37 and name   HA ) (segid A and resid  38 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  37 and name HD2# ) (segid A and resid  38 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid  37 and name  HB# ) (segid A and resid  43 and name  HE1 )  4.0  2.2  1.0 
assign (segid A and resid  37 and name  HB# ) (segid A and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid A and resid  37 and name HD2# ) (segid A and resid  54 and name  HG* )  4.0  2.2  2.5 
assign (segid A and resid  37 and name HD2# ) (segid A and resid  56 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid  37 and name HD2# ) (segid A and resid  56 and name  HG# )  4.0  2.2  1.5 

! G38
assign (segid A and resid  38 and name  HA# ) (segid A and resid  39 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  38 and name  HA# ) (segid A and resid  40 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  38 and name  HA# ) (segid A and resid  43 and name  HE1 )  4.0  2.2  2.0 
assign (segid A and resid  38 and name  HA# ) (segid A and resid  43 and name  HZ2 )  4.0  2.2  2.0 
assign (segid A and resid  38 and name  HA# ) (segid A and resid  54 and name  HG* )  4.0  2.2  2.5 

! V39
assign (segid A and resid  39 and name   HA ) (segid A and resid  39 and name  HG* )  2.5  0.7  0.7 
assign (segid A and resid  39 and name   HB ) (segid A and resid  39 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  39 and name  HG* ) (segid A and resid  39 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  39 and name   HA ) (segid A and resid  40 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  39 and name   HB ) (segid A and resid  40 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  39 and name  HG* ) (segid A and resid  40 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  39 and name   HN ) (segid A and resid  40 and name  HB# )  4.0  2.2  2.0 
assign (segid A and resid  39 and name   HN ) (segid A and resid  40 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  39 and name  HG* ) (segid A and resid  41 and name   HN )  4.0  2.2  1.5 

! D40
assign (segid A and resid  40 and name  HB# ) (segid A and resid  40 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  40 and name   HA ) (segid A and resid  41 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  40 and name  HB# ) (segid A and resid  41 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  40 and name   HN ) (segid A and resid  41 and name   HN )  3.0  1.2  0.5 

! G41
assign (segid A and resid  41 and name  HA# ) (segid A and resid  42 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  41 and name   HN ) (segid A and resid  42 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  41 and name  HA# ) (segid A and resid  43 and name  HD1 )  4.0  2.2  2.0 
assign (segid A and resid  41 and name  HA# ) (segid A and resid  43 and name  HE1 )  4.0  2.2  1.0 
assign (segid A and resid  41 and name   HN ) (segid A and resid  43 and name  HE1 )  4.0  2.2  1.0 

! E42
assign (segid A and resid  42 and name  HG# ) (segid A and resid  42 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid  42 and name  HG# ) (segid A and resid  42 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  42 and name  HB# ) (segid A and resid  42 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  42 and name   HA ) (segid A and resid  43 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  42 and name  HG# ) (segid A and resid  43 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  42 and name   HA ) (segid A and resid  43 and name  HB# )  4.0  2.2  2.0 
assign (segid A and resid  42 and name  HB# ) (segid A and resid  43 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  42 and name   HN ) (segid A and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid A and resid  42 and name  HB# ) (segid A and resid  55 and name   HB )  4.0  2.2  1.0 
assign (segid A and resid  42 and name  HB# ) (segid A and resid  55 and name   HN )  4.0  2.2  1.0 

! W43
assign (segid A and resid  43 and name  HB# ) (segid A and resid  43 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  43 and name   HA ) (segid A and resid  44 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  43 and name   HA ) (segid A and resid  44 and name HG2# )  4.0  2.2  2.5 
assign (segid A and resid  43 and name  HB# ) (segid A and resid  44 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  43 and name  HD1 ) (segid A and resid  44 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid  43 and name  HE3 ) (segid A and resid  44 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid  43 and name   HA ) (segid A and resid  52 and name  HD# )  4.0  2.2  2.5 
assign (segid A and resid  43 and name  HB# ) (segid A and resid  52 and name  HD# )  4.0  2.2  1.5 
assign (segid A and resid  43 and name  HZ3 ) (segid A and resid  52 and name  HD# )  4.0  2.2  1.5 
assign (segid A and resid  43 and name  HZ3 ) (segid A and resid  52 and name  HE# )  4.0  2.2  2.5 
assign (segid A and resid  43 and name   HA ) (segid A and resid  54 and name   HA )  3.0  1.2  0.3 
assign (segid A and resid  43 and name  HB# ) (segid A and resid  54 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid  43 and name   HA ) (segid A and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid A and resid  43 and name  HB# ) (segid A and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid A and resid  43 and name  HE1 ) (segid A and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid A and resid  43 and name  HZ2 ) (segid A and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid A and resid  43 and name  HZ3 ) (segid A and resid  54 and name  HG* )  4.0  2.2  2.5 
assign (segid A and resid  43 and name  HE3 ) (segid A and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid A and resid  43 and name  HD1 ) (segid A and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid A and resid  43 and name  HH2 ) (segid A and resid  54 and name  HG* )  4.0  2.2  2.5 
assign (segid A and resid  43 and name   HA ) (segid A and resid  55 and name   HN )  4.0  2.2  1.0 

! T44
assign (segid A and resid  44 and name   HB ) (segid A and resid  44 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  44 and name HG2# ) (segid A and resid  44 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  44 and name HG2# ) (segid A and resid  44 and name   HA )  2.5  0.7  0.7 
assign (segid A and resid  44 and name   HA ) (segid A and resid  45 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  44 and name HG2# ) (segid A and resid  45 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  44 and name   HB ) (segid A and resid  45 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  44 and name   HN ) (segid A and resid  52 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid  44 and name   HB ) (segid A and resid  53 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  44 and name HG2# ) (segid A and resid  53 and name   HB )  4.0  2.2  1.5 
assign (segid A and resid  44 and name HG2# ) (segid A and resid  53 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  44 and name   HN ) (segid A and resid  53 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  44 and name   HN ) (segid A and resid  53 and name   HB )  4.0  2.2  1.0 
assign (segid A and resid  44 and name   HN ) (segid A and resid  53 and name HG2# )  4.0  2.2  2.5 
assign (segid A and resid  44 and name   HN ) (segid A and resid  54 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid  44 and name   HN ) (segid A and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid A and resid  44 and name   HN ) (segid A and resid  55 and name   HN )  4.0  2.2  1.0 

! Y45
assign (segid A and resid  45 and name  HB# ) (segid A and resid  45 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  45 and name   HA ) (segid A and resid  46 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  45 and name  HE# ) (segid A and resid  46 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  45 and name  HB# ) (segid A and resid  46 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  45 and name   HN ) (segid A and resid  46 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  45 and name  HE# ) (segid A and resid  47 and name   HA )  3.0  1.2  0.8 
assign (segid A and resid  45 and name  HE# ) (segid A and resid  47 and name  HB# )  4.0  2.2  1.5 
assign (segid A and resid  45 and name  HE# ) (segid A and resid  47 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  45 and name  HE# ) (segid A and resid  50 and name   HA )  3.0  1.2  0.8 
assign (segid A and resid  45 and name  HE# ) (segid A and resid  50 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  45 and name  HE# ) (segid A and resid  51 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  45 and name   HA ) (segid A and resid  52 and name   HA )  3.0  1.2  0.3 
assign (segid A and resid  45 and name  HB# ) (segid A and resid  52 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid  45 and name  HB# ) (segid A and resid  52 and name  HE# )  3.0  1.2  0.8 
assign (segid A and resid  45 and name  HB# ) (segid A and resid  52 and name  HD# )  3.0  1.2  0.8 
assign (segid A and resid  45 and name   HN ) (segid A and resid  52 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid  45 and name   HA ) (segid A and resid  53 and name   HN )  3.0  1.2  0.5 

! D46
assign (segid A and resid  46 and name  HB# ) (segid A and resid  46 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  46 and name   HA ) (segid A and resid  47 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  46 and name  HB# ) (segid A and resid  47 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  46 and name   HA ) (segid A and resid  47 and name  HB# )  4.0  2.2  1.0 
assign (segid A and resid  46 and name   HN ) (segid A and resid  47 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  46 and name   HA ) (segid A and resid  48 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  46 and name  HB# ) (segid A and resid  48 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  46 and name  HB# ) (segid A and resid  49 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  46 and name  HB# ) (segid A and resid  51 and name   HB )  4.0  2.2  1.0 
assign (segid A and resid  46 and name  HB# ) (segid A and resid  51 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  46 and name  HB# ) (segid A and resid  51 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid  46 and name   HN ) (segid A and resid  51 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid  46 and name   HN ) (segid A and resid  51 and name   HB )  4.0  2.2  1.0 
assign (segid A and resid  46 and name   HN ) (segid A and resid  51 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  46 and name   HN ) (segid A and resid  52 and name   HA )  3.0  1.2  0.5 
assign (segid A and resid  46 and name   HN ) (segid A and resid  53 and name   HN )  4.0  2.2  1.0 

! D47
assign (segid A and resid  47 and name   HA ) (segid A and resid  47 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  47 and name  HB# ) (segid A and resid  47 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  47 and name   HA ) (segid A and resid  48 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  47 and name  HB# ) (segid A and resid  48 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  47 and name  HB# ) (segid A and resid  48 and name  HB# )  4.0  2.2  2.5 
assign (segid A and resid  47 and name   HN ) (segid A and resid  48 and name  HB# )  4.0  2.2  2.5 
assign (segid A and resid  47 and name   HN ) (segid A and resid  48 and name   HN )  3.0  1.2  0.7 
assign (segid A and resid  47 and name   HA ) (segid A and resid  49 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  47 and name   HN ) (segid A and resid  49 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  47 and name   HA ) (segid A and resid  50 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  47 and name   HA ) (segid A and resid  50 and name  HD# )  4.0  2.2  1.0 

! A48
assign (segid A and resid  48 and name   HN ) (segid A and resid  48 and name   HA )  2.5  0.7  0.4 
assign (segid A and resid  48 and name  HB# ) (segid A and resid  48 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  48 and name   HN ) (segid A and resid  49 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid  48 and name  HB# ) (segid A and resid  49 and name   HA )  4.0  2.2  1.5 
assign (segid A and resid  48 and name   HA ) (segid A and resid  49 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  48 and name  HB# ) (segid A and resid  49 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  48 and name   HN ) (segid A and resid  49 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid  48 and name   HN ) (segid A and resid  49 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  48 and name   HA ) (segid A and resid  50 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  48 and name  HB# ) (segid A and resid  50 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  48 and name   HN ) (segid A and resid  50 and name   HN )  4.0  2.2  1.0 

! T49
assign (segid A and resid  49 and name   HA ) (segid A and resid  49 and name HG2# )  2.5  0.7  0.7 
assign (segid A and resid  49 and name HG2# ) (segid A and resid  49 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  49 and name   HB ) (segid A and resid  50 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid  49 and name   HA ) (segid A and resid  50 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  49 and name HG2# ) (segid A and resid  50 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  49 and name   HA ) (segid A and resid  50 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  49 and name   HN ) (segid A and resid  50 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  49 and name   HN ) (segid A and resid  51 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  49 and name   HN ) (segid A and resid  51 and name   HB )  4.0  2.2  2.0 

! K50
assign (segid A and resid  50 and name   HA ) (segid A and resid  50 and name  HG# )  3.0  1.2  0.3 
assign (segid A and resid  50 and name   HA ) (segid A and resid  50 and name  HD# )  3.0  1.2  0.3 
assign (segid A and resid  50 and name  HB# ) (segid A and resid  50 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  50 and name  HG# ) (segid A and resid  50 and name  HE# )  4.0  2.2  2.0 
assign (segid A and resid  50 and name  HG# ) (segid A and resid  50 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  50 and name  HD# ) (segid A and resid  50 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  50 and name   HA ) (segid A and resid  51 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  50 and name   HN ) (segid A and resid  51 and name   HB )  4.0  2.2  2.0 
assign (segid A and resid  50 and name   HN ) (segid A and resid  51 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  50 and name  HB# ) (segid A and resid  51 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  50 and name  HD# ) (segid A and resid  51 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid  50 and name  HG# ) (segid A and resid  51 and name   HN )  4.0  2.2  1.0 

! T51
assign (segid A and resid  51 and name   HB ) (segid A and resid  51 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  51 and name   HA ) (segid A and resid  51 and name  HG1 )  4.0  2.2  1.0 
assign (segid A and resid  51 and name   HA ) (segid A and resid  51 and name HG2# )  2.5  0.7  0.7 
assign (segid A and resid  51 and name HG2# ) (segid A and resid  51 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  51 and name  HG1 ) (segid A and resid  51 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  51 and name   HB ) (segid A and resid  52 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  51 and name   HA ) (segid A and resid  52 and name  HD# )  4.0  2.2  1.5 
assign (segid A and resid  51 and name   HA ) (segid A and resid  52 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  51 and name   HA ) (segid A and resid  52 and name  HB# )  4.0  2.2  2.0 
assign (segid A and resid  51 and name HG2# ) (segid A and resid  52 and name   HA )  4.0  2.2  1.5 
assign (segid A and resid  51 and name HG2# ) (segid A and resid  52 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  51 and name   HN ) (segid A and resid  52 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  51 and name   HN ) (segid A and resid  52 and name   HA )  4.0  2.2  2.0 

! F52
assign (segid A and resid  52 and name   HA ) (segid A and resid  52 and name  HD# )  4.0  2.2  1.5 
assign (segid A and resid  52 and name  HB# ) (segid A and resid  52 and name  HD# )  3.0  1.2  0.8 
assign (segid A and resid  52 and name  HB# ) (segid A and resid  52 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  52 and name  HB# ) (segid A and resid  52 and name  HE# )  4.0  2.2  2.5 
assign (segid A and resid  52 and name  HE# ) (segid A and resid  52 and name   HN )  4.0  2.2  2.5 
assign (segid A and resid  52 and name  HD# ) (segid A and resid  52 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  52 and name   HA ) (segid A and resid  53 and name   HB )  4.0  2.2  2.0 
assign (segid A and resid  52 and name   HA ) (segid A and resid  53 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  52 and name  HB# ) (segid A and resid  53 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  52 and name   HN ) (segid A and resid  53 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  52 and name  HD# ) (segid A and resid  53 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  52 and name  HB# ) (segid A and resid  54 and name  HG* )  4.0  2.2  2.5 

! T53
assign (segid A and resid  53 and name   HB ) (segid A and resid  53 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  53 and name   HA ) (segid A and resid  53 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid  53 and name HG2# ) (segid A and resid  53 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  53 and name   HB ) (segid A and resid  54 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  53 and name   HA ) (segid A and resid  54 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  53 and name HG2# ) (segid A and resid  54 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  53 and name   HN ) (segid A and resid  54 and name  HG* )  4.0  2.2  2.5 
assign (segid A and resid  53 and name HG2# ) (segid A and resid  55 and name   HN )  4.0  2.2  2.5 

! V54
assign (segid A and resid  54 and name   HA ) (segid A and resid  54 and name  HG* )  3.0  1.2  0.8 
assign (segid A and resid  54 and name   HB ) (segid A and resid  54 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  54 and name  HG* ) (segid A and resid  54 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  54 and name   HA ) (segid A and resid  55 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  54 and name  HG* ) (segid A and resid  55 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid  54 and name   HN ) (segid A and resid  55 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  54 and name   HB ) (segid A and resid  55 and name   HN )  4.0  2.2  1.0 

! T55
assign (segid A and resid  55 and name   HB ) (segid A and resid  55 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid  55 and name   HA ) (segid A and resid  55 and name HG2# )  3.0  1.2  0.8 
assign (segid A and resid  55 and name HG2# ) (segid A and resid  55 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  55 and name   HB ) (segid A and resid  56 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  55 and name   HA ) (segid A and resid  56 and name   HN )  2.5  0.7  0.4 
assign (segid A and resid  55 and name HG2# ) (segid A and resid  56 and name   HA )  4.0  2.2  1.5 
assign (segid A and resid  55 and name   HA ) (segid A and resid  56 and name  HG# )  4.0  2.2  2.5 
assign (segid A and resid  55 and name HG2# ) (segid A and resid  56 and name   HN )  3.0  1.2  1.0 
assign (segid A and resid  55 and name   HN ) (segid A and resid  56 and name   HN )  4.0  2.2  1.0 

! E56
assign (segid A and resid  56 and name   HA ) (segid A and resid  56 and name  HG# )  3.0  1.2  0.5 
assign (segid A and resid  56 and name  HG# ) (segid A and resid  56 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  56 and name  HB# ) (segid A and resid  56 and name   HN )  3.0  1.2  0.5 


!MONOMER UNIT B
! M1
assign (segid B and resid   1 and name   HA ) (segid B and resid   1 and name  HB# )  4.0  2.2  1.0 
assign (segid B and resid   1 and name   HA ) (segid B and resid   1 and name  HG# )  4.0  2.2  1.0 
assign (segid B and resid   1 and name   HA ) (segid B and resid   1 and name  HE# )  4.0  2.2  1.5 
assign (segid B and resid   1 and name   HA ) (segid B and resid   2 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid   1 and name  HB# ) (segid B and resid   2 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   1 and name  HG# ) (segid B and resid   2 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   1 and name  HE# ) (segid B and resid   2 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid   1 and name  HB1 ) (segid B and resid   3 and name  HE# )  3.0  1.2  0.8 
assign (segid B and resid   1 and name  HB2 ) (segid B and resid   3 and name  HE# )  3.0  1.2  0.8 
assign (segid B and resid   1 and name  HG1 ) (segid B and resid   3 and name  HE# )  4.0  2.2  1.5 
assign (segid B and resid   1 and name  HG2 ) (segid B and resid   3 and name  HE# )  4.0  2.2  1.5 
assign (segid B and resid   1 and name  HE# ) (segid B and resid   3 and name  HE# )  4.0  2.2  3.0 
 
! Q2
assign (segid B and resid   2 and name   HA ) (segid B and resid   2 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid   2 and name  HG# ) (segid B and resid   2 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   2 and name  HG# ) (segid B and resid   2 and name HE2# )  4.0  2.2  1.0 
assign (segid B and resid   2 and name  HG# ) (segid B and resid   2 and name   HA )  3.0  1.2  0.3 
assign (segid B and resid   2 and name  HB# ) (segid B and resid   2 and name   HN )  3.0  1.2  0.3 
assign (segid B and resid   2 and name   HA ) (segid B and resid   3 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid   2 and name  HG# ) (segid B and resid   3 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid   2 and name  HB1 ) (segid B and resid   3 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   2 and name  HB2 ) (segid B and resid   3 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   2 and name   HN ) (segid B and resid   3 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   2 and name  HG# ) (segid B and resid  17 and name   HB )  4.0  2.2  1.0 
assign (segid B and resid   2 and name HE2# ) (segid B and resid  17 and name   HB )  4.0  2.2  2.5 
assign (segid B and resid   2 and name  HG# ) (segid B and resid  17 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid   2 and name  HB# ) (segid B and resid  17 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid   2 and name HE2# ) (segid B and resid  17 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid   2 and name  HG# ) (segid B and resid  18 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid   2 and name   HA ) (segid B and resid  19 and name   HA )  2.5  0.7  0.2 
assign (segid B and resid   2 and name  HG# ) (segid B and resid  19 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid   2 and name HE2# ) (segid B and resid  19 and name  HB# )  4.0  2.2  2.0 
assign (segid B and resid   2 and name   HN ) (segid B and resid  19 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid   2 and name   HA ) (segid B and resid  20 and name   HN )  4.0  2.2  1.0 

! Y3
assign (segid B and resid   3 and name   HA ) (segid B and resid   3 and name  HD# )  3.0  1.2  0.8 
assign (segid B and resid   3 and name   HA ) (segid B and resid   3 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   3 and name  HB# ) (segid B and resid   3 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid   3 and name  HD# ) (segid B and resid   3 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid   3 and name  HB# ) (segid B and resid   3 and name  HD# )  3.0  1.2  0.8 
assign (segid B and resid   3 and name   HA ) (segid B and resid   4 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid   3 and name  HB# ) (segid B and resid   4 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   3 and name  HD# ) (segid B and resid   4 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid   3 and name   HN ) (segid B and resid   4 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid   3 and name   HN ) (segid B and resid  17 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid   3 and name   HN ) (segid B and resid  17 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid   3 and name   HA ) (segid B and resid  18 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid   3 and name  HB# ) (segid B and resid  18 and name HG2# )  3.0  1.2  0.8 
assign (segid B and resid   3 and name  HD# ) (segid B and resid  18 and name HG2# )  3.0  1.2  1.3 
assign (segid B and resid   3 and name   HN ) (segid B and resid  18 and name HG2# )  3.0  1.2  1.0 
assign (segid B and resid   3 and name   HN ) (segid B and resid  18 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid   3 and name  HB# ) (segid B and resid  18 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   3 and name  HD# ) (segid B and resid  19 and name   HA )  4.0  2.2  1.5 
assign (segid B and resid   3 and name  HE# ) (segid B and resid  19 and name   HA )  4.0  2.2  1.5 
assign (segid B and resid   3 and name   HN ) (segid B and resid  19 and name   HA )  3.0  1.2  0.5 
assign (segid B and resid   3 and name  HD# ) (segid B and resid  20 and name  HB# )  3.0  1.2  1.3 
assign (segid B and resid   3 and name  HE# ) (segid B and resid  20 and name  HB# )  3.0  1.2  1.3 
assign (segid B and resid   3 and name  HE# ) (segid B and resid  20 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid   3 and name  HD# ) (segid B and resid  20 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid   3 and name  HD# ) (segid B and resid  23 and name   HA )  4.0  2.2  1.5 
assign (segid B and resid   3 and name  HE# ) (segid B and resid  23 and name   HA )  4.0  2.2  1.5 
assign (segid B and resid   3 and name  HE# ) (segid B and resid  23 and name  HB# )  3.0  1.2  1.3 
assign (segid B and resid   3 and name  HD# ) (segid B and resid  23 and name  HB# )  4.0  2.2  2.0 
assign (segid B and resid   3 and name  HE# ) (segid B and resid  23 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid   3 and name  HD# ) (segid B and resid  23 and name   HN )  4.0  2.2  2.5 
assign (segid B and resid   3 and name  HB# ) (segid B and resid  26 and name  HB# )  3.0  1.2  0.8 

! K4
assign (segid B and resid   4 and name   HA ) (segid B and resid   4 and name  HG# )  3.0  1.2  0.3 
assign (segid B and resid   4 and name   HA ) (segid B and resid   4 and name  HD# )  4.0  2.2  1.0 
assign (segid B and resid   4 and name  HE# ) (segid B and resid   4 and name  HB# )  4.0  2.2  1.5 
assign (segid B and resid   4 and name   HA ) (segid B and resid   4 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid   4 and name  HB# ) (segid B and resid   4 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid   4 and name  HG# ) (segid B and resid   4 and name  HE# )  4.0  2.2  2.0 
assign (segid B and resid   4 and name  HG# ) (segid B and resid   4 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   4 and name   HA ) (segid B and resid   5 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid   4 and name   HA ) (segid B and resid   5 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid   4 and name  HB# ) (segid B and resid   5 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   4 and name  HG# ) (segid B and resid   5 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid   4 and name   HN ) (segid B and resid   5 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   4 and name  HB# ) (segid B and resid   6 and name HD1# )  4.0  2.2  2.0 
assign (segid B and resid   4 and name  HE# ) (segid B and resid   6 and name HD1# )  4.0  2.2  2.5 
assign (segid B and resid   4 and name   HA ) (segid B and resid  16 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   4 and name   HA ) (segid B and resid  17 and name   HA )  3.0  1.2  0.3 
assign (segid B and resid   4 and name  HG# ) (segid B and resid  17 and name   HB )  4.0  2.2  2.0 
assign (segid B and resid   4 and name  HB# ) (segid B and resid  17 and name   HA )  4.0  2.2  2.5 
assign (segid B and resid   4 and name  HG# ) (segid B and resid  17 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid   4 and name   HA ) (segid B and resid  17 and name HG2# )  3.0  1.2  0.8 
assign (segid B and resid   4 and name   HA ) (segid B and resid  18 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   4 and name  HB# ) (segid B and resid  18 and name   HN )  4.0  2.2  2.5 

! V5
assign (segid B and resid   5 and name   HA ) (segid B and resid   5 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid   5 and name  HG* ) (segid B and resid   5 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid   5 and name   HB ) (segid B and resid   5 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid   5 and name   HA ) (segid B and resid   6 and name HG1# )  4.0  2.2  2.0 
assign (segid B and resid   5 and name   HA ) (segid B and resid   6 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid   5 and name  HG* ) (segid B and resid   6 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid   5 and name   HA ) (segid B and resid   6 and name HD1# )  4.0  2.2  2.5 
assign (segid B and resid   5 and name  HG* ) (segid B and resid   7 and name   HG )  4.0  2.2  1.5 
assign (segid B and resid   5 and name  HG* ) (segid B and resid   7 and name   HD* )  3.0  1.2  1.3 
assign (segid B and resid   5 and name  HG* ) (segid B and resid   7 and name   HN )  4.0  2.2  2.5 
assign (segid B and resid   5 and name   HN ) (segid B and resid  15 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid   5 and name   HB ) (segid B and resid  16 and name   HB )  4.0  2.2  1.0 
assign (segid B and resid   5 and name  HG* ) (segid B and resid  16 and name   HB )  4.0  2.2  1.5 
assign (segid B and resid   5 and name   HB ) (segid B and resid  16 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid   5 and name   HB ) (segid B and resid  16 and name  HG1 )  4.0  2.2  1.0 
assign (segid B and resid   5 and name  HG* ) (segid B and resid  16 and name  HG1 )  4.0  2.2  1.5 
assign (segid B and resid   5 and name  HG* ) (segid B and resid  16 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid   5 and name   HN ) (segid B and resid  16 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid   5 and name   HN ) (segid B and resid  16 and name  HG1 )  4.0  2.2  1.0 
assign (segid B and resid   5 and name   HN ) (segid B and resid  17 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid   5 and name   HN ) (segid B and resid  17 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid   5 and name   HB ) (segid B and resid  18 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid   5 and name   HA ) (segid B and resid  30 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid   5 and name   HB ) (segid B and resid  30 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid   5 and name  HG* ) (segid B and resid  33 and name  HB# )  4.0  2.2  2.5 
assign (segid B and resid   5 and name  HG* ) (segid B and resid  34 and name  HE# )  4.0  2.2  3.0 
assign (segid B and resid   5 and name  HG* ) (segid B and resid  34 and name   HZ )  4.0  2.2  2.5 

! I6
assign (segid B and resid   6 and name   HA ) (segid B and resid   6 and name HG1# )  3.0  1.2  0.3 
assign (segid B and resid   6 and name   HA ) (segid B and resid   6 and name HD1# )  4.0  2.2  1.5 
assign (segid B and resid   6 and name   HB ) (segid B and resid   6 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid   6 and name HG1# ) (segid B and resid   6 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid   6 and name HG2# ) (segid B and resid   6 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid   6 and name HG2# ) (segid B and resid   6 and name   HA )  3.0  1.2  0.8 
assign (segid B and resid   6 and name HD1# ) (segid B and resid   6 and name   HN )  4.0  2.2  2.5 
assign (segid B and resid   6 and name HD1# ) (segid B and resid   6 and name   HB )  3.0  1.2  0.8 
assign (segid B and resid   6 and name   HA ) (segid B and resid   7 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid   6 and name   HB ) (segid B and resid   7 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   6 and name HG1# ) (segid B and resid   7 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid   6 and name   HA ) (segid B and resid   7 and name  HD* )  4.0  2.2  2.5 
assign (segid B and resid   6 and name HG2# ) (segid B and resid   7 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid   6 and name HD1# ) (segid B and resid   7 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid   6 and name   HN ) (segid B and resid   7 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   6 and name HG2# ) (segid B and resid   8 and name  HB# )  4.0  2.2  1.5 
assign (segid B and resid   6 and name HG2# ) (segid B and resid   8 and name HD21 )  4.0  2.2  1.5 
assign (segid B and resid   6 and name HG2# ) (segid B and resid   8 and name   HA )  4.0  2.2  1.5 
assign (segid B and resid   6 and name HG2# ) (segid B and resid   8 and name HD22 )  4.0  2.2  1.5 
assign (segid B and resid   6 and name   HA ) (segid B and resid  15 and name  HG# )  4.0  2.2  1.0 
assign (segid B and resid   6 and name   HA ) (segid B and resid  15 and name   HA )  2.5  0.7  0.2 
assign (segid B and resid   6 and name HG2# ) (segid B and resid  15 and name   HA )  4.0  2.2  1.5 
assign (segid B and resid   6 and name HD1# ) (segid B and resid  15 and name   HA )  4.0  2.2  1.5 
assign (segid B and resid   6 and name HD1# ) (segid B and resid  15 and name  HG# )  3.0  1.2  0.8 
assign (segid B and resid   6 and name   HA ) (segid B and resid  15 and name  HB# )  4.0  2.2  2.0 
assign (segid B and resid   6 and name   HA ) (segid B and resid  16 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   6 and name HD1# ) (segid B and resid  16 and name   HN )  4.0  2.2  2.5 

! L7
assign (segid B and resid   7 and name  HB# ) (segid B and resid   7 and name  HD* )  3.0  1.2  0.8 
assign (segid B and resid   7 and name  HB# ) (segid B and resid   7 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid   7 and name   HG ) (segid B and resid   7 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid   7 and name   HG ) (segid B and resid   7 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid   7 and name  HD* ) (segid B and resid   7 and name   HA )  3.0  1.2  0.8 
assign (segid B and resid   7 and name  HD* ) (segid B and resid   7 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid   7 and name   HA ) (segid B and resid   8 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid   7 and name  HB# ) (segid B and resid   8 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   7 and name   HG ) (segid B and resid   8 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid   7 and name  HD* ) (segid B and resid   8 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid   7 and name   HN ) (segid B and resid   8 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   7 and name  HB1 ) (segid B and resid  12 and name  HD* )  4.0  2.2  1.5 
assign (segid B and resid   7 and name  HB2 ) (segid B and resid  12 and name  HD* )  4.0  2.2  1.5 
assign (segid B and resid   7 and name  HD* ) (segid B and resid  12 and name  HD* )  3.0  1.2  1.3 
assign (segid B and resid   7 and name  HB# ) (segid B and resid  13 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid   7 and name   HN ) (segid B and resid  13 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid   7 and name  HB# ) (segid B and resid  14 and name  HA# )  4.0  2.2  1.0 
assign (segid B and resid   7 and name  HD* ) (segid B and resid  14 and name  HA# )  4.0  2.2  1.5 
assign (segid B and resid   7 and name  HB# ) (segid B and resid  14 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid   7 and name  HD* ) (segid B and resid  14 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid   7 and name  HD* ) (segid B and resid  15 and name   HA )  4.0  2.2  1.5 
assign (segid B and resid   7 and name   HG ) (segid B and resid  15 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid   7 and name  HD* ) (segid B and resid  15 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid   7 and name   HN ) (segid B and resid  15 and name   HA )  3.0  1.2  0.5 
assign (segid B and resid   7 and name  HD* ) (segid B and resid  16 and name   HB )  4.0  2.2  1.5 
assign (segid B and resid   7 and name  HD* ) (segid B and resid  16 and name   HA )  4.0  2.2  2.5 
assign (segid B and resid   7 and name  HD* ) (segid B and resid  16 and name  HG1 )  4.0  2.2  1.5 
assign (segid B and resid   7 and name  HB# ) (segid B and resid  33 and name  HD# )  4.0  2.2  2.5 
assign (segid B and resid   7 and name  HB# ) (segid B and resid  33 and name  HE# )  4.0  2.2  2.5 
assign (segid B and resid   7 and name  HD* ) (segid B and resid  33 and name  HD# )  3.0  1.2  1.3 
assign (segid B and resid   7 and name  HD* ) (segid B and resid  33 and name  HE# )  3.0  1.2  1.3 
assign (segid B and resid   7 and name  HB# ) (segid B and resid  34 and name  HE# )  4.0  2.2  1.5 
assign (segid B and resid   7 and name  HB# ) (segid B and resid  34 and name   HZ )  4.0  2.2  1.0 
assign (segid B and resid   7 and name   HG ) (segid B and resid  34 and name  HE# )  4.0  2.2  1.5 
assign (segid B and resid   7 and name  HD* ) (segid B and resid  34 and name  HE# )  3.0  1.2  1.3 
assign (segid B and resid   7 and name  HD* ) (segid B and resid  34 and name   HZ )  3.0  1.2  0.8 
assign (segid B and resid   7 and name  HD* ) (segid B and resid  34 and name  HD# )  4.0  2.2  2.0 

! N8
assign (segid B and resid   8 and name  HB# ) (segid B and resid   8 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid   8 and name   HN ) (segid B and resid   8 and name HD2# )  4.0  2.2  2.0 
assign (segid B and resid   8 and name  HB# ) (segid B and resid   8 and name HD2# )  4.0  2.2  1.0 
assign (segid B and resid   8 and name   HA ) (segid B and resid   8 and name HD2# )  4.0  2.2  2.0 
assign (segid B and resid   8 and name   HA ) (segid B and resid   9 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid   8 and name  HB# ) (segid B and resid   9 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   8 and name   HN ) (segid B and resid   9 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   8 and name   HA ) (segid B and resid  12 and name  HD* )  4.0  2.2  1.5 
assign (segid B and resid   8 and name   HA ) (segid B and resid  13 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid   8 and name   HA ) (segid B and resid  13 and name  HD# )  4.0  2.2  1.0 
assign (segid B and resid   8 and name   HA ) (segid B and resid  13 and name  HG# )  4.0  2.2  1.0 
assign (segid B and resid   8 and name HD2# ) (segid B and resid  13 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid   8 and name   HA ) (segid B and resid  14 and name   HN )  4.0  2.2  1.0 

! G9
assign (segid B and resid   9 and name  HA# ) (segid B and resid  10 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid   9 and name   HN ) (segid B and resid  10 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   9 and name  HA# ) (segid B and resid  11 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   9 and name   HN ) (segid B and resid  11 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid   9 and name  HA# ) (segid B and resid  12 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid   9 and name  HA# ) (segid B and resid  12 and name   HG )  4.0  2.2  1.0 
assign (segid B and resid   9 and name   HN ) (segid B and resid  12 and name  HB# )  4.0  2.2  1.5 
assign (segid B and resid   9 and name  HA# ) (segid B and resid  12 and name  HD* )  4.0  2.2  1.5 
assign (segid B and resid   9 and name   HN ) (segid B and resid  12 and name  HD* )  4.0  2.2  1.5 
assign (segid B and resid   9 and name   HN ) (segid B and resid  12 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   9 and name   HN ) (segid B and resid  13 and name   HA )  3.0  1.2  0.5 
assign (segid B and resid   9 and name   HN ) (segid B and resid  13 and name  HD# )  4.0  2.2  1.0 
assign (segid B and resid   9 and name   HN ) (segid B and resid  13 and name  HG# )  4.0  2.2  1.0 

! K10
assign (segid B and resid  10 and name   HA ) (segid B and resid  10 and name  HG# )  3.0  1.2  0.3 
assign (segid B and resid  10 and name  HB# ) (segid B and resid  10 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  10 and name  HD# ) (segid B and resid  10 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid  10 and name  HD# ) (segid B and resid  10 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid  10 and name  HG# ) (segid B and resid  10 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  10 and name  HG# ) (segid B and resid  11 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid  10 and name   HA ) (segid B and resid  11 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  10 and name   HA ) (segid B and resid  11 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid  10 and name  HB# ) (segid B and resid  11 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid  10 and name  HB# ) (segid B and resid  11 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  10 and name   HN ) (segid B and resid  11 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  10 and name  HG# ) (segid B and resid  11 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  10 and name   HA ) (segid B and resid  12 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  10 and name  HB# ) (segid B and resid  12 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  10 and name   HN ) (segid B and resid  12 and name   HN )  4.0  2.2  1.0 

! T11
assign (segid B and resid  11 and name   HA ) (segid B and resid  11 and name HG2# )  2.5  0.7  0.7 
assign (segid B and resid  11 and name HG2# ) (segid B and resid  11 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  11 and name   HB ) (segid B and resid  12 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid  11 and name   HA ) (segid B and resid  12 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  11 and name HG2# ) (segid B and resid  12 and name   HN )  4.0  2.2  2.5 
assign (segid B and resid  11 and name   HN ) (segid B and resid  12 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  11 and name   HN ) (segid B and resid  12 and name  HD* )  4.0  2.2  1.5 

! L12
assign (segid B and resid  12 and name   HA ) (segid B and resid  12 and name  HD* )  4.0  2.2  1.5 
assign (segid B and resid  12 and name  HB# ) (segid B and resid  12 and name  HD* )  3.0  1.2  0.8 
assign (segid B and resid  12 and name  HB# ) (segid B and resid  12 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  12 and name   HG ) (segid B and resid  12 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid  12 and name   HG ) (segid B and resid  12 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  12 and name   HA ) (segid B and resid  13 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  12 and name  HD* ) (segid B and resid  13 and name   HA )  4.0  2.2  1.5 
assign (segid B and resid  12 and name  HB# ) (segid B and resid  13 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  12 and name   HG ) (segid B and resid  13 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid  12 and name  HD1#) (segid B and resid  13 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  12 and name  HD2#) (segid B and resid  13 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  12 and name   HN ) (segid B and resid  13 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  12 and name  HD* ) (segid B and resid  14 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  12 and name  HD* ) (segid B and resid  34 and name  HD# )  4.0  2.2  3.0 
assign (segid B and resid  12 and name  HD* ) (segid B and resid  34 and name  HE# )  4.0  2.2  2.0 
assign (segid B and resid  12 and name  HD* ) (segid B and resid  34 and name   HZ )  4.0  2.2  2.5 

! K13
assign (segid B and resid  13 and name   HA ) (segid B and resid  13 and name  HG# )  3.0  1.2  0.3 
assign (segid B and resid  13 and name  HB# ) (segid B and resid  13 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  13 and name  HD# ) (segid B and resid  13 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid  13 and name  HG# ) (segid B and resid  13 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  13 and name   HA ) (segid B and resid  14 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  13 and name  HB# ) (segid B and resid  14 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  13 and name  HG# ) (segid B and resid  14 and name   HN )  4.0  2.2  1.0 

! G14
assign (segid B and resid  14 and name  HA# ) (segid B and resid  15 and name   HN )  2.5  0.7  0.4 

! E15
assign (segid B and resid  15 and name  HG# ) (segid B and resid  15 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  15 and name  HG# ) (segid B and resid  15 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid  15 and name  HB# ) (segid B and resid  15 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  15 and name   HA ) (segid B and resid  16 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  15 and name   HA ) (segid B and resid  16 and name  HG1 )  4.0  2.2  2.0 
assign (segid B and resid  15 and name  HG# ) (segid B and resid  16 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  15 and name  HB# ) (segid B and resid  16 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  15 and name   HN ) (segid B and resid  16 and name   HN )  4.0  2.2  1.0 

! T16
assign (segid B and resid  16 and name   HB ) (segid B and resid  16 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  16 and name   HA ) (segid B and resid  16 and name HG2# )  3.0  1.2  0.8 
assign (segid B and resid  16 and name   HA ) (segid B and resid  16 and name  HG1 )  4.0  2.2  1.0 
assign (segid B and resid  16 and name HG2# ) (segid B and resid  16 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  16 and name  HG1 ) (segid B and resid  16 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  16 and name   HB ) (segid B and resid  17 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  16 and name   HA ) (segid B and resid  17 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  16 and name HG2# ) (segid B and resid  17 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  16 and name  HG1 ) (segid B and resid  17 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  16 and name HG2# ) (segid B and resid  30 and name  HG* )  3.0  1.2  1.3 
assign (segid B and resid  16 and name HG2# ) (segid B and resid  34 and name  HE# )  4.0  2.2  2.0 
assign (segid B and resid  16 and name HG2# ) (segid B and resid  34 and name   HZ )  4.0  2.2  1.5 

! T17
assign (segid B and resid  17 and name   HB ) (segid B and resid  17 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  17 and name   HA ) (segid B and resid  17 and name HG2# )  2.5  0.7  0.7 
assign (segid B and resid  17 and name HG2# ) (segid B and resid  17 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  17 and name   HB ) (segid B and resid  18 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  17 and name   HA ) (segid B and resid  18 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid  17 and name   HA ) (segid B and resid  18 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  17 and name HG2# ) (segid B and resid  18 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  17 and name   HA ) (segid B and resid  30 and name  HG* )  4.0  2.2  1.5 

! T18
assign (segid B and resid  18 and name   HB ) (segid B and resid  18 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  18 and name   HA ) (segid B and resid  18 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid  18 and name HG2# ) (segid B and resid  18 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  18 and name   HB ) (segid B and resid  19 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  18 and name   HA ) (segid B and resid  19 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  18 and name   HA ) (segid B and resid  19 and name  HB# )  4.0  2.2  1.0 
assign (segid B and resid  18 and name HG2# ) (segid B and resid  19 and name   HA )  4.0  2.2  1.5 
assign (segid B and resid  18 and name HG2# ) (segid B and resid  19 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  18 and name   HN ) (segid B and resid  19 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  18 and name  HG1 ) (segid B and resid  19 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  18 and name HG2# ) (segid B and resid  20 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  18 and name HG2# ) (segid B and resid  20 and name  HB# )  4.0  2.2  2.0 
assign (segid B and resid  18 and name HG2# ) (segid B and resid  26 and name   HA )  3.0  1.2  0.8 
assign (segid B and resid  18 and name  HG1 ) (segid B and resid  29 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid  18 and name   HB ) (segid B and resid  30 and name  HG* )  3.0  1.2  0.8 
assign (segid B and resid  18 and name   HN ) (segid B and resid  30 and name  HG* )  4.0  2.2  1.5 

! E19
assign (segid B and resid  19 and name   HA ) (segid B and resid  19 and name  HG# )  4.0  2.2  1.0 
assign (segid B and resid  19 and name  HG# ) (segid B and resid  19 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  19 and name  HB# ) (segid B and resid  19 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  19 and name   HA ) (segid B and resid  20 and name  HB# )  4.0  2.2  1.5 
assign (segid B and resid  19 and name   HA ) (segid B and resid  20 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  19 and name  HG# ) (segid B and resid  20 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  19 and name  HB# ) (segid B and resid  20 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  19 and name   HN ) (segid B and resid  20 and name   HN )  4.0  2.2  1.0 

! A20
assign (segid B and resid  20 and name  HB# ) (segid B and resid  20 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  20 and name  HB# ) (segid B and resid  21 and name   HA )  4.0  2.2  1.5 
assign (segid B and resid  20 and name   HA ) (segid B and resid  21 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  20 and name  HB# ) (segid B and resid  21 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  20 and name   HN ) (segid B and resid  21 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  20 and name  HB# ) (segid B and resid  22 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  20 and name   HN ) (segid B and resid  22 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  20 and name  HB# ) (segid B and resid  25 and name   HB )  3.0  1.2  0.8 
assign (segid B and resid  20 and name  HB# ) (segid B and resid  25 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  20 and name  HB# ) (segid B and resid  26 and name   HA )  3.0  1.2  0.8 
assign (segid B and resid  20 and name  HB# ) (segid B and resid  26 and name  HB# )  3.0  1.2  0.8 
assign (segid B and resid  20 and name  HB# ) (segid B and resid  26 and name   HN )  3.0  1.2  1.0 

! V21
assign (segid B and resid  21 and name   HA ) (segid B and resid  21 and name  HG* )  3.0  1.2  1.0 
assign (segid B and resid  21 and name   HB ) (segid B and resid  21 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  21 and name  HG* ) (segid B and resid  21 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  21 and name   HA ) (segid B and resid  22 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  21 and name   HB ) (segid B and resid  22 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  21 and name  HG* ) (segid B and resid  22 and name   HN )  2.5  0.7  0.9 
assign (segid B and resid  21 and name   HN ) (segid B and resid  22 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  21 and name  HG* ) (segid B and resid  25 and name   HB )  3.0  1.2  0.8 

! D22
assign (segid B and resid  22 and name  HB# ) (segid B and resid  22 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  22 and name  HB# ) (segid B and resid  23 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  22 and name   HA ) (segid B and resid  23 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  22 and name   HN ) (segid B and resid  23 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  22 and name   HA ) (segid B and resid  24 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  22 and name   HN ) (segid B and resid  24 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  22 and name  HB# ) (segid B and resid  24 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  22 and name   HN ) (segid B and resid  25 and name   HB )  3.0  1.2  0.5 
assign (segid B and resid  22 and name   HN ) (segid B and resid  25 and name HG2# )  3.0  1.2  1.0 
assign (segid B and resid  22 and name  HB# ) (segid B and resid  25 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  22 and name   HN ) (segid B and resid  25 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  22 and name   HN ) (segid B and resid  25 and name HG2* )  3.0  1.2  0.5 
assign (segid B and resid  22 and name   HN ) (segid B and resid  25 and name   HA )  4.0  2.2  1.0 

! A23
assign (segid B and resid  23 and name  HB# ) (segid B and resid  23 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  23 and name  HB# ) (segid B and resid  24 and name   HA )  4.0  2.2  1.5 
assign (segid B and resid  23 and name   HA ) (segid B and resid  24 and name  HB# )  4.0  2.2  1.5 
assign (segid B and resid  23 and name   HN ) (segid B and resid  24 and name  HB# )  4.0  2.2  1.5 
assign (segid B and resid  23 and name  HB# ) (segid B and resid  24 and name   HN )  2.5  0.7  0.9 
assign (segid B and resid  23 and name   HA ) (segid B and resid  24 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  23 and name   HA ) (segid B and resid  26 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  23 and name   HA ) (segid B and resid  26 and name  HB# )  2.5  0.7  0.7 

! A24
assign (segid B and resid  24 and name  HB# ) (segid B and resid  24 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  24 and name   HA ) (segid B and resid  25 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  24 and name  HB# ) (segid B and resid  25 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  24 and name   HN ) (segid B and resid  25 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  24 and name   HN ) (segid B and resid  26 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  24 and name   HA ) (segid B and resid  27 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  24 and name   HA ) (segid B and resid  27 and name  HB# )  3.0  1.2  0.3 
assign (segid B and resid  24 and name   HA ) (segid B and resid  27 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid  24 and name  HB# ) (segid B and resid  27 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  24 and name   HA ) (segid B and resid  28 and name   HN )  4.0  2.2  1.0 

! T25
assign (segid B and resid  25 and name   HA ) (segid B and resid  25 and name HG2* )  2.5  0.7  0.2 
assign (segid B and resid  25 and name HG2# ) (segid B and resid  25 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  25 and name HG2# ) (segid B and resid  25 and name   HA )  3.0  1.2  1.0 
assign (segid B and resid  25 and name   HB ) (segid B and resid  25 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  25 and name   HN ) (segid B and resid  26 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid  25 and name   HB ) (segid B and resid  26 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  25 and name   HA ) (segid B and resid  26 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  25 and name HG2# ) (segid B and resid  26 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  25 and name   HN ) (segid B and resid  26 and name  HB# )  4.0  2.2  1.5 
assign (segid B and resid  25 and name   HB ) (segid B and resid  26 and name  HB# )  4.0  2.2  2.5 
assign (segid B and resid  25 and name   HN ) (segid B and resid  26 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  25 and name   HA ) (segid B and resid  28 and name  HE# )  4.0  2.2  2.0 
assign (segid B and resid  25 and name   HA ) (segid B and resid  28 and name  HD# )  4.0  2.2  1.0 
assign (segid B and resid  25 and name   HA ) (segid B and resid  28 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  25 and name   HA ) (segid B and resid  28 and name  HB# )  2.5  0.7  0.2 
assign (segid B and resid  25 and name   HN ) (segid B and resid  28 and name  HB# )  4.0  2.2  1.0 

! A26
assign (segid B and resid  26 and name  HB# ) (segid B and resid  26 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  26 and name   HN ) (segid B and resid  27 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  26 and name  HB# ) (segid B and resid  27 and name   HN )  2.5  0.7  0.9 
assign (segid B and resid  26 and name   HA ) (segid B and resid  27 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  26 and name   HN ) (segid B and resid  28 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  26 and name   HA ) (segid B and resid  29 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  26 and name   HA ) (segid B and resid  29 and name   HB )  3.0  1.2  0.3 
assign (segid B and resid  26 and name   HA ) (segid B and resid  30 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid  26 and name   HA ) (segid B and resid  30 and name  HG* )  4.0  2.2  1.5 

! E27
assign (segid B and resid  27 and name   HA ) (segid B and resid  27 and name  HG# )  3.0  1.2  0.3 
assign (segid B and resid  27 and name  HB# ) (segid B and resid  27 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  27 and name  HG# ) (segid B and resid  27 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  27 and name   HA ) (segid B and resid  28 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  27 and name   HN ) (segid B and resid  28 and name  HB# )  4.0  2.2  1.0 
assign (segid B and resid  27 and name  HB# ) (segid B and resid  28 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  27 and name  HG# ) (segid B and resid  28 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  27 and name   HN ) (segid B and resid  28 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  27 and name   HN ) (segid B and resid  29 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  27 and name   HA ) (segid B and resid  29 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid  27 and name   HA ) (segid B and resid  30 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  27 and name   HA ) (segid B and resid  30 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid  27 and name   HA ) (segid B and resid  30 and name   HB )  4.0  2.2  1.0 
assign (segid B and resid  27 and name  HG# ) (segid B and resid  30 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid  27 and name  HB# ) (segid B and resid  30 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  27 and name   HA ) (segid B and resid  31 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  27 and name  HG# ) (segid B and resid  31 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid  27 and name  HG# ) (segid B and resid  31 and name  HE# )  4.0  2.2  2.0 
assign (segid B and resid  27 and name  HB# ) (segid B and resid  31 and name  HD# )  4.0  2.2  1.0 

! K28
assign (segid B and resid  28 and name   HA ) (segid B and resid  28 and name  HG# )  3.0  1.2  0.3 
assign (segid B and resid  28 and name  HB# ) (segid B and resid  28 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  28 and name  HG# ) (segid B and resid  28 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  28 and name   HA ) (segid B and resid  29 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  28 and name  HB# ) (segid B and resid  29 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  28 and name  HB# ) (segid B and resid  29 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid  28 and name  HD# ) (segid B and resid  29 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  28 and name   HN ) (segid B and resid  29 and name  HG* )  4.0  2.2  2.5 
assign (segid B and resid  28 and name  HG# ) (segid B and resid  29 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  28 and name   HN ) (segid B and resid  29 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  28 and name   HN ) (segid B and resid  30 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  28 and name   HA ) (segid B and resid  31 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  28 and name   HA ) (segid B and resid  31 and name  HG# )  4.0  2.2  1.0 
assign (segid B and resid  28 and name  HD# ) (segid B and resid  31 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid  28 and name  HB# ) (segid B and resid  32 and name   HN )  4.0  2.2  2.0 

! V29
assign (segid B and resid  29 and name   HA ) (segid B and resid  29 and name  HG* )  3.0  1.2  1.0 
assign (segid B and resid  29 and name   HB ) (segid B and resid  29 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  29 and name  HG* ) (segid B and resid  29 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  29 and name   HB ) (segid B and resid  30 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  29 and name  HG* ) (segid B and resid  30 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  29 and name  HG* ) (segid B and resid  30 and name   HB )  4.0  2.2  1.5 
assign (segid B and resid  29 and name   HA ) (segid B and resid  30 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  29 and name   HN ) (segid B and resid  30 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  29 and name   HA ) (segid B and resid  32 and name  HG# )  4.0  2.2  2.0 
assign (segid B and resid  29 and name   HA ) (segid B and resid  32 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  29 and name   HA ) (segid B and resid  32 and name  HB# )  3.0  1.2  0.3 
assign (segid B and resid  29 and name   HA ) (segid B and resid  33 and name   HN )  4.0  2.2  2.0 

! V30
assign (segid B and resid  30 and name   HA ) (segid B and resid  30 and name  HG* )  2.5  0.7  0.7 
assign (segid B and resid  30 and name  HG* ) (segid B and resid  30 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  30 and name   HB ) (segid B and resid  30 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  30 and name   HN ) (segid B and resid  31 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  30 and name   HA ) (segid B and resid  31 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  30 and name  HG* ) (segid B and resid  31 and name   HA )  4.0  2.2  2.5 
assign (segid B and resid  30 and name   HB ) (segid B and resid  31 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  30 and name  HG* ) (segid B and resid  31 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  30 and name   HA ) (segid B and resid  33 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  30 and name   HA ) (segid B and resid  33 and name  HB# )  4.0  2.2  1.0 
assign (segid B and resid  30 and name   HA ) (segid B and resid  33 and name  HD# )  4.0  2.2  1.5 
assign (segid B and resid  30 and name  HG* ) (segid B and resid  33 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  30 and name  HG* ) (segid B and resid  33 and name  HD# )  4.0  2.2  2.5 
assign (segid B and resid  30 and name   HA ) (segid B and resid  34 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid  30 and name  HG* ) (segid B and resid  34 and name  HD# )  4.0  2.2  2.0 
assign (segid B and resid  30 and name  HG* ) (segid B and resid  34 and name   HZ )  4.0  2.2  1.5 
assign (segid B and resid  30 and name  HG* ) (segid B and resid  34 and name  HE# )  4.0  2.2  2.0 

! K31
assign (segid B and resid  31 and name   HA ) (segid B and resid  31 and name  HG# )  4.0  2.2  1.0 
assign (segid B and resid  31 and name   HA ) (segid B and resid  31 and name  HD# )  4.0  2.2  1.0 
assign (segid B and resid  31 and name  HE# ) (segid B and resid  31 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid  31 and name  HE# ) (segid B and resid  31 and name  HB# )  4.0  2.2  1.0 
assign (segid B and resid  31 and name  HB# ) (segid B and resid  31 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  31 and name  HB# ) (segid B and resid  31 and name  HD# )  3.0  1.2  0.3 
assign (segid B and resid  31 and name  HD# ) (segid B and resid  31 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  31 and name  HG# ) (segid B and resid  31 and name  HE# )  4.0  2.2  1.0 
assign (segid B and resid  31 and name  HG# ) (segid B and resid  31 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  31 and name   HN ) (segid B and resid  32 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  31 and name  HG# ) (segid B and resid  32 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid  31 and name  HB# ) (segid B and resid  32 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid  31 and name  HB# ) (segid B and resid  32 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  31 and name  HD# ) (segid B and resid  32 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  31 and name   HA ) (segid B and resid  32 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  31 and name  HD# ) (segid B and resid  32 and name HE2# )  4.0  2.2  2.5 
assign (segid B and resid  31 and name   HA ) (segid B and resid  33 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  31 and name   HA ) (segid B and resid  34 and name  HB# )  4.0  2.2  1.0 
assign (segid B and resid  31 and name   HA ) (segid B and resid  34 and name  HD# )  4.0  2.2  1.5 
assign (segid B and resid  31 and name   HA ) (segid B and resid  34 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  31 and name   HA ) (segid B and resid  35 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid  31 and name  HG# ) (segid B and resid  35 and name HD2# )  4.0  2.2  1.5 
assign (segid B and resid  31 and name  HB# ) (segid B and resid  35 and name HD2# )  4.0  2.2  2.0 

! Q32
assign (segid B and resid  32 and name  HG# ) (segid B and resid  32 and name   HA )  3.0  1.2  0.3 
assign (segid B and resid  32 and name  HG# ) (segid B and resid  32 and name HE2# )  4.0  2.2  1.0 
assign (segid B and resid  32 and name  HG# ) (segid B and resid  32 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  32 and name  HB# ) (segid B and resid  32 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  32 and name  HB# ) (segid B and resid  32 and name HE2# )  4.0  2.2  1.5 
assign (segid B and resid  32 and name   HA ) (segid B and resid  32 and name HE2# )  4.0  2.2  2.0 
assign (segid B and resid  32 and name  HB# ) (segid B and resid  33 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid  32 and name   HA ) (segid B and resid  33 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  32 and name  HB# ) (segid B and resid  33 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  32 and name  HG# ) (segid B and resid  33 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  32 and name   HN ) (segid B and resid  33 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  32 and name   HA ) (segid B and resid  35 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  32 and name   HA ) (segid B and resid  35 and name HD2# )  4.0  2.2  1.0 
assign (segid B and resid  32 and name   HA ) (segid B and resid  35 and name  HB# )  3.0  1.2  0.3 
assign (segid B and resid  32 and name HE2# ) (segid B and resid  35 and name  HB# )  4.0  2.2  1.0 
assign (segid B and resid  32 and name   HA ) (segid B and resid  36 and name   HN )  4.0  2.2  1.0 

! F33
assign (segid B and resid  33 and name   HA ) (segid B and resid  33 and name  HD# )  3.0  1.2  0.8 
assign (segid B and resid  33 and name  HB# ) (segid B and resid  33 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  33 and name  HB# ) (segid B and resid  33 and name  HD# )  3.0  1.2  0.8 
assign (segid B and resid  33 and name  HD# ) (segid B and resid  33 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  33 and name   HA ) (segid B and resid  34 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  33 and name  HB# ) (segid B and resid  34 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  33 and name   HN ) (segid B and resid  34 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  33 and name  HD# ) (segid B and resid  34 and name  HD# )  3.0  1.2  1.3 
assign (segid B and resid  33 and name   HA ) (segid B and resid  36 and name  HB# )  4.0  2.2  1.0 
assign (segid B and resid  33 and name   HA ) (segid B and resid  36 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  33 and name   HA ) (segid B and resid  37 and name  HB# )  4.0  2.2  1.0 
assign (segid B and resid  33 and name   HA ) (segid B and resid  37 and name HD2# )  4.0  2.2  1.0 
assign (segid B and resid  33 and name   HA ) (segid B and resid  37 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  33 and name  HD# ) (segid B and resid  37 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid  33 and name  HD# ) (segid B and resid  37 and name HD2# )  4.0  2.2  1.5 
assign (segid B and resid  33 and name  HE# ) (segid B and resid  37 and name HD2# )  4.0  2.2  2.5 
assign (segid B and resid  33 and name  HD# ) (segid B and resid  54 and name  HG* )  4.0  2.2  2.0 
assign (segid B and resid  33 and name  HE# ) (segid B and resid  54 and name  HG* )  4.0  2.2  2.0 
assign (segid B and resid  33 and name  HD# ) (segid B and resid  56 and name  HB# )  4.0  2.2  1.5 
assign (segid B and resid  33 and name  HE# ) (segid B and resid  56 and name  HB# )  4.0  2.2  1.5 
assign (segid B and resid  33 and name   HZ ) (segid B and resid  56 and name  HB# )  4.0  2.2  1.0 
assign (segid B and resid  33 and name  HD# ) (segid B and resid  56 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  33 and name  HE# ) (segid B and resid  56 and name   HN )  4.0  2.2  1.5 

! F34
assign (segid B and resid  34 and name  HB# ) (segid B and resid  34 and name  HD# )  4.0  2.2  1.5 
assign (segid B and resid  34 and name  HB# ) (segid B and resid  34 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  34 and name   HA ) (segid B and resid  35 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  34 and name  HB# ) (segid B and resid  35 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid  34 and name  HB# ) (segid B and resid  35 and name  HB# )  4.0  2.2  2.0 
assign (segid B and resid  34 and name  HB# ) (segid B and resid  35 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  34 and name   HN ) (segid B and resid  35 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  34 and name   HA ) (segid B and resid  37 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  34 and name   HA ) (segid B and resid  37 and name  HB# )  4.0  2.2  2.0 
assign (segid B and resid  34 and name   HZ ) (segid B and resid  37 and name HD2# )  4.0  2.2  1.0 

! N35
assign (segid B and resid  35 and name   HA ) (segid B and resid  35 and name HD2# )  4.0  2.2  1.0 
assign (segid B and resid  35 and name  HB1 ) (segid B and resid  35 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  35 and name  HB2 ) (segid B and resid  35 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  35 and name  HB# ) (segid B and resid  35 and name HD2# )  4.0  2.2  1.0 
assign (segid B and resid  35 and name HD2# ) (segid B and resid  35 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid  35 and name  HB# ) (segid B and resid  36 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  35 and name   HN ) (segid B and resid  36 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  35 and name HD2# ) (segid B and resid  36 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  35 and name   HN ) (segid B and resid  37 and name   HN )  4.0  2.2  1.0 

! D36
assign (segid B and resid  36 and name  HB# ) (segid B and resid  36 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  36 and name   HA ) (segid B and resid  37 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  36 and name  HB# ) (segid B and resid  37 and name HD2# )  4.0  2.2  2.0 
assign (segid B and resid  36 and name  HB# ) (segid B and resid  37 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  36 and name   HN ) (segid B and resid  37 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  36 and name   HN ) (segid B and resid  37 and name HD2# )  4.0  2.2  1.0 
assign (segid B and resid  36 and name   HN ) (segid B and resid  38 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  36 and name  HB# ) (segid B and resid  38 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid  36 and name   HA ) (segid B and resid  39 and name   HN )  4.0  2.2  2.0 

! N37
assign (segid B and resid  37 and name  HB# ) (segid B and resid  37 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  37 and name  HB# ) (segid B and resid  37 and name HD2# )  4.0  2.2  1.0 
assign (segid B and resid  37 and name  HB# ) (segid B and resid  38 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  37 and name   HN ) (segid B and resid  38 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  37 and name   HA ) (segid B and resid  38 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  37 and name HD2# ) (segid B and resid  38 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid  37 and name  HB# ) (segid B and resid  43 and name  HE1 )  4.0  2.2  1.0 
assign (segid B and resid  37 and name  HB# ) (segid B and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid  37 and name HD2# ) (segid B and resid  54 and name  HG* )  4.0  2.2  2.5 
assign (segid B and resid  37 and name HD2# ) (segid B and resid  56 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid  37 and name HD2# ) (segid B and resid  56 and name  HG# )  4.0  2.2  1.5 

! G38
assign (segid B and resid  38 and name  HA# ) (segid B and resid  39 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  38 and name  HA# ) (segid B and resid  40 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  38 and name  HA# ) (segid B and resid  43 and name  HE1 )  4.0  2.2  2.0 
assign (segid B and resid  38 and name  HA# ) (segid B and resid  43 and name  HZ2 )  4.0  2.2  2.0 
assign (segid B and resid  38 and name  HA# ) (segid B and resid  54 and name  HG* )  4.0  2.2  2.5 

! V39
assign (segid B and resid  39 and name   HA ) (segid B and resid  39 and name  HG* )  2.5  0.7  0.7 
assign (segid B and resid  39 and name   HB ) (segid B and resid  39 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  39 and name  HG* ) (segid B and resid  39 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  39 and name   HA ) (segid B and resid  40 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  39 and name   HB ) (segid B and resid  40 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  39 and name  HG* ) (segid B and resid  40 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  39 and name   HN ) (segid B and resid  40 and name  HB# )  4.0  2.2  2.0 
assign (segid B and resid  39 and name   HN ) (segid B and resid  40 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  39 and name  HG* ) (segid B and resid  41 and name   HN )  4.0  2.2  1.5 

! D40
assign (segid B and resid  40 and name  HB# ) (segid B and resid  40 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  40 and name   HA ) (segid B and resid  41 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  40 and name  HB# ) (segid B and resid  41 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  40 and name   HN ) (segid B and resid  41 and name   HN )  3.0  1.2  0.5 

! G41
assign (segid B and resid  41 and name  HA# ) (segid B and resid  42 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  41 and name   HN ) (segid B and resid  42 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  41 and name  HA# ) (segid B and resid  43 and name  HD1 )  4.0  2.2  2.0 
assign (segid B and resid  41 and name  HA# ) (segid B and resid  43 and name  HE1 )  4.0  2.2  1.0 
assign (segid B and resid  41 and name   HN ) (segid B and resid  43 and name  HE1 )  4.0  2.2  1.0 

! E42
assign (segid B and resid  42 and name  HG# ) (segid B and resid  42 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid  42 and name  HG# ) (segid B and resid  42 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  42 and name  HB# ) (segid B and resid  42 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  42 and name   HA ) (segid B and resid  43 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  42 and name  HG# ) (segid B and resid  43 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  42 and name   HA ) (segid B and resid  43 and name  HB# )  4.0  2.2  2.0 
assign (segid B and resid  42 and name  HB# ) (segid B and resid  43 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  42 and name   HN ) (segid B and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid  42 and name  HB# ) (segid B and resid  55 and name   HB )  4.0  2.2  1.0 
assign (segid B and resid  42 and name  HB# ) (segid B and resid  55 and name   HN )  4.0  2.2  1.0 

! W43
assign (segid B and resid  43 and name  HB# ) (segid B and resid  43 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  43 and name   HA ) (segid B and resid  44 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  43 and name   HA ) (segid B and resid  44 and name HG2# )  4.0  2.2  2.5 
assign (segid B and resid  43 and name  HB# ) (segid B and resid  44 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  43 and name  HD1 ) (segid B and resid  44 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid  43 and name  HE3 ) (segid B and resid  44 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid  43 and name   HA ) (segid B and resid  52 and name  HD# )  4.0  2.2  2.5 
assign (segid B and resid  43 and name  HB# ) (segid B and resid  52 and name  HD# )  4.0  2.2  1.5 
assign (segid B and resid  43 and name  HZ3 ) (segid B and resid  52 and name  HD# )  4.0  2.2  1.5 
assign (segid B and resid  43 and name  HZ3 ) (segid B and resid  52 and name  HE# )  4.0  2.2  2.5 
assign (segid B and resid  43 and name   HA ) (segid B and resid  54 and name   HA )  3.0  1.2  0.3 
assign (segid B and resid  43 and name  HB# ) (segid B and resid  54 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid  43 and name   HA ) (segid B and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid  43 and name  HB# ) (segid B and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid  43 and name  HE1 ) (segid B and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid  43 and name  HZ2 ) (segid B and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid  43 and name  HZ3 ) (segid B and resid  54 and name  HG* )  4.0  2.2  2.5 
assign (segid B and resid  43 and name  HE3 ) (segid B and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid  43 and name  HD1 ) (segid B and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid  43 and name  HH2 ) (segid B and resid  54 and name  HG* )  4.0  2.2  2.5 
assign (segid B and resid  43 and name   HA ) (segid B and resid  55 and name   HN )  4.0  2.2  1.0 

! T44
assign (segid B and resid  44 and name   HB ) (segid B and resid  44 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  44 and name HG2# ) (segid B and resid  44 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  44 and name HG2# ) (segid B and resid  44 and name   HA )  2.5  0.7  0.7 
assign (segid B and resid  44 and name   HA ) (segid B and resid  45 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  44 and name HG2# ) (segid B and resid  45 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  44 and name   HB ) (segid B and resid  45 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  44 and name   HN ) (segid B and resid  52 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid  44 and name   HB ) (segid B and resid  53 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  44 and name HG2# ) (segid B and resid  53 and name   HB )  4.0  2.2  1.5 
assign (segid B and resid  44 and name HG2# ) (segid B and resid  53 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  44 and name   HN ) (segid B and resid  53 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  44 and name   HN ) (segid B and resid  53 and name   HB )  4.0  2.2  1.0 
assign (segid B and resid  44 and name   HN ) (segid B and resid  53 and name HG2# )  4.0  2.2  2.5 
assign (segid B and resid  44 and name   HN ) (segid B and resid  54 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid  44 and name   HN ) (segid B and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid  44 and name   HN ) (segid B and resid  55 and name   HN )  4.0  2.2  1.0 

! Y45
assign (segid B and resid  45 and name  HB# ) (segid B and resid  45 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  45 and name   HA ) (segid B and resid  46 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  45 and name  HE# ) (segid B and resid  46 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  45 and name  HB# ) (segid B and resid  46 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  45 and name   HN ) (segid B and resid  46 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  45 and name  HE# ) (segid B and resid  47 and name   HA )  3.0  1.2  0.8 
assign (segid B and resid  45 and name  HE# ) (segid B and resid  47 and name  HB# )  4.0  2.2  1.5 
assign (segid B and resid  45 and name  HE# ) (segid B and resid  47 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  45 and name  HE# ) (segid B and resid  50 and name   HA )  3.0  1.2  0.8 
assign (segid B and resid  45 and name  HE# ) (segid B and resid  50 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  45 and name  HE# ) (segid B and resid  51 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  45 and name   HA ) (segid B and resid  52 and name   HA )  3.0  1.2  0.3 
assign (segid B and resid  45 and name  HB# ) (segid B and resid  52 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid  45 and name  HB# ) (segid B and resid  52 and name  HE# )  3.0  1.2  0.8 
assign (segid B and resid  45 and name  HB# ) (segid B and resid  52 and name  HD# )  3.0  1.2  0.8 
assign (segid B and resid  45 and name   HN ) (segid B and resid  52 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid  45 and name   HA ) (segid B and resid  53 and name   HN )  3.0  1.2  0.5 

! D46
assign (segid B and resid  46 and name  HB# ) (segid B and resid  46 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  46 and name   HA ) (segid B and resid  47 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  46 and name  HB# ) (segid B and resid  47 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  46 and name   HA ) (segid B and resid  47 and name  HB# )  4.0  2.2  1.0 
assign (segid B and resid  46 and name   HN ) (segid B and resid  47 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  46 and name   HA ) (segid B and resid  48 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  46 and name  HB# ) (segid B and resid  48 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  46 and name  HB# ) (segid B and resid  49 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  46 and name  HB# ) (segid B and resid  51 and name   HB )  4.0  2.2  1.0 
assign (segid B and resid  46 and name  HB# ) (segid B and resid  51 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  46 and name  HB# ) (segid B and resid  51 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid  46 and name   HN ) (segid B and resid  51 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid  46 and name   HN ) (segid B and resid  51 and name   HB )  4.0  2.2  1.0 
assign (segid B and resid  46 and name   HN ) (segid B and resid  51 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  46 and name   HN ) (segid B and resid  52 and name   HA )  3.0  1.2  0.5 
assign (segid B and resid  46 and name   HN ) (segid B and resid  53 and name   HN )  4.0  2.2  1.0 

! D47
assign (segid B and resid  47 and name   HA ) (segid B and resid  47 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  47 and name  HB# ) (segid B and resid  47 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  47 and name   HA ) (segid B and resid  48 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  47 and name  HB# ) (segid B and resid  48 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  47 and name  HB# ) (segid B and resid  48 and name  HB# )  4.0  2.2  2.5 
assign (segid B and resid  47 and name   HN ) (segid B and resid  48 and name  HB# )  4.0  2.2  2.5 
assign (segid B and resid  47 and name   HN ) (segid B and resid  48 and name   HN )  3.0  1.2  0.7 
assign (segid B and resid  47 and name   HA ) (segid B and resid  49 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  47 and name   HN ) (segid B and resid  49 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  47 and name   HA ) (segid B and resid  50 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  47 and name   HA ) (segid B and resid  50 and name  HD# )  4.0  2.2  1.0 

! A48
assign (segid B and resid  48 and name   HN ) (segid B and resid  48 and name   HA )  2.5  0.7  0.4 
assign (segid B and resid  48 and name  HB# ) (segid B and resid  48 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  48 and name   HN ) (segid B and resid  49 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid  48 and name  HB# ) (segid B and resid  49 and name   HA )  4.0  2.2  1.5 
assign (segid B and resid  48 and name   HA ) (segid B and resid  49 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  48 and name  HB# ) (segid B and resid  49 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  48 and name   HN ) (segid B and resid  49 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid  48 and name   HN ) (segid B and resid  49 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  48 and name   HA ) (segid B and resid  50 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  48 and name  HB# ) (segid B and resid  50 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  48 and name   HN ) (segid B and resid  50 and name   HN )  4.0  2.2  1.0 

! T49
assign (segid B and resid  49 and name   HA ) (segid B and resid  49 and name HG2# )  2.5  0.7  0.7 
assign (segid B and resid  49 and name HG2# ) (segid B and resid  49 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  49 and name   HB ) (segid B and resid  50 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid  49 and name   HA ) (segid B and resid  50 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  49 and name HG2# ) (segid B and resid  50 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  49 and name   HA ) (segid B and resid  50 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  49 and name   HN ) (segid B and resid  50 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  49 and name   HN ) (segid B and resid  51 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  49 and name   HN ) (segid B and resid  51 and name   HB )  4.0  2.2  2.0 

! K50
assign (segid B and resid  50 and name   HA ) (segid B and resid  50 and name  HG# )  3.0  1.2  0.3 
assign (segid B and resid  50 and name   HA ) (segid B and resid  50 and name  HD# )  3.0  1.2  0.3 
assign (segid B and resid  50 and name  HB# ) (segid B and resid  50 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  50 and name  HG# ) (segid B and resid  50 and name  HE# )  4.0  2.2  2.0 
assign (segid B and resid  50 and name  HG# ) (segid B and resid  50 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  50 and name  HD# ) (segid B and resid  50 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  50 and name   HA ) (segid B and resid  51 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  50 and name   HN ) (segid B and resid  51 and name   HB )  4.0  2.2  2.0 
assign (segid B and resid  50 and name   HN ) (segid B and resid  51 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  50 and name  HB# ) (segid B and resid  51 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  50 and name  HD# ) (segid B and resid  51 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid  50 and name  HG# ) (segid B and resid  51 and name   HN )  4.0  2.2  1.0 

! T51
assign (segid B and resid  51 and name   HB ) (segid B and resid  51 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  51 and name   HA ) (segid B and resid  51 and name  HG1 )  4.0  2.2  1.0 
assign (segid B and resid  51 and name   HA ) (segid B and resid  51 and name HG2# )  2.5  0.7  0.7 
assign (segid B and resid  51 and name HG2# ) (segid B and resid  51 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  51 and name  HG1 ) (segid B and resid  51 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  51 and name   HB ) (segid B and resid  52 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  51 and name   HA ) (segid B and resid  52 and name  HD# )  4.0  2.2  1.5 
assign (segid B and resid  51 and name   HA ) (segid B and resid  52 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  51 and name   HA ) (segid B and resid  52 and name  HB# )  4.0  2.2  2.0 
assign (segid B and resid  51 and name HG2# ) (segid B and resid  52 and name   HA )  4.0  2.2  1.5 
assign (segid B and resid  51 and name HG2# ) (segid B and resid  52 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  51 and name   HN ) (segid B and resid  52 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  51 and name   HN ) (segid B and resid  52 and name   HA )  4.0  2.2  2.0 

! F52
assign (segid B and resid  52 and name   HA ) (segid B and resid  52 and name  HD# )  4.0  2.2  1.5 
assign (segid B and resid  52 and name  HB# ) (segid B and resid  52 and name  HD# )  3.0  1.2  0.8 
assign (segid B and resid  52 and name  HB# ) (segid B and resid  52 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  52 and name  HB# ) (segid B and resid  52 and name  HE# )  4.0  2.2  2.5 
assign (segid B and resid  52 and name  HE# ) (segid B and resid  52 and name   HN )  4.0  2.2  2.5 
assign (segid B and resid  52 and name  HD# ) (segid B and resid  52 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  52 and name   HA ) (segid B and resid  53 and name   HB )  4.0  2.2  2.0 
assign (segid B and resid  52 and name   HA ) (segid B and resid  53 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  52 and name  HB# ) (segid B and resid  53 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  52 and name   HN ) (segid B and resid  53 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  52 and name  HD# ) (segid B and resid  53 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  52 and name  HB# ) (segid B and resid  54 and name  HG* )  4.0  2.2  2.5 

! T53
assign (segid B and resid  53 and name   HB ) (segid B and resid  53 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  53 and name   HA ) (segid B and resid  53 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid  53 and name HG2# ) (segid B and resid  53 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  53 and name   HB ) (segid B and resid  54 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  53 and name   HA ) (segid B and resid  54 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  53 and name HG2# ) (segid B and resid  54 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  53 and name   HN ) (segid B and resid  54 and name  HG* )  4.0  2.2  2.5 
assign (segid B and resid  53 and name HG2# ) (segid B and resid  55 and name   HN )  4.0  2.2  2.5 

! V54
assign (segid B and resid  54 and name   HA ) (segid B and resid  54 and name  HG* )  3.0  1.2  0.8 
assign (segid B and resid  54 and name   HB ) (segid B and resid  54 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  54 and name  HG* ) (segid B and resid  54 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  54 and name   HA ) (segid B and resid  55 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  54 and name  HG* ) (segid B and resid  55 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid  54 and name   HN ) (segid B and resid  55 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  54 and name   HB ) (segid B and resid  55 and name   HN )  4.0  2.2  1.0 

! T55
assign (segid B and resid  55 and name   HB ) (segid B and resid  55 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid  55 and name   HA ) (segid B and resid  55 and name HG2# )  3.0  1.2  0.8 
assign (segid B and resid  55 and name HG2# ) (segid B and resid  55 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  55 and name   HB ) (segid B and resid  56 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  55 and name   HA ) (segid B and resid  56 and name   HN )  2.5  0.7  0.4 
assign (segid B and resid  55 and name HG2# ) (segid B and resid  56 and name   HA )  4.0  2.2  1.5 
assign (segid B and resid  55 and name   HA ) (segid B and resid  56 and name  HG# )  4.0  2.2  2.5 
assign (segid B and resid  55 and name HG2# ) (segid B and resid  56 and name   HN )  3.0  1.2  1.0 
assign (segid B and resid  55 and name   HN ) (segid B and resid  56 and name   HN )  4.0  2.2  1.0 

! E56
assign (segid B and resid  56 and name   HA ) (segid B and resid  56 and name  HG# )  3.0  1.2  0.5 
assign (segid B and resid  56 and name  HG# ) (segid B and resid  56 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  56 and name  HB# ) (segid B and resid  56 and name   HN )  3.0  1.2  0.5 

!INTERMOLECULAR NOES

!M1
assign (segid A and resid   1 and name  HB# ) (segid B and resid  50 and name  HE# )  4.0  2.2  1.0 
assign (segid B and resid   1 and name  HB# ) (segid A and resid  50 and name  HE# )  4.0  2.2  1.0 
assign (segid A and resid   1 and name  HG# ) (segid B and resid  50 and name  HD# )  4.0  2.2  1.0 
assign (segid B and resid   1 and name  HG# ) (segid A and resid  50 and name  HD# )  4.0  2.2  1.0 
assign (segid A and resid   1 and name  HG# ) (segid B and resid  50 and name  HE# )  4.0  2.2  2.0 
assign (segid B and resid   1 and name  HG# ) (segid A and resid  50 and name  HE# )  4.0  2.2  2.0 
assign (segid A and resid   1 and name  HE# ) (segid B and resid  50 and name   HA )  4.0  2.2  2.5 
assign (segid B and resid   1 and name  HE# ) (segid A and resid  50 and name   HA )  4.0  2.2  2.5 
assign (segid A and resid   1 and name  HE# ) (segid B and resid  50 and name  HG# )  4.0  2.2  1.5 
assign (segid B and resid   1 and name  HE# ) (segid A and resid  50 and name  HG# )  4.0  2.2  1.5 
assign (segid A and resid   1 and name  HE# ) (segid B and resid  50 and name  HD# )  4.0  2.2  1.5 
assign (segid B and resid   1 and name  HE# ) (segid A and resid  50 and name  HD# )  4.0  2.2  1.5 
assign (segid A and resid   1 and name  HE# ) (segid B and resid  50 and name  HE1 )  3.0  1.2  0.8 
assign (segid B and resid   1 and name  HE# ) (segid A and resid  50 and name  HE1 )  3.0  1.2  0.8 
assign (segid A and resid   1 and name  HE# ) (segid B and resid  50 and name  HE2 )  3.0  1.2  0.8 
assign (segid B and resid   1 and name  HE# ) (segid A and resid  50 and name  HE2 )  3.0  1.2  0.8 

!Y3
assign (segid A and resid   3 and name  HD# ) (segid B and resid  45 and name  HE# )  4.0  2.2  2.0 
assign (segid B and resid   3 and name  HD# ) (segid A and resid  45 and name  HE# )  4.0  2.2  2.0 
assign (segid A and resid   3 and name  HE# ) (segid B and resid  45 and name  HE# )  4.0  2.2  2.0 
assign (segid B and resid   3 and name  HE# ) (segid A and resid  45 and name  HE# )  4.0  2.2  2.0 
assign (segid A and resid   3 and name   HA ) (segid B and resid  50 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid   3 and name   HA ) (segid A and resid  50 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid   3 and name   HA ) (segid B and resid  50 and name  HB# )  4.0  2.2  1.0 
assign (segid B and resid   3 and name   HA ) (segid A and resid  50 and name  HB# )  4.0  2.2  1.0 
assign (segid A and resid   3 and name   HA ) (segid B and resid  50 and name  HD# )  4.0  2.2  2.0 
assign (segid B and resid   3 and name   HA ) (segid A and resid  50 and name  HD# )  4.0  2.2  2.0 
assign (segid A and resid   3 and name  HD# ) (segid B and resid  50 and name   HA )  3.0  1.2  0.8 
assign (segid B and resid   3 and name  HD# ) (segid A and resid  50 and name   HA )  3.0  1.2  0.8 
assign (segid A and resid   3 and name  HE# ) (segid B and resid  50 and name   HA )  4.0  2.2  1.5 
assign (segid B and resid   3 and name  HE# ) (segid A and resid  50 and name   HA )  4.0  2.2  1.5 
assign (segid A and resid   3 and name  HE# ) (segid B and resid  50 and name  HB# )  4.0  2.2  1.5 
assign (segid B and resid   3 and name  HE# ) (segid A and resid  50 and name  HB# )  4.0  2.2  1.5 
assign (segid A and resid   3 and name  HE# ) (segid B and resid  50 and name  HG# )  4.0  2.2  1.5 
assign (segid B and resid   3 and name  HE# ) (segid A and resid  50 and name  HG# )  4.0  2.2  1.5 
assign (segid A and resid   3 and name  HD# ) (segid B and resid  50 and name  HD# )  4.0  2.2  1.5 
assign (segid B and resid   3 and name  HD# ) (segid A and resid  50 and name  HD# )  4.0  2.2  1.5 
assign (segid A and resid   3 and name  HD# ) (segid B and resid  50 and name  HE# )  4.0  2.2  2.5 
assign (segid B and resid   3 and name  HD# ) (segid A and resid  50 and name  HE# )  4.0  2.2  2.5 
assign (segid A and resid   3 and name  HE# ) (segid B and resid  50 and name  HD# )  3.0  1.2  0.8 
assign (segid B and resid   3 and name  HE# ) (segid A and resid  50 and name  HD# )  3.0  1.2  0.8 
assign (segid A and resid   3 and name  HE# ) (segid B and resid  50 and name  HE# )  4.0  2.2  1.5 
assign (segid B and resid   3 and name  HE# ) (segid A and resid  50 and name  HE# )  4.0  2.2  1.5 
assign (segid A and resid   3 and name  HD# ) (segid B and resid  50 and name  HB# )  3.0  1.2  1.0 
assign (segid B and resid   3 and name  HD# ) (segid A and resid  50 and name  HB# )  3.0  1.2  1.0 
assign (segid A and resid   3 and name  HB# ) (segid B and resid  52 and name  HD# )  4.0  2.2  1.5 
assign (segid B and resid   3 and name  HB# ) (segid A and resid  52 and name  HD# )  4.0  2.2  1.5 
assign (segid A and resid   3 and name  HB# ) (segid B and resid  52 and name  HE# )  3.0  1.2  0.8 
assign (segid B and resid   3 and name  HB# ) (segid A and resid  52 and name  HE# )  3.0  1.2  0.8 
assign (segid A and resid   3 and name  HD# ) (segid B and resid  52 and name  HD# )  4.0  2.2  2.0 
assign (segid B and resid   3 and name  HD# ) (segid A and resid  52 and name  HD# )  4.0  2.2  2.0 
assign (segid A and resid   3 and name  HD# ) (segid B and resid  52 and name  HE# )  3.0  1.2  1.3 
assign (segid B and resid   3 and name  HD# ) (segid A and resid  52 and name  HE# )  3.0  1.2  1.3 

!K4
assign (segid A and resid   4 and name   HA ) (segid B and resid  51 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid   4 and name   HA ) (segid A and resid  51 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid   4 and name  HB# ) (segid B and resid  51 and name  HG1 )  4.0  2.2  2.0 
assign (segid B and resid   4 and name  HB# ) (segid A and resid  51 and name  HG1 )  4.0  2.2  2.0 
assign (segid A and resid   4 and name   HN ) (segid B and resid  51 and name   HA )  3.0  1.2  0.5 
assign (segid B and resid   4 and name   HN ) (segid A and resid  51 and name   HA )  3.0  1.2  0.5 
assign (segid A and resid   4 and name  HB# ) (segid B and resid  51 and name   HA )  3.0  1.2  0.5 
assign (segid B and resid   4 and name  HB# ) (segid A and resid  51 and name   HA )  3.0  1.2  0.5 
assign (segid A and resid   4 and name  HB# ) (segid B and resid  51 and name HG2# )  3.0  1.2  1.3 
assign (segid B and resid   4 and name  HB# ) (segid A and resid  51 and name HG2# )  3.0  1.2  1.3 
assign (segid A and resid   4 and name  HG# ) (segid B and resid  51 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid   4 and name  HG# ) (segid A and resid  51 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid   4 and name  HG# ) (segid B and resid  51 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid   4 and name  HG# ) (segid A and resid  51 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid   4 and name  HD# ) (segid B and resid  51 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid   4 and name  HD# ) (segid A and resid  51 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid   4 and name   HN ) (segid B and resid  51 and name  HG1 )  4.0  2.2  1.0 
assign (segid B and resid   4 and name   HN ) (segid A and resid  51 and name  HG1 )  4.0  2.2  1.0 
assign (segid A and resid   4 and name   HN ) (segid B and resid  51 and name HG2# )  4.0  2.2  2.5 
assign (segid B and resid   4 and name   HN ) (segid A and resid  51 and name HG2# )  4.0  2.2  2.5 
assign (segid A and resid   4 and name   HN ) (segid B and resid  51 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid   4 and name   HN ) (segid A and resid  51 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid   4 and name  HB# ) (segid B and resid  52 and name   HN )  4.0  2.2  2.5 
assign (segid B and resid   4 and name  HB# ) (segid A and resid  52 and name   HN )  4.0  2.2  2.5 
assign (segid A and resid   4 and name   HN ) (segid B and resid  52 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   4 and name   HN ) (segid A and resid  52 and name   HN )  4.0  2.2  1.0 

!V5
assign (segid A and resid   5 and name  HG* ) (segid B and resid  12 and name  HD* )  4.0  2.2  3.0 
assign (segid B and resid   5 and name  HG* ) (segid A and resid  12 and name  HD* )  4.0  2.2  3.0 
assign (segid A and resid   5 and name  HG* ) (segid B and resid  43 and name  HZ3 )  3.0  1.2  0.8 
assign (segid B and resid   5 and name  HG* ) (segid A and resid  43 and name  HZ3 )  3.0  1.2  0.8 
assign (segid A and resid   5 and name  HG* ) (segid B and resid  43 and name  HH2 )  4.0  2.2  1.5 
assign (segid B and resid   5 and name  HG* ) (segid A and resid  43 and name  HH2 )  4.0  2.2  1.5 
assign (segid A and resid   5 and name   HA ) (segid B and resid  51 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid   5 and name   HA ) (segid A and resid  51 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid   5 and name   HA ) (segid B and resid  51 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid   5 and name   HA ) (segid A and resid  51 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid   5 and name   HA ) (segid B and resid  52 and name  HB# )  4.0  2.2  1.0 
assign (segid B and resid   5 and name   HA ) (segid A and resid  52 and name  HB# )  4.0  2.2  1.0 
assign (segid A and resid   5 and name   HA ) (segid B and resid  52 and name   HN )  3.0  1.2  0.5 
assign (segid B and resid   5 and name   HA ) (segid A and resid  52 and name   HN )  3.0  1.2  0.5 
assign (segid A and resid   5 and name   HA ) (segid B and resid  52 and name  HD# )  3.0  1.2  0.8 
assign (segid B and resid   5 and name   HA ) (segid A and resid  52 and name  HD# )  3.0  1.2  0.8 
assign (segid A and resid   5 and name  HG* ) (segid B and resid  52 and name   HA )  4.0  2.2  1.5 
assign (segid B and resid   5 and name  HG* ) (segid A and resid  52 and name   HA )  4.0  2.2  1.5 
assign (segid A and resid   5 and name  HG* ) (segid B and resid  52 and name  HB# )  3.0  1.2  0.8 
assign (segid B and resid   5 and name  HG* ) (segid A and resid  52 and name  HB# )  3.0  1.2  0.8 
assign (segid A and resid   5 and name  HG* ) (segid B and resid  52 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid   5 and name  HG* ) (segid A and resid  52 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid   5 and name  HG* ) (segid B and resid  52 and name  HD# )  3.0  1.2  1.3 
assign (segid B and resid   5 and name  HG* ) (segid A and resid  52 and name  HD# )  3.0  1.2  1.3 
assign (segid A and resid   5 and name  HG* ) (segid B and resid  52 and name  HE# )  4.0  2.2  2.0 
assign (segid B and resid   5 and name  HG* ) (segid A and resid  52 and name  HE# )  4.0  2.2  2.0 
assign (segid A and resid   5 and name  HG* ) (segid B and resid  52 and name  HZ  )  4.0  2.2  2.5 
assign (segid B and resid   5 and name  HG* ) (segid A and resid  52 and name  HZ  )  4.0  2.2  2.5 
assign (segid A and resid   5 and name  HG* ) (segid B and resid  54 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid   5 and name  HG* ) (segid A and resid  54 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid   5 and name  HG* ) (segid B and resid  54 and name   HB )  4.0  2.2  2.5 
assign (segid B and resid   5 and name  HG* ) (segid A and resid  54 and name   HB )  4.0  2.2  2.5 
assign (segid A and resid   5 and name  HG* ) (segid B and resid  54 and name  HG* )  2.5  0.7  1.2 
assign (segid B and resid   5 and name  HG* ) (segid A and resid  54 and name  HG* )  2.5  0.7  1.2 
assign (segid A and resid   5 and name   HA ) (segid B and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid   5 and name   HA ) (segid A and resid  54 and name  HG* )  4.0  2.2  1.5 

!I6
assign (segid A and resid   6 and name   HN ) (segid B and resid  51 and name HG2# )  3.0  1.2  1.0 
assign (segid B and resid   6 and name   HN ) (segid A and resid  51 and name HG2# )  3.0  1.2  1.0 
assign (segid A and resid   6 and name   HB ) (segid B and resid  51 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid   6 and name   HB ) (segid A and resid  51 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid   6 and name HG1# ) (segid B and resid  51 and name HG2# )  3.0  1.2  0.8 
assign (segid B and resid   6 and name HG1# ) (segid A and resid  51 and name HG2# )  3.0  1.2  0.8 
assign (segid A and resid   6 and name HD1# ) (segid B and resid  51 and name   HA )  4.0  2.2  1.5 
assign (segid B and resid   6 and name HD1# ) (segid A and resid  51 and name   HA )  4.0  2.2  1.5 
assign (segid A and resid   6 and name HD1# ) (segid B and resid  51 and name   HB )  4.0  2.2  1.5 
assign (segid B and resid   6 and name HD1# ) (segid A and resid  51 and name   HB )  4.0  2.2  1.5 
assign (segid A and resid   6 and name HD1# ) (segid B and resid  51 and name HG2# )  3.0  1.2  0.8 
assign (segid B and resid   6 and name HD1# ) (segid A and resid  51 and name HG2# )  3.0  1.2  0.8 
assign (segid A and resid   6 and name   HN ) (segid B and resid  52 and name  HB# )  4.0  2.2  1.0 
assign (segid B and resid   6 and name   HN ) (segid A and resid  52 and name  HB# )  4.0  2.2  1.0 
assign (segid A and resid   6 and name   HN ) (segid B and resid  52 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   6 and name   HN ) (segid A and resid  52 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   6 and name   HB ) (segid B and resid  53 and name   HA )  3.0  1.2  0.3 
assign (segid B and resid   6 and name   HB ) (segid A and resid  53 and name   HA )  3.0  1.2  0.3 
assign (segid A and resid   6 and name   HN ) (segid B and resid  53 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid   6 and name   HN ) (segid A and resid  53 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid   6 and name   HB ) (segid B and resid  53 and name HG2# )  3.0  1.2  0.8 
assign (segid B and resid   6 and name   HB ) (segid A and resid  53 and name HG2# )  3.0  1.2  0.8 
assign (segid A and resid   6 and name HG1# ) (segid B and resid  53 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid   6 and name HG1# ) (segid A and resid  53 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid   6 and name HG1# ) (segid B and resid  53 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid   6 and name HG1# ) (segid A and resid  53 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid   6 and name HG2# ) (segid B and resid  53 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid   6 and name HG2# ) (segid A and resid  53 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid   6 and name HG2# ) (segid B and resid  53 and name   HA )  3.0  1.2  0.8 
assign (segid B and resid   6 and name HG2# ) (segid A and resid  53 and name   HA )  3.0  1.2  0.8 
assign (segid A and resid   6 and name HD1# ) (segid B and resid  53 and name   HA )  4.0  2.2  1.5 
assign (segid B and resid   6 and name HD1# ) (segid A and resid  53 and name   HA )  4.0  2.2  1.5 
assign (segid A and resid   6 and name   HN ) (segid B and resid  53 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid   6 and name   HN ) (segid A and resid  53 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid   6 and name   HB ) (segid B and resid  54 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   6 and name   HB ) (segid A and resid  54 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   6 and name HG2# ) (segid B and resid  54 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid   6 and name HG2# ) (segid A and resid  54 and name   HN )  4.0  2.2  1.5 
assign (segid A and resid   6 and name   HN ) (segid B and resid  54 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   6 and name   HN ) (segid A and resid  54 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   6 and name   HN ) (segid B and resid  54 and name  HG* )  4.0  2.2  2.5 
assign (segid B and resid   6 and name   HN ) (segid A and resid  54 and name  HG* )  4.0  2.2  2.5 

!L7
assign (segid A and resid   7 and name   HG ) (segid B and resid  16 and name HG2# )  4.0  2.2  2.5 
assign (segid B and resid   7 and name   HG ) (segid A and resid  16 and name HG2# )  4.0  2.2  2.5 
assign (segid A and resid   7 and name  HD* ) (segid B and resid  16 and name   HB )  4.0  2.2  1.5 
assign (segid B and resid   7 and name  HD* ) (segid A and resid  16 and name   HB )  4.0  2.2  1.5 
assign (segid A and resid   7 and name   HA ) (segid B and resid  33 and name   HZ )  3.0  1.2  0.3 
assign (segid B and resid   7 and name   HA ) (segid A and resid  33 and name   HZ )  3.0  1.2  0.3 
assign (segid A and resid   7 and name   HA ) (segid B and resid  33 and name  HD# )  4.0  2.2  2.5 
assign (segid B and resid   7 and name   HA ) (segid A and resid  33 and name  HD# )  4.0  2.2  2.5 
assign (segid A and resid   7 and name   HA ) (segid B and resid  33 and name  HE# )  4.0  2.2  1.5 
assign (segid B and resid   7 and name   HA ) (segid A and resid  33 and name  HE# )  4.0  2.2  1.5 
assign (segid A and resid   7 and name  HB# ) (segid B and resid  33 and name  HD# )  4.0  2.2  1.5 
assign (segid B and resid   7 and name  HB# ) (segid A and resid  33 and name  HD# )  4.0  2.2  1.5 
assign (segid A and resid   7 and name  HB# ) (segid B and resid  33 and name  HE# )  4.0  2.2  1.5 
assign (segid B and resid   7 and name  HB# ) (segid A and resid  33 and name  HE# )  4.0  2.2  1.5 
assign (segid A and resid   7 and name  HB# ) (segid B and resid  33 and name   HZ )  4.0  2.2  2.0 
assign (segid B and resid   7 and name  HB# ) (segid A and resid  33 and name   HZ )  4.0  2.2  2.0 
assign (segid A and resid   7 and name  HD* ) (segid B and resid  33 and name  HD# )  3.0  1.2  1.3 
assign (segid B and resid   7 and name  HD* ) (segid A and resid  33 and name  HD# )  3.0  1.2  1.3 
assign (segid A and resid   7 and name  HD* ) (segid B and resid  33 and name  HE# )  3.0  1.2  1.3 
assign (segid B and resid   7 and name  HD* ) (segid A and resid  33 and name  HE# )  3.0  1.2  1.3 
assign (segid A and resid   7 and name  HD* ) (segid B and resid  33 and name   HZ )  3.0  1.2  0.8 
assign (segid B and resid   7 and name  HD* ) (segid A and resid  33 and name   HZ )  3.0  1.2  0.8 
assign (segid A and resid   7 and name  HD* ) (segid B and resid  34 and name  HD# )  4.0  2.2  2.0 
assign (segid B and resid   7 and name  HD* ) (segid A and resid  34 and name  HD# )  4.0  2.2  2.0 
assign (segid A and resid   7 and name  HD* ) (segid B and resid  34 and name  HE# )  3.0  1.2  1.3 
assign (segid B and resid   7 and name  HD* ) (segid A and resid  34 and name  HE# )  3.0  1.2  1.3 
assign (segid A and resid   7 and name  HD* ) (segid B and resid  34 and name   HZ )  4.0  2.2  1.5 
assign (segid B and resid   7 and name  HD* ) (segid A and resid  34 and name   HZ )  4.0  2.2  1.5 
assign (segid A and resid   7 and name   HA ) (segid B and resid  54 and name   HB )  3.0  1.2  0.3 
assign (segid B and resid   7 and name   HA ) (segid A and resid  54 and name   HB )  3.0  1.2  0.3 
assign (segid A and resid   7 and name   HA ) (segid B and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid   7 and name   HA ) (segid A and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid A and resid   7 and name  HB# ) (segid B and resid  54 and name   HB )  4.0  2.2  1.0 
assign (segid B and resid   7 and name  HB# ) (segid A and resid  54 and name   HB )  4.0  2.2  1.0 
assign (segid A and resid   7 and name  HD* ) (segid B and resid  54 and name   HB )  3.0  1.2  0.8 
assign (segid B and resid   7 and name  HD* ) (segid A and resid  54 and name   HB )  3.0  1.2  0.8 
assign (segid A and resid   7 and name  HD* ) (segid B and resid  54 and name  HG* )  2.5  0.7  1.2 
assign (segid B and resid   7 and name  HD* ) (segid A and resid  54 and name  HG* )  2.5  0.7  1.2 
assign (segid A and resid   7 and name   HA ) (segid B and resid  54 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   7 and name   HA ) (segid A and resid  54 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   7 and name   HG ) (segid B and resid  54 and name  HG* )  4.0  2.2  2.5 
assign (segid B and resid   7 and name   HG ) (segid A and resid  54 and name  HG* )  4.0  2.2  2.5 
assign (segid A and resid   7 and name  HD* ) (segid B and resid  54 and name   HN )  4.0  2.2  1.5 
assign (segid B and resid   7 and name  HD* ) (segid A and resid  54 and name   HN )  4.0  2.2  1.5 

!N8
assign (segid A and resid   8 and name   HN ) (segid B and resid  33 and name  HE# )  4.0  2.2  1.5 
assign (segid B and resid   8 and name   HN ) (segid A and resid  33 and name  HE# )  4.0  2.2  1.5 
assign (segid A and resid   8 and name   HN ) (segid B and resid  33 and name   HZ )  4.0  2.2  1.0 
assign (segid B and resid   8 and name   HN ) (segid A and resid  33 and name   HZ )  4.0  2.2  1.0 
assign (segid A and resid   8 and name   HA ) (segid B and resid  53 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid   8 and name   HA ) (segid A and resid  53 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid   8 and name  HB# ) (segid B and resid  53 and name HG2# )  3.0  1.2  0.8 
assign (segid B and resid   8 and name  HB# ) (segid A and resid  53 and name HG2# )  3.0  1.2  0.8 
assign (segid A and resid   8 and name HD2# ) (segid B and resid  53 and name HG2# )  3.0  1.2  0.8 
assign (segid B and resid   8 and name HD2# ) (segid A and resid  53 and name HG2# )  3.0  1.2  0.8 
assign (segid A and resid   8 and name   HN ) (segid B and resid  54 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   8 and name   HN ) (segid A and resid  54 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid   8 and name   HN ) (segid B and resid  54 and name   HB )  4.0  2.2  1.0 
assign (segid B and resid   8 and name   HN ) (segid A and resid  54 and name   HB )  4.0  2.2  1.0 
assign (segid A and resid   8 and name   HN ) (segid B and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid   8 and name   HN ) (segid A and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid A and resid   8 and name   HA ) (segid B and resid  55 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid   8 and name   HA ) (segid A and resid  55 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid   8 and name  HB# ) (segid B and resid  55 and name   HB )  4.0  2.2  2.0 
assign (segid B and resid   8 and name  HB# ) (segid A and resid  55 and name   HB )  4.0  2.2  2.0 
assign (segid A and resid   8 and name   HN ) (segid B and resid  55 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid   8 and name   HN ) (segid A and resid  55 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid   8 and name  HB# ) (segid B and resid  55 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid   8 and name  HB# ) (segid A and resid  55 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid   8 and name  HB# ) (segid B and resid  55 and name HG2# )  3.0  1.2  0.8 
assign (segid B and resid   8 and name  HB# ) (segid A and resid  55 and name HG2# )  3.0  1.2  0.8 
assign (segid A and resid   8 and name HD2# ) (segid B and resid  55 and name HG2# )  4.0  2.2  1.5 
assign (segid B and resid   8 and name HD2# ) (segid A and resid  55 and name HG2# )  4.0  2.2  1.5 
assign (segid A and resid   8 and name   HN ) (segid B and resid  55 and name HG2# )  4.0  2.2  2.5 
assign (segid B and resid   8 and name   HN ) (segid A and resid  55 and name HG2# )  4.0  2.2  2.5 
assign (segid A and resid   8 and name HD2# ) (segid B and resid  55 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid   8 and name HD2# ) (segid A and resid  55 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid   8 and name   HN ) (segid B and resid  56 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid   8 and name   HN ) (segid A and resid  56 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid   8 and name  HB# ) (segid B and resid  56 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   8 and name  HB# ) (segid A and resid  56 and name   HN )  4.0  2.2  1.0 

!G9
assign (segid A and resid   9 and name   HN ) (segid B and resid  33 and name  HD# )  4.0  2.2  2.5 
assign (segid B and resid   9 and name   HN ) (segid A and resid  33 and name  HD# )  4.0  2.2  2.5 
assign (segid A and resid   9 and name   HN ) (segid B and resid  33 and name  HE# )  4.0  2.2  2.5 
assign (segid B and resid   9 and name   HN ) (segid A and resid  33 and name  HE# )  4.0  2.2  2.5 
assign (segid A and resid   9 and name  HA# ) (segid B and resid  33 and name  HD# )  4.0  2.2  1.5 
assign (segid B and resid   9 and name  HA# ) (segid A and resid  33 and name  HD# )  4.0  2.2  1.5 
assign (segid A and resid   9 and name  HA# ) (segid B and resid  33 and name  HE# )  3.0  1.2  1.3 
assign (segid B and resid   9 and name  HA# ) (segid A and resid  33 and name  HE# )  3.0  1.2  1.3 
assign (segid A and resid   9 and name  HA# ) (segid B and resid  56 and name  HB# )  4.0  2.2  2.0 
assign (segid B and resid   9 and name  HA# ) (segid A and resid  56 and name  HB# )  4.0  2.2  2.0 
assign (segid A and resid   9 and name  HA# ) (segid B and resid  56 and name  HG# )  4.0  2.2  2.0 
assign (segid B and resid   9 and name  HA# ) (segid A and resid  56 and name  HG# )  4.0  2.2  2.0 
assign (segid A and resid   9 and name  HA# ) (segid B and resid  56 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid   9 and name  HA# ) (segid A and resid  56 and name   HN )  4.0  2.2  1.0 

!K10
assign (segid A and resid  10 and name   HN ) (segid B and resid  33 and name  HD# )  4.0  2.2  2.5 
assign (segid B and resid  10 and name   HN ) (segid A and resid  33 and name  HD# )  4.0  2.2  2.5 
assign (segid A and resid  10 and name   HN ) (segid B and resid  33 and name  HE# )  4.0  2.2  2.5 
assign (segid B and resid  10 and name   HN ) (segid A and resid  33 and name  HE# )  4.0  2.2  2.0 
assign (segid A and resid  10 and name   HN ) (segid B and resid  56 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid  10 and name   HN ) (segid A and resid  56 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid  10 and name   HA ) (segid B and resid  56 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid  10 and name   HA ) (segid A and resid  56 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid  10 and name   HN ) (segid B and resid  56 and name  HG# )  4.0  2.2  1.0 
assign (segid B and resid  10 and name   HN ) (segid A and resid  56 and name  HG# )  4.0  2.2  1.0 
assign (segid A and resid  10 and name   HN ) (segid B and resid  56 and name  HB1 )  4.0  2.2  1.0 
assign (segid B and resid  10 and name   HN ) (segid A and resid  56 and name  HB1 )  4.0  2.2  1.0 
assign (segid A and resid  10 and name   HN ) (segid B and resid  56 and name  HB2 )  4.0  2.2  1.0 
assign (segid B and resid  10 and name   HN ) (segid A and resid  56 and name  HB2 )  4.0  2.2  1.0 
assign (segid A and resid  10 and name  HG# ) (segid B and resid  56 and name  HB# )  4.0  2.2  2.0 
assign (segid B and resid  10 and name  HG# ) (segid A and resid  56 and name  HB# )  4.0  2.2  2.0 
assign (segid A and resid  10 and name  HG# ) (segid B and resid  56 and name  HG# )  4.0  2.2  2.0 
assign (segid B and resid  10 and name  HG# ) (segid A and resid  56 and name  HG# )  4.0  2.2  2.0 
assign (segid A and resid  10 and name  HE# ) (segid B and resid  56 and name  HB# )  4.0  2.2  2.0 
assign (segid B and resid  10 and name  HE# ) (segid A and resid  56 and name  HB# )  4.0  2.2  2.0 
assign (segid A and resid  10 and name  HE# ) (segid B and resid  56 and name  HG# )  4.0  2.2  1.0 
assign (segid B and resid  10 and name  HE# ) (segid A and resid  56 and name  HG# )  4.0  2.2  1.0 

!T11
assign (segid A and resid 11 and name HN) (segid B and resid 18 and name HA)  4.0  2.2  2.0 
assign (segid B and resid 11 and name HN) (segid A and resid 18 and name HA)  4.0  2.2  2.0 
assign (segid A and resid 11 and name HG2#) (segid B and resid 18 and name HA)  4.0  2.2  2.5 
assign (segid B and resid 11 and name HG2#) (segid A and resid 18 and name HA)  4.0  2.2  2.5 
assign (segid A and resid 11 and name HA) (segid B and resid 19 and name HB#)  4.0  2.2  1.0 
assign (segid B and resid 11 and name HA) (segid A and resid 19 and name HB#)  4.0  2.2  1.0 
assign (segid A and resid 11 and name HB) (segid B and resid 19 and name HN)  4.0  2.2  1.0 
assign (segid B and resid 11 and name HB) (segid A and resid 19 and name HN)  4.0  2.2  1.0 
assign (segid A and resid 11 and name HB) (segid B and resid 19 and name HB#)  4.0  2.2  1.0 
assign (segid B and resid 11 and name HB) (segid A and resid 19 and name HB#)  4.0  2.2  1.0 
assign (segid A and resid 11 and name HG2#) (segid B and resid 19 and name HN)  4.0  2.2  1.5 
assign (segid B and resid 11 and name HG2#) (segid A and resid 19 and name HN)  4.0  2.2  1.5 
assign (segid A and resid 11 and name HG2#) (segid B and resid 19 and name HB#)  4.0  2.2  1.5 
assign (segid B and resid 11 and name HG2#) (segid A and resid 19 and name HB#)  4.0  2.2  1.5 
assign (segid A and resid 11 and name HA) (segid B and resid 29 and name HG*)  4.0  2.2  1.5 
assign (segid B and resid 11 and name HA) (segid A and resid 29 and name HG*)  4.0  2.2  1.5 
assign (segid A and resid 11 and name HB) (segid B and resid 29 and name HG*)  3.0  1.2  0.8 
assign (segid B and resid 11 and name HB) (segid A and resid 29 and name HG*)  3.0  1.2  0.8 
assign (segid A and resid 11 and name HG2#) (segid B and resid 29 and name HB)  4.0  2.2  2.5 
assign (segid B and resid 11 and name HG2#) (segid A and resid 29 and name HB)  4.0  2.2  2.5 
assign (segid A and resid 11 and name HB) (segid B and resid 33 and name HD#)  4.0  2.2  2.5 
assign (segid B and resid 11 and name HB) (segid A and resid 33 and name HD#)  4.0  2.2  2.5 
assign (segid A and resid 11 and name HG2#) (segid B and resid 33 and name HB#)  4.0  2.2  2.5 
assign (segid B and resid 11 and name HG2#) (segid A and resid 33 and name HB#)  4.0  2.2  2.5 
assign (segid A and resid 11 and name HG2#) (segid B and resid 33 and name HD#)  4.0  2.2  3.0 
assign (segid B and resid 11 and name HG2#) (segid A and resid 33 and name HD#)  4.0  2.2  3.0 

!L12
assign (segid A and resid 12 and name HA) (segid B and resid 16 and name HG2#)  4.0  2.2  2.5 
assign (segid B and resid 12 and name HA) (segid A and resid 16 and name HG2#)  4.0  2.2  2.5 
assign (segid A and resid 12 and name HB#) (segid B and resid 16 and name HB)  4.0  2.2  2.0 
assign (segid B and resid 12 and name HB#) (segid A and resid 16 and name HB)  4.0  2.2  2.0 
assign (segid A and resid 12 and name HB#) (segid B and resid 16 and name HG2#)  4.0  2.2  1.5 
assign (segid B and resid 12 and name HB#) (segid A and resid 16 and name HG2#)  4.0  2.2  1.5 
assign (segid A and resid 12 and name HG) (segid B and resid 16 and name HB)  4.0  2.2  2.0 
assign (segid B and resid 12 and name HG) (segid A and resid 16 and name HB)  4.0  2.2  2.0 
assign (segid A and resid 12 and name HD*) (segid B and resid 16 and name HA)  4.0  2.2  2.5 
assign (segid B and resid 12 and name HD*) (segid A and resid 16 and name HA)  4.0  2.2  2.5 
assign (segid A and resid 12 and name HD1#) (segid B and resid 16 and name HB)  4.0  2.2  1.5 
assign (segid B and resid 12 and name HD1#) (segid A and resid 16 and name HB)  4.0  2.2  1.5 
assign (segid A and resid 12 and name HD1#) (segid B and resid 16 and name HG2#)  3.0  1.2  1.3 
assign (segid B and resid 12 and name HD1#) (segid A and resid 16 and name HG2#)  3.0  1.2  1.3 
assign (segid A and resid 12 and name HD2#) (segid B and resid 16 and name HB)  4.0  2.2  1.5 
assign (segid B and resid 12 and name HD2#) (segid A and resid 16 and name HB)  4.0  2.2  1.5 
assign (segid A and resid 12 and name HD2#) (segid B and resid 16 and name HG2#)  3.0  1.2  1.3 
assign (segid B and resid 12 and name HD2#) (segid A and resid 16 and name HG2#)  3.0  1.2  1.3 
assign (segid A and resid 12 and name HA) (segid B and resid 17 and name HN)  4.0  2.2  1.0 
assign (segid B and resid 12 and name HA) (segid A and resid 17 and name HN)  4.0  2.2  1.0 
assign (segid A and resid 12 and name HA) (segid B and resid 17 and name HG2#)  4.0  2.2  2.5 
assign (segid B and resid 12 and name HA) (segid A and resid 17 and name HG2#)  4.0  2.2  2.5 
assign (segid A and resid 12 and name HB#) (segid B and resid 17 and name HN)  4.0  2.2  2.0 
assign (segid B and resid 12 and name HB#) (segid A and resid 17 and name HN)  4.0  2.2  2.0 
assign (segid A and resid 12 and name HD*) (segid B and resid 17 and name HN)  4.0  2.2  1.5 
assign (segid B and resid 12 and name HD*) (segid A and resid 17 and name HN)  4.0  2.2  1.5 
assign (segid A and resid 12 and name HA) (segid B and resid 18 and name HA)  3.0  1.2  0.3 
assign (segid B and resid 12 and name HA) (segid A and resid 18 and name HA)  3.0  1.2  0.3 
assign (segid A and resid 12 and name HA) (segid B and resid 18 and name HB)  4.0  2.2  1.0 
assign (segid B and resid 12 and name HA) (segid A and resid 18 and name HB)  4.0  2.2  1.0 
assign (segid A and resid 12 and name HB#) (segid B and resid 18 and name HN)  4.0  2.2  1.0 
assign (segid B and resid 12 and name HB#) (segid A and resid 18 and name HN)  4.0  2.2  1.0 
assign (segid A and resid 12 and name HB*) (segid B and resid 18 and name HA)  4.0  2.2  1.5 
assign (segid B and resid 12 and name HB*) (segid A and resid 18 and name HA)  4.0  2.2  1.5 
assign (segid A and resid 12 and name HB#) (segid B and resid 18 and name HB)  3.0  1.2  0.3 
assign (segid B and resid 12 and name HB#) (segid A and resid 18 and name HB)  3.0  1.2  0.3 
assign (segid A and resid 12 and name HB#) (segid B and resid 18 and name HG1)  3.0  1.2  0.3 
assign (segid B and resid 12 and name HB#) (segid A and resid 18 and name HG1)  3.0  1.2  0.3 
assign (segid A and resid 12 and name HG) (segid B and resid 18 and name HA)  4.0  2.2  1.0 
assign (segid B and resid 12 and name HG) (segid A and resid 18 and name HA)  4.0  2.2  1.0 
assign (segid A and resid 12 and name HG) (segid B and resid 18 and name HB)  4.0  2.2  1.0 
assign (segid B and resid 12 and name HG) (segid A and resid 18 and name HB)  4.0  2.2  1.0 
assign (segid A and resid 12 and name HD*) (segid B and resid 18 and name HA)  4.0  2.2  1.5 
assign (segid B and resid 12 and name HD*) (segid A and resid 18 and name HA)  4.0  2.2  1.5 
assign (segid A and resid 12 and name HD1#) (segid B and resid 18 and name HB)  4.0  2.2  1.5 
assign (segid B and resid 12 and name HD1#) (segid A and resid 18 and name HB)  4.0  2.2  1.5 
assign (segid A and resid 12 and name HD2#) (segid B and resid 18 and name HB)  4.0  2.2  1.5 
assign (segid B and resid 12 and name HD2#) (segid A and resid 18 and name HB)  4.0  2.2  1.5 
assign (segid A and resid 12 and name HD1#) (segid B and resid 18 and name HG1)  4.0  2.2  1.5 
assign (segid B and resid 12 and name HD1#) (segid A and resid 18 and name HG1)  4.0  2.2  1.5 
assign (segid A and resid 12 and name HD2#) (segid B and resid 18 and name HG1)  4.0  2.2  1.5 
assign (segid B and resid 12 and name HD2#) (segid A and resid 18 and name HG1)  4.0  2.2  1.5 
assign (segid A and resid 12 and name HD*) (segid B and resid 18 and name HG2#)  4.0  2.2  2.0 
assign (segid B and resid 12 and name HD*) (segid A and resid 18 and name HG2#)  4.0  2.2  2.0 
assign (segid A and resid 12 and name HN) (segid B and resid 19 and name HN)  4.0  2.2  2.0 
assign (segid B and resid 12 and name HN) (segid A and resid 19 and name HN)  4.0  2.2  2.0 
assign (segid A and resid 12 and name HB#) (segid B and resid 29 and name HG*)  4.0  2.2  2.5 
assign (segid B and resid 12 and name HB#) (segid A and resid 29 and name HG*)  4.0  2.2  2.5 
assign (segid A and resid 12 and name HD*) (segid B and resid 29 and name HB)  4.0  2.2  2.5 
assign (segid B and resid 12 and name HD*) (segid A and resid 29 and name HB)  4.0  2.2  2.5 
assign (segid A and resid 12 and name HD1#) (segid B and resid 29 and name HG*)  3.0  1.2  1.5 
assign (segid B and resid 12 and name HD1#) (segid A and resid 29 and name HG*)  3.0  1.2  1.5 
assign (segid A and resid 12 and name HD2#) (segid B and resid 29 and name HG*)  3.0  1.2  1.5 
assign (segid B and resid 12 and name HD2#) (segid A and resid 29 and name HG*)  3.0  1.2  1.5 
assign (segid A and resid 12 and name HG) (segid B and resid 30 and name HA)  4.0  2.2  1.0 
assign (segid B and resid 12 and name HG) (segid A and resid 30 and name HA)  4.0  2.2  1.0 
assign (segid A and resid 12 and name HD*) (segid B and resid 30 and name HN)  4.0  2.2  1.5 
assign (segid B and resid 12 and name HD*) (segid A and resid 30 and name HN)  4.0  2.2  1.5 
assign (segid A and resid 12 and name HD*) (segid B and resid 30 and name HA)  3.0  1.2  0.8 
assign (segid B and resid 12 and name HD*) (segid A and resid 30 and name HA)  3.0  1.2  0.8 
assign (segid A and resid 12 and name HD*) (segid B and resid 30 and name HB)  4.0  2.2  2.5 
assign (segid B and resid 12 and name HD*) (segid A and resid 30 and name HB)  4.0  2.2  2.5 
assign (segid A and resid 12 and name HD*) (segid B and resid 30 and name HG*)  2.5  0.7  1.2 
assign (segid B and resid 12 and name HD*) (segid A and resid 30 and name HG*)  2.5  0.7  1.2 
assign (segid A and resid 12 and name HB#) (segid B and resid 33 and name HD#)  4.0  2.2  2.5 
assign (segid B and resid 12 and name HB#) (segid A and resid 33 and name HD#)  4.0  2.2  2.5 
assign (segid A and resid 12 and name HG) (segid B and resid 33 and name HD#)  4.0  2.2  2.5 
assign (segid B and resid 12 and name HG) (segid A and resid 33 and name HD#)  4.0  2.2  2.5 
assign (segid A and resid 12 and name HG) (segid B and resid 33 and name HE#)  4.0  2.2  2.5 
assign (segid B and resid 12 and name HG) (segid A and resid 33 and name HE#)  4.0  2.2  2.5 
assign (segid A and resid 12 and name HD*) (segid B and resid 33 and name HN)  4.0  2.2  1.5 
assign (segid B and resid 12 and name HD*) (segid A and resid 33 and name HN)  4.0  2.2  1.5 
assign (segid A and resid 12 and name HD*) (segid B and resid 33 and name HA)  4.0  2.2  1.5 
assign (segid B and resid 12 and name HD*) (segid A and resid 33 and name HA)  4.0  2.2  1.5 
assign (segid A and resid 12 and name HD1#) (segid B and resid 33 and name HB1)  4.0  2.2  1.5 
assign (segid B and resid 12 and name HD1#) (segid A and resid 33 and name HB1)  4.0  2.2  1.5 
assign (segid A and resid 12 and name HD1#) (segid B and resid 33 and name HB2)  4.0  2.2  1.5 
assign (segid B and resid 12 and name HD1#) (segid A and resid 33 and name HB2)  4.0  2.2  1.5 
assign (segid A and resid 12 and name HD2#) (segid B and resid 33 and name HB1)  4.0  2.2  1.5 
assign (segid B and resid 12 and name HD2#) (segid A and resid 33 and name HB1)  4.0  2.2  1.5 
assign (segid A and resid 12 and name HD2#) (segid B and resid 33 and name HB2)  4.0  2.2  1.5 
assign (segid B and resid 12 and name HD2#) (segid A and resid 33 and name HB2)  4.0  2.2  1.5 
assign (segid A and resid 12 and name HD1#) (segid B and resid 33 and name HD*)  4.0  2.2  2.0 
assign (segid B and resid 12 and name HD1#) (segid A and resid 33 and name HD*)  4.0  2.2  2.0 
assign (segid A and resid 12 and name HD1#) (segid B and resid 33 and name HE*)  4.0  2.2  2.0 
assign (segid B and resid 12 and name HD1#) (segid A and resid 33 and name HE*)  4.0  2.2  2.0 
assign (segid A and resid 12 and name HD2#) (segid B and resid 33 and name HD*)  4.0  2.2  2.0 
assign (segid B and resid 12 and name HD2#) (segid A and resid 33 and name HD*)  4.0  2.2  2.0 
assign (segid A and resid 12 and name HD2#) (segid B and resid 33 and name HE*)  4.0  2.2  2.0 
assign (segid B and resid 12 and name HD2#) (segid A and resid 33 and name HE*)  4.0  2.2  2.0 
assign (segid A and resid  12 and name  HD* ) (segid B and resid  33 and name   HZ )  4.0  2.2  1.5 
assign (segid B and resid  12 and name  HD* ) (segid A and resid  33 and name   HZ )  4.0  2.2  1.5 
assign (segid A and resid 12 and name HD*) (segid B and resid 34 and name HN)  4.0  2.2  2.5 
assign (segid B and resid 12 and name HD*) (segid A and resid 34 and name HN)  4.0  2.2  2.5 
assign (segid A and resid  12 and name  HD* ) (segid B and resid  34 and name  HD# )  4.0  2.2  3.0 
assign (segid B and resid  12 and name  HD* ) (segid A and resid  34 and name  HD# )  4.0  2.2  3.0 
assign (segid A and resid  12 and name  HD* ) (segid B and resid  34 and name  HE# )  4.0  2.2  2.0 
assign (segid B and resid  12 and name  HD* ) (segid A and resid  34 and name  HE# )  4.0  2.2  2.0 

!K13
assign (segid A and resid 13 and name HN) (segid B and resid 16 and name HA)  4.0  2.2  2.0 
assign (segid B and resid 13 and name HN) (segid A and resid 16 and name HA)  4.0  2.2  2.0 
assign (segid A and resid 13 and name HN) (segid B and resid 16 and name HB)  4.0  2.2  2.0 
assign (segid B and resid 13 and name HN) (segid A and resid 16 and name HB)  4.0  2.2  2.0 
assign (segid A and resid 13 and name HN) (segid B and resid 16 and name HG2#)  4.0  2.2  1.5 
assign (segid B and resid 13 and name HN) (segid A and resid 16 and name HG2#)  4.0  2.2  1.5 
assign (segid A and resid 13 and name HN) (segid B and resid 17 and name HN)  3.0  1.2  0.5 
assign (segid B and resid 13 and name HN) (segid A and resid 17 and name HN)  3.0  1.2  0.5 
assign (segid A and resid 13 and name HN) (segid B and resid 17 and name HB)  4.0  2.2  1.0 
assign (segid B and resid 13 and name HN) (segid A and resid 17 and name HB)  4.0  2.2  1.0 
assign (segid A and resid 13 and name HN) (segid B and resid 17 and name HG2#)  4.0  2.2  1.5 
assign (segid B and resid 13 and name HN) (segid A and resid 17 and name HG2#)  4.0  2.2  1.5 
assign (segid A and resid 13 and name HB#) (segid B and resid 17 and name HN)  4.0  2.2  1.0 
assign (segid B and resid 13 and name HB#) (segid A and resid 17 and name HN)  4.0  2.2  1.0 
assign (segid A and resid 13 and name HN) (segid B and resid 18 and name HA)  4.0  2.2  2.0 
assign (segid B and resid 13 and name HN) (segid A and resid 18 and name HA)  4.0  2.2  2.0 
assign (segid A and resid 13 and name HN) (segid B and resid 18 and name HB)  4.0  2.2  2.0 
assign (segid B and resid 13 and name HN) (segid A and resid 18 and name HB)  4.0  2.2  2.0 
assign (segid A and resid 13 and name HN) (segid B and resid 18 and name HG1)  4.0  2.2  1.0 
assign (segid B and resid 13 and name HN) (segid A and resid 18 and name HG1)  4.0  2.2  1.0 

!G14
assign (segid A and resid 14 and name HA#) (segid B and resid 16 and name HN)  4.0  2.2  1.0 
assign (segid B and resid 14 and name HA#) (segid A and resid 16 and name HN)  4.0  2.2  1.0 
assign (segid A and resid 14 and name HA#) (segid B and resid 16 and name HA)  2.5  0.7  0.2 
assign (segid B and resid 14 and name HA#) (segid A and resid 16 and name HA)  2.5  0.7  0.2 
assign (segid A and resid 14 and name HA#) (segid B and resid 16 and name HB)  4.0  2.2  1.0 
assign (segid B and resid 14 and name HA#) (segid A and resid 16 and name HB)  4.0  2.2  1.0 
assign (segid A and resid 14 and name HA#) (segid B and resid 16 and name HG1)  4.0  2.2  1.0 
assign (segid B and resid 14 and name HA#) (segid A and resid 16 and name HG1)  4.0  2.2  1.0 
assign (segid A and resid 14 and name HA#) (segid B and resid 16 and name HG2#)  3.0 1.2 0.8 
assign (segid B and resid 14 and name HA#) (segid A and resid 16 and name HG2#)  3.0 1.2 0.8 
assign (segid A and resid 14 and name HA#) (segid B and resid 17 and name HN)  3.0  1.2  0.5 
assign (segid B and resid 14 and name HA#) (segid A and resid 17 and name HN)  3.0  1.2  0.5 

!E15
assign (segid A and resid 15 and name HN) (segid B and resid 16 and name HA)  3.0  1.2  0.5 
assign (segid B and resid 15 and name HN) (segid A and resid 16 and name HA)  3.0  1.2  0.5 
assign (segid A and resid 15 and name HN) (segid B and resid 16 and name HB)  4.0  2.2  2.0 
assign (segid B and resid 15 and name HN) (segid A and resid 16 and name HB)  4.0  2.2  2.0 
assign (segid A and resid 15 and name HN) (segid B and resid 16 and name HG2#)  4.0  2.2  2.5 
assign (segid B and resid 15 and name HN) (segid A and resid 16 and name HG2#)  4.0  2.2  2.5 

!T18
assign (segid A and resid  18 and name HG2# ) (segid B and resid  52 and name  HD# )  4.0  2.2  3.0 
assign (segid B and resid  18 and name HG2# ) (segid A and resid  52 and name  HD# )  4.0  2.2  3.0 
assign (segid A and resid  18 and name HG2# ) (segid B and resid  52 and name  HE# )  4.0  2.2  2.0 
assign (segid B and resid  18 and name HG2# ) (segid A and resid  52 and name  HE# )  4.0  2.2  2.0 

!A20
assign (segid A and resid  20 and name  HB# ) (segid B and resid  52 and name  HE# )  4.0  2.2  2.0 
assign (segid B and resid  20 and name  HB# ) (segid A and resid  52 and name  HE# )  4.0  2.2  2.0 

!A23
assign (segid A and resid  23 and name  HB# ) (segid B and resid  45 and name  HE# )  4.0  2.2  2.0 
assign (segid B and resid  23 and name  HB# ) (segid A and resid  45 and name  HE# )  4.0  2.2  2.0 
assign (segid A and resid  23 and name  HB# ) (segid B and resid  50 and name   HA )  4.0  2.2  2.5 
assign (segid B and resid  23 and name  HB# ) (segid A and resid  50 and name   HA )  4.0  2.2  2.5 
assign (segid A and resid  23 and name   HA ) (segid B and resid  52 and name  HD# )  4.0  2.2  2.5 
assign (segid B and resid  23 and name   HA ) (segid A and resid  52 and name  HD# )  4.0  2.2  2.5 
assign (segid A and resid  23 and name   HA ) (segid B and resid  52 and name  HE# )  3.0  1.2  0.8 
assign (segid B and resid  23 and name   HA ) (segid A and resid  52 and name  HE# )  3.0  1.2  0.8 
assign (segid A and resid  23 and name  HB# ) (segid B and resid  52 and name  HD# )  4.0  2.2  2.0 
assign (segid B and resid  23 and name  HB# ) (segid A and resid  52 and name  HD# )  4.0  2.2  2.0 
assign (segid A and resid  23 and name  HB# ) (segid B and resid  52 and name  HE# )  2.5  0.7  1.2 
assign (segid B and resid  23 and name  HB# ) (segid A and resid  52 and name  HE# )  2.5  0.7  1.2 

!A24
assign (segid A and resid  24 and name   HA ) (segid B and resid  52 and name  HE# )  4.0  2.2  1.5 
assign (segid B and resid  24 and name   HA ) (segid A and resid  52 and name  HE# )  4.0  2.2  1.5 

!A26
assign (segid A and resid  26 and name   HA ) (segid B and resid  52 and name  HE# )  4.0  2.2  2.5 
assign (segid B and resid  26 and name   HA ) (segid A and resid  52 and name  HE# )  4.0  2.2  2.5 
assign (segid A and resid  26 and name  HB# ) (segid B and resid  52 and name  HD# )  4.0  2.2  2.0 
assign (segid B and resid  26 and name  HB# ) (segid A and resid  52 and name  HD# )  4.0  2.2  2.0 
assign (segid A and resid  26 and name  HB# ) (segid B and resid  52 and name  HE# )  2.5  0.7  1.2 
assign (segid B and resid  26 and name  HB# ) (segid A and resid  52 and name  HE# )  2.5  0.7  1.2 

!E27
assign (segid A and resid  27 and name   HA ) (segid B and resid  43 and name  HE3 )  4.0  2.2  2.0 
assign (segid B and resid  27 and name   HA ) (segid A and resid  43 and name  HE3 )  4.0  2.2  2.0 
assign (segid A and resid  27 and name   HA ) (segid B and resid  43 and name  HH2 )  4.0  2.2  2.0 
assign (segid B and resid  27 and name   HA ) (segid A and resid  43 and name  HH2 )  4.0  2.2  2.0 
assign (segid A and resid  27 and name   HA ) (segid B and resid  43 and name  HZ3 )  3.0  1.2  0.3 
assign (segid B and resid  27 and name   HA ) (segid A and resid  43 and name  HZ3 )  3.0  1.2  0.3 
assign (segid A and resid  27 and name  HG# ) (segid B and resid  43 and name  HZ3 )  4.0  2.2  2.0 
assign (segid B and resid  27 and name  HG# ) (segid A and resid  43 and name  HZ3 )  4.0  2.2  2.0 
assign (segid A and resid  27 and name  HG# ) (segid B and resid  43 and name  HE3 )  4.0  2.2  1.0 
assign (segid B and resid  27 and name  HG# ) (segid A and resid  43 and name  HE3 )  4.0  2.2  1.0 
assign (segid A and resid  27 and name  HB# ) (segid B and resid  43 and name  HZ3 )  4.0  2.2  2.0 
assign (segid B and resid  27 and name  HB# ) (segid A and resid  43 and name  HZ3 )  4.0  2.2  2.0 
assign (segid A and resid  27 and name  HB# ) (segid B and resid  45 and name  HB# )  4.0  2.2  2.0 
assign (segid B and resid  27 and name  HB# ) (segid A and resid  45 and name  HB# )  4.0  2.2  2.0 
assign (segid A and resid  27 and name   HA ) (segid B and resid  52 and name  HE# )  4.0  2.2  1.5 
assign (segid B and resid  27 and name   HA ) (segid A and resid  52 and name  HE# )  4.0  2.2  1.5 
assign (segid A and resid  27 and name  HG# ) (segid B and resid  52 and name  HE# )  4.0  2.2  2.5 
assign (segid B and resid  27 and name  HG# ) (segid A and resid  52 and name  HE# )  4.0  2.2  2.5 
assign (segid A and resid  27 and name  HG# ) (segid B and resid  52 and name   HZ )  4.0  2.2  2.0 
assign (segid B and resid  27 and name  HG# ) (segid A and resid  52 and name   HZ )  4.0  2.2  2.0 
assign (segid A and resid  27 and name  HB# ) (segid B and resid  52 and name  HD# )  4.0  2.2  1.5 
assign (segid B and resid  27 and name  HB# ) (segid A and resid  52 and name  HD# )  4.0  2.2  1.5 
assign (segid A and resid  27 and name  HB# ) (segid B and resid  52 and name  HE# )  3.0  1.2  0.8 
assign (segid B and resid  27 and name  HB# ) (segid A and resid  52 and name  HE# )  3.0  1.2  0.8 
assign (segid A and resid  27 and name   HN ) (segid B and resid  52 and name  HE# )  3.0  1.2  1.0 
assign (segid B and resid  27 and name   HN ) (segid A and resid  52 and name  HE# )  3.0  1.2  1.0 

!V30
assign (segid A and resid  30 and name   HB ) (segid B and resid  43 and name  HH2 )  3.0  1.2  0.3 
assign (segid B and resid  30 and name   HB ) (segid A and resid  43 and name  HH2 )  3.0  1.2  0.3 
assign (segid A and resid  30 and name   HB ) (segid B and resid  43 and name  HZ2 )  4.0  2.2  2.0 
assign (segid B and resid  30 and name   HB ) (segid A and resid  43 and name  HZ2 )  4.0  2.2  2.0 
assign (segid A and resid  30 and name   HB ) (segid B and resid  43 and name  HZ3 )  4.0  2.2  1.0 
assign (segid B and resid  30 and name   HB ) (segid A and resid  43 and name  HZ3 )  4.0  2.2  1.0 
assign (segid A and resid  30 and name  HG* ) (segid B and resid  43 and name  HE3 )  4.0  2.2  2.5 
assign (segid B and resid  30 and name  HG* ) (segid A and resid  43 and name  HE3 )  4.0  2.2  2.5 
assign (segid A and resid  30 and name  HG* ) (segid B and resid  43 and name  HZ2 )  4.0  2.2  1.5 
assign (segid B and resid  30 and name  HG* ) (segid A and resid  43 and name  HZ2 )  4.0  2.2  1.5 
assign (segid A and resid  30 and name  HG* ) (segid B and resid  43 and name  HZ3 )  4.0  2.2  1.5 
assign (segid B and resid  30 and name  HG* ) (segid A and resid  43 and name  HZ3 )  4.0  2.2  1.5 
assign (segid A and resid  30 and name  HG* ) (segid B and resid  43 and name  HH2 )  3.0  1.2  0.8 
assign (segid B and resid  30 and name  HG* ) (segid A and resid  43 and name  HH2 )  3.0  1.2  0.8 
assign (segid A and resid  30 and name  HG* ) (segid B and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid  30 and name  HG* ) (segid A and resid  54 and name  HG* )  4.0  2.2  1.5 

!K31
assign (segid A and resid  31 and name   HA ) (segid B and resid  39 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid  31 and name   HA ) (segid A and resid  39 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid  31 and name  HB# ) (segid B and resid  39 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid  31 and name  HB# ) (segid A and resid  39 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid  31 and name  HB# ) (segid B and resid  39 and name  HG* )  4.0  2.2  2.5 
assign (segid B and resid  31 and name  HB# ) (segid A and resid  39 and name  HG* )  4.0  2.2  2.5 
assign (segid A and resid  31 and name  HG# ) (segid B and resid  39 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid  31 and name  HG# ) (segid A and resid  39 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid  31 and name  HD# ) (segid B and resid  39 and name   HA )  4.0  2.2  1.0 
assign (segid B and resid  31 and name  HD# ) (segid A and resid  39 and name   HA )  4.0  2.2  1.0 
assign (segid A and resid  31 and name  HE# ) (segid B and resid  39 and name   HA )  4.0  2.2  2.0 
assign (segid B and resid  31 and name  HE# ) (segid A and resid  39 and name   HA )  4.0  2.2  2.0 
assign (segid A and resid  31 and name   HA ) (segid B and resid  43 and name  HZ2 )  4.0  2.2  1.0 
assign (segid B and resid  31 and name   HA ) (segid A and resid  43 and name  HZ2 )  4.0  2.2  1.0 
assign (segid A and resid  31 and name   HA ) (segid B and resid  43 and name  HH2 )  4.0  2.2  2.0 
assign (segid B and resid  31 and name   HA ) (segid A and resid  43 and name  HH2 )  4.0  2.2  2.0 
assign (segid A and resid  31 and name  HE# ) (segid B and resid  43 and name  HD1 )  4.0  2.2  2.0 
assign (segid B and resid  31 and name  HE# ) (segid A and resid  43 and name  HD1 )  4.0  2.2  2.0 
assign (segid A and resid  31 and name  HE# ) (segid B and resid  43 and name  HZ2 )  4.0  2.2  1.0 
assign (segid B and resid  31 and name  HE# ) (segid A and resid  43 and name  HZ2 )  4.0  2.2  1.0 
assign (segid A and resid  31 and name  HE# ) (segid B and resid  43 and name  HE1 )  4.0  2.2  1.0 
assign (segid B and resid  31 and name  HE# ) (segid A and resid  43 and name  HE1 )  4.0  2.2  1.0 
assign (segid A and resid  31 and name  HG# ) (segid B and resid  43 and name  HZ2 )  4.0  2.2  1.0 
assign (segid B and resid  31 and name  HG# ) (segid A and resid  43 and name  HZ2 )  4.0  2.2  1.0 
assign (segid A and resid  31 and name  HD# ) (segid B and resid  43 and name  HZ2 )  4.0  2.2  2.0 
assign (segid B and resid  31 and name  HD# ) (segid A and resid  43 and name  HZ2 )  4.0  2.2  2.0 
assign (segid A and resid  31 and name   HN ) (segid B and resid  43 and name  HH2 )  4.0  2.2  1.0 
assign (segid B and resid  31 and name   HN ) (segid A and resid  43 and name  HH2 )  4.0  2.2  1.0 

!F33
assign (segid A and resid  33 and name  HD# ) (segid B and resid  54 and name  HG* )  4.0  2.2  3.0 
assign (segid B and resid  33 and name  HD# ) (segid A and resid  54 and name  HG* )  4.0  2.2  3.0 
assign (segid A and resid  33 and name  HE# ) (segid B and resid  54 and name  HG* )  4.0  2.2  3.0 
assign (segid B and resid  33 and name  HE# ) (segid A and resid  54 and name  HG* )  4.0  2.2  3.0 

!F34
assign (segid A and resid  34 and name   HA ) (segid B and resid  34 and name  HD# )  4.0  2.2  1.5 
assign (segid B and resid  34 and name   HA ) (segid A and resid  34 and name  HD# )  4.0  2.2  1.5 
assign (segid A and resid  34 and name   HA ) (segid B and resid  34 and name  HE# )  4.0  2.2  2.5 
assign (segid B and resid  34 and name   HA ) (segid A and resid  34 and name  HE# )  4.0  2.2  2.5 
assign (segid A and resid  34 and name  HE# ) (segid B and resid  37 and name  HB# )  4.0  2.2  1.5 
assign (segid B and resid  34 and name  HE# ) (segid A and resid  37 and name  HB# )  4.0  2.2  1.5 
assign (segid A and resid  34 and name  HD# ) (segid B and resid  37 and name  HB# )  4.0  2.2  1.0 
assign (segid B and resid  34 and name  HD# ) (segid A and resid  37 and name  HB# )  4.0  2.2  1.0 
assign (segid A and resid  34 and name  HB# ) (segid B and resid  38 and name  HA# )  4.0  2.2  1.0 
assign (segid B and resid  34 and name  HB# ) (segid A and resid  38 and name  HA# )  4.0  2.2  1.0 
assign (segid A and resid  34 and name   HA ) (segid B and resid  38 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  34 and name   HA ) (segid A and resid  38 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  34 and name  HB# ) (segid B and resid  38 and name   HN )  4.0  2.2  1.0 
assign (segid B and resid  34 and name  HB# ) (segid A and resid  38 and name   HN )  4.0  2.2  1.0 
assign (segid A and resid  34 and name  HD# ) (segid B and resid  38 and name  HA# )  4.0  2.2  1.5 
assign (segid B and resid  34 and name  HD# ) (segid A and resid  38 and name  HA# )  4.0  2.2  1.5 
assign (segid A and resid  34 and name  HB# ) (segid B and resid  39 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid  34 and name  HB# ) (segid A and resid  39 and name  HG* )  4.0  2.2  1.5 
assign (segid A and resid  34 and name  HD# ) (segid B and resid  39 and name  HG* )  4.0  2.2  2.0 
assign (segid B and resid  34 and name  HD# ) (segid A and resid  39 and name  HG* )  4.0  2.2  2.0 
assign (segid A and resid  34 and name  HB# ) (segid B and resid  39 and name   HN )  4.0  2.2  2.0 
assign (segid B and resid  34 and name  HB# ) (segid A and resid  39 and name   HN )  4.0  2.2  2.0 
assign (segid A and resid  34 and name  HD# ) (segid B and resid  43 and name  HH2 )  4.0  2.2  2.5 
assign (segid B and resid  34 and name  HD# ) (segid A and resid  43 and name  HH2 )  4.0  2.2  2.5 
assign (segid A and resid  34 and name  HD# ) (segid B and resid  43 and name  HZ2 )  4.0  2.2  1.5 
assign (segid B and resid  34 and name  HD# ) (segid A and resid  43 and name  HZ2 )  4.0  2.2  1.5 
assign (segid A and resid  34 and name  HE# ) (segid B and resid  43 and name  HH2 )  3.0  1.2  0.8 
assign (segid B and resid  34 and name  HE# ) (segid A and resid  43 and name  HH2 )  3.0  1.2  0.8 
assign (segid A and resid  34 and name  HE# ) (segid B and resid  43 and name  HZ2 )  3.0  1.2  0.8 
assign (segid B and resid  34 and name  HE# ) (segid A and resid  43 and name  HZ2 )  3.0  1.2  0.8 
assign (segid A and resid  34 and name  HE# ) (segid B and resid  54 and name   HB )  4.0  2.2  1.5 
assign (segid B and resid  34 and name  HE# ) (segid A and resid  54 and name   HB )  4.0  2.2  1.5 
assign (segid A and resid  34 and name   HZ ) (segid B and resid  54 and name   HB )  4.0  2.2  1.0 
assign (segid B and resid  34 and name   HZ ) (segid A and resid  54 and name   HB )  4.0  2.2  1.0 
assign (segid A and resid  34 and name  HD# ) (segid B and resid  54 and name  HG* )  4.0  2.2  3.0 
assign (segid B and resid  34 and name  HD# ) (segid A and resid  54 and name  HG* )  4.0  2.2  3.0 
assign (segid A and resid  34 and name  HE# ) (segid B and resid  54 and name  HG* )  4.0  2.2  2.0 
assign (segid B and resid  34 and name  HE# ) (segid A and resid  54 and name  HG* )  4.0  2.2  2.0 
assign (segid A and resid  34 and name   HZ ) (segid B and resid  54 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid  34 and name   HZ ) (segid A and resid  54 and name  HG* )  4.0  2.2  1.5 

!N35
assign (segid A and resid  35 and name   HA ) (segid B and resid  39 and name   HB )  4.0  2.2  1.0 
assign (segid B and resid  35 and name   HA ) (segid A and resid  39 and name   HB )  4.0  2.2  1.0 
assign (segid A and resid  35 and name   HA ) (segid B and resid  39 and name  HG* )  3.0  1.2  0.8 
assign (segid B and resid  35 and name   HA ) (segid A and resid  39 and name  HG* )  3.0  1.2  0.8 
assign (segid A and resid  35 and name  HB# ) (segid B and resid  39 and name  HG* )  3.0  1.2  0.8 
assign (segid B and resid  35 and name  HB# ) (segid A and resid  39 and name  HG* )  3.0  1.2  0.8 
assign (segid A and resid  35 and name HD2# ) (segid B and resid  39 and name  HG* )  4.0  2.2  1.5 
assign (segid B and resid  35 and name HD2# ) (segid A and resid  39 and name  HG* )  4.0  2.2  1.5 


!INTRAMOLECULAR H-BONDS
!unit A
assign (segid A and resid  22 and name o ) (segid A and resid  26 and name hn )  2.3 0.8 0.2
assign (segid A and resid  22 and name o ) (segid A and resid  26 and name n )  3.3 0.8 0.2
assign (segid A and resid  23 and name o ) (segid A and resid  27 and name hn )  2.3 0.8 0.2
assign (segid A and resid  23 and name o ) (segid A and resid  27 and name n )  3.3 0.8 0.2
assign (segid A and resid  24 and name o ) (segid A and resid  28 and name hn )  2.3 0.8 0.2
assign (segid A and resid  24 and name o ) (segid A and resid  28 and name n )  3.3 0.8 0.2
assign (segid A and resid  25 and name o ) (segid A and resid  29 and name hn )  2.3 0.8 0.2
assign (segid A and resid  25 and name o ) (segid A and resid  29 and name n )  3.3 0.8 0.2
assign (segid A and resid  26 and name o ) (segid A and resid  30 and name hn )  2.3 0.8 0.2
assign (segid A and resid  26 and name o ) (segid A and resid  30 and name n )  3.3 0.8 0.2 
assign (segid A and resid  27 and name o ) (segid A and resid  31 and name hn )  2.3 0.8 0.2
assign (segid A and resid  27 and name o ) (segid A and resid  31 and name n )  3.3 0.8 0.2
assign (segid A and resid  28 and name o ) (segid A and resid  32 and name hn )  2.3 0.8 0.2
assign (segid A and resid  28 and name o ) (segid A and resid  32 and name n )  3.3 0.8 0.2
assign (segid A and resid  29 and name o ) (segid A and resid  33 and name hn )  2.3 0.8 0.2
assign (segid A and resid  29 and name o ) (segid A and resid  33 and name n )  3.3 0.8 0.2
assign (segid A and resid  30 and name o ) (segid A and resid  34 and name hn )  2.3 0.8 0.2
assign (segid A and resid  30 and name o ) (segid A and resid  34 and name n )  3.3 0.8 0.2
assign (segid A and resid  31 and name o ) (segid A and resid  35 and name hn )  2.3 0.8 0.2
assign (segid A and resid  31 and name o ) (segid A and resid  35 and name n )  3.3 0.8 0.2
assign (segid A and resid  32 and name o ) (segid A and resid  36 and name hn )  2.3 0.8 0.2
assign (segid A and resid  32 and name o ) (segid A and resid  36 and name n )  3.3 0.8 0.2

assign (segid A and resid  20 and name hn ) (segid A and resid   1 and name o )  2.3 0.8 0.2
assign (segid A and resid  20 and name n ) (segid A and resid   1 and name o )  3.3 0.8 0.2
assign (segid A and resid   3 and name hn ) (segid A and resid  18 and name o )  2.3 0.8 0.2
assign (segid A and resid   3 and name n ) (segid A and resid  18 and name o )  3.3 0.8 0.2
assign (segid A and resid  18 and name hn ) (segid A and resid   3 and name o )  2.3 0.8 0.2
assign (segid A and resid  18 and name n ) (segid A and resid   3 and name o )  3.3 0.8 0.2
assign (segid A and resid   5 and name hn ) (segid A and resid  16 and name o )  2.3 0.8 0.2
assign (segid A and resid   5 and name n ) (segid A and resid  16 and name o )  3.3 0.8 0.2
assign (segid A and resid  16 and name hn ) (segid A and resid   5 and name o )  2.3 0.8 0.2
assign (segid A and resid  16 and name n ) (segid A and resid   5 and name o )  3.3 0.8 0.2
assign (segid A and resid   7 and name hn ) (segid A and resid  14 and name o )  2.3 0.8 0.2
assign (segid A and resid   7 and name n ) (segid A and resid  14 and name o )  3.3 0.8 0.2
assign (segid A and resid  14 and name hn ) (segid A and resid   7 and name o )  2.3 0.8 0.2
assign (segid A and resid  14 and name n ) (segid A and resid   7 and name o )  3.3 0.8 0.2
assign (segid A and resid   9 and name hn ) (segid A and resid  12 and name o )  2.3 0.8 0.2
assign (segid A and resid   9 and name n ) (segid A and resid  12 and name o )  3.3 0.8 0.2

assign (segid A and resid  50 and name hn ) (segid A and resid  47 and name o )  2.3 0.8 0.2     
assign (segid A and resid  50 and name n ) (segid A and resid  47 and name o )  3.3 0.8 0.2      
assign (segid A and resid  51 and name hn ) (segid A and resid  46 and name o )  2.3 0.8 0.2
assign (segid A and resid  51 and name n ) (segid A and resid  46 and name o )  3.3 0.8 0.2
assign (segid A and resid  46 and name hn ) (segid A and resid  51 and name o )  2.3 0.8 0.2
assign (segid A and resid  46 and name n ) (segid A and resid  51 and name o )  3.3 0.8 0.2
assign (segid A and resid  53 and name hn ) (segid A and resid  44 and name o )  2.3 0.8 0.2
assign (segid A and resid  53 and name n ) (segid A and resid  44 and name o )  3.3 0.8 0.2
assign (segid A and resid  44 and name hn ) (segid A and resid  53 and name o )  2.3 0.8 0.2
assign (segid A and resid  44 and name n ) (segid A and resid  53 and name o )  3.3 0.8 0.2
assign (segid A and resid  55 and name hn ) (segid A and resid  42 and name o )  2.3 0.8 0.2
assign (segid A and resid  55 and name n ) (segid A and resid  42 and name o )  3.3 0.8 0.2

assign (segid A and resid  22 and name OD#)(segid A and resid  25 and name N) 3.3 0.8 0.2
assign (segid A and resid  22 and name OD#)(segid A and resid  25 and name HN) 2.3 0.8 0.2
assign (segid A and resid  43 and name NE1)(segid A and resid  37 and name O ) 3.3 0.8 0.2     
assign (segid A and resid  43 and name HE1)(segid A and resid  37 and name O ) 2.3 0.8 0.2     

!unit B
assign (segid B and resid  22 and name o ) (segid B and resid  26 and name hn )  2.3 0.8 0.2
assign (segid B and resid  22 and name o ) (segid B and resid  26 and name n )  3.3 0.8 0.2
assign (segid B and resid  23 and name o ) (segid B and resid  27 and name hn )  2.3 0.8 0.2
assign (segid B and resid  23 and name o ) (segid B and resid  27 and name n )  3.3 0.8 0.2
assign (segid B and resid  24 and name o ) (segid B and resid  28 and name hn )  2.3 0.8 0.2
assign (segid B and resid  24 and name o ) (segid B and resid  28 and name n )  3.3 0.8 0.2
assign (segid B and resid  25 and name o ) (segid B and resid  29 and name hn )  2.3 0.8 0.2
assign (segid B and resid  25 and name o ) (segid B and resid  29 and name n )  3.3 0.8 0.2
assign (segid B and resid  26 and name o ) (segid B and resid  30 and name hn )  2.3 0.8 0.2
assign (segid B and resid  26 and name o ) (segid B and resid  30 and name n )  3.3 0.8 0.2 
assign (segid B and resid  27 and name o ) (segid B and resid  31 and name hn )  2.3 0.8 0.2
assign (segid B and resid  27 and name o ) (segid B and resid  31 and name n )  3.3 0.8 0.2
assign (segid B and resid  28 and name o ) (segid B and resid  32 and name hn )  2.3 0.8 0.2
assign (segid B and resid  28 and name o ) (segid B and resid  32 and name n )  3.3 0.8 0.2
assign (segid B and resid  29 and name o ) (segid B and resid  33 and name hn )  2.3 0.8 0.2
assign (segid B and resid  29 and name o ) (segid B and resid  33 and name n )  3.3 0.8 0.2
assign (segid B and resid  30 and name o ) (segid B and resid  34 and name hn )  2.3 0.8 0.2
assign (segid B and resid  30 and name o ) (segid B and resid  34 and name n )  3.3 0.8 0.2
assign (segid B and resid  31 and name o ) (segid B and resid  35 and name hn )  2.3 0.8 0.2
assign (segid B and resid  31 and name o ) (segid B and resid  35 and name n )  3.3 0.8 0.2
assign (segid B and resid  32 and name o ) (segid B and resid  36 and name hn )  2.3 0.8 0.2
assign (segid B and resid  32 and name o ) (segid B and resid  36 and name n )  3.3 0.8 0.2

assign (segid B and resid  20 and name hn ) (segid B and resid   1 and name o )  2.3 0.8 0.2
assign (segid B and resid  20 and name n ) (segid B and resid   1 and name o )  3.3 0.8 0.2
assign (segid B and resid   3 and name hn ) (segid B and resid  18 and name o )  2.3 0.8 0.2
assign (segid B and resid   3 and name n ) (segid B and resid  18 and name o )  3.3 0.8 0.2
assign (segid B and resid  18 and name hn ) (segid B and resid   3 and name o )  2.3 0.8 0.2
assign (segid B and resid  18 and name n ) (segid B and resid   3 and name o )  3.3 0.8 0.2
assign (segid B and resid   5 and name hn ) (segid B and resid  16 and name o )  2.3 0.8 0.2
assign (segid B and resid   5 and name n ) (segid B and resid  16 and name o )  3.3 0.8 0.2
assign (segid B and resid  16 and name hn ) (segid B and resid   5 and name o )  2.3 0.8 0.2
assign (segid B and resid  16 and name n ) (segid B and resid   5 and name o )  3.3 0.8 0.2
assign (segid B and resid   7 and name hn ) (segid B and resid  14 and name o )  2.3 0.8 0.2
assign (segid B and resid   7 and name n ) (segid B and resid  14 and name o )  3.3 0.8 0.2
assign (segid B and resid  14 and name hn ) (segid B and resid   7 and name o )  2.3 0.8 0.2
assign (segid B and resid  14 and name n ) (segid B and resid   7 and name o )  3.3 0.8 0.2
assign (segid B and resid   9 and name hn ) (segid B and resid  12 and name o )  2.3 0.8 0.2
assign (segid B and resid   9 and name n ) (segid B and resid  12 and name o )  3.3 0.8 0.2

assign (segid B and resid  50 and name hn ) (segid B and resid  47 and name o )  2.3 0.8 0.2     
assign (segid B and resid  50 and name n ) (segid B and resid  47 and name o )  3.3 0.8 0.2     
assign (segid B and resid  51 and name hn ) (segid B and resid  46 and name o )  2.3 0.8 0.2
assign (segid B and resid  51 and name n ) (segid B and resid  46 and name o )  3.3 0.8 0.2
assign (segid B and resid  46 and name hn ) (segid B and resid  51 and name o )  2.3 0.8 0.2
assign (segid B and resid  46 and name n ) (segid B and resid  51 and name o )  3.3 0.8 0.2
assign (segid B and resid  53 and name hn ) (segid B and resid  44 and name o )  2.3 0.8 0.2
assign (segid B and resid  53 and name n ) (segid B and resid  44 and name o )  3.3 0.8 0.2
assign (segid B and resid  44 and name hn ) (segid B and resid  53 and name o )  2.3 0.8 0.2
assign (segid B and resid  44 and name n ) (segid B and resid  53 and name o )  3.3 0.8 0.2
assign (segid B and resid  55 and name hn ) (segid B and resid  42 and name o )  2.3 0.8 0.2
assign (segid B and resid  55 and name n ) (segid B and resid  42 and name o )  3.3 0.8 0.2

assign (segid B and resid  22 and name OD#)(segid B and resid  25 and name N) 3.3 0.8 0.2
assign (segid B and resid  22 and name OD#)(segid B and resid  25 and name HN) 2.3 0.8 0.2
assign (segid B and resid  43 and name NE1)(segid B and resid  37 and name O ) 3.3 0.8 0.2     
assign (segid B and resid  43 and name HE1)(segid B and resid  37 and name O ) 2.3 0.8 0.2     

assign (segid A and resid   4 and name hn ) (segid B and resid  50 and name o )  2.3 0.8 0.2
assign (segid B and resid   4 and name hn ) (segid A and resid  50 and name o )  2.3 0.8 0.2
assign (segid A and resid   4 and name n ) (segid B and resid  50 and name o )  3.3 0.8 0.2
assign (segid B and resid   4 and name n ) (segid A and resid  50 and name o )  3.3 0.8 0.2
assign (segid A and resid  52 and name hn ) (segid B and resid   4 and name o )  2.3 0.8 0.2
assign (segid B and resid  52 and name hn ) (segid A and resid   4 and name o )  2.3 0.8 0.2
assign (segid A and resid  52 and name n ) (segid B and resid   4 and name o )  3.3 0.8 0.2
assign (segid B and resid  52 and name n ) (segid A and resid   4 and name o )  3.3 0.8 0.2
assign (segid A and resid   6 and name hn ) (segid B and resid  52 and name o )  2.3 0.8 0.2
assign (segid B and resid   6 and name hn ) (segid A and resid  52 and name o )  2.3 0.8 0.2
assign (segid A and resid   6 and name n ) (segid B and resid  52 and name o )  3.3 0.8 0.2
assign (segid B and resid   6 and name n ) (segid A and resid  52 and name o )  3.3 0.8 0.2
assign (segid A and resid  54 and name hn ) (segid B and resid   6 and name o )  2.3 0.8 0.2
assign (segid B and resid  54 and name hn ) (segid A and resid   6 and name o )  2.3 0.8 0.2
assign (segid A and resid  54 and name n ) (segid B and resid   6 and name o )  3.3 0.8 0.2
assign (segid B and resid  54 and name n ) (segid A and resid   6 and name o )  3.3 0.8 0.2
assign (segid A and resid   8 and name hn ) (segid B and resid  54 and name o )  2.3 0.8 0.2
assign (segid B and resid   8 and name hn ) (segid A and resid  54 and name o )  2.3 0.8 0.2
assign (segid A and resid   8 and name n ) (segid B and resid  54 and name o )  3.3 0.8 0.2
assign (segid B and resid   8 and name n ) (segid A and resid  54 and name o )  3.3 0.8 0.2
assign (segid A and resid  56 and name hn ) (segid B and resid   8 and name o )  2.3 0.8 0.2
assign (segid B and resid  56 and name hn ) (segid A and resid   8 and name o )  2.3 0.8 0.2
assign (segid A and resid  56 and name n ) (segid B and resid   8 and name o )  3.3 0.8 0.2
assign (segid B and resid  56 and name n ) (segid A and resid   8 and name o )  3.3 0.8 0.2

!INTERMOLECULAR H-BONDS
assign (segid A and resid  13 and name hn ) (segid B and resid  17 and name o )  2.3 0.8 0.2
assign (segid B and resid  13 and name hn ) (segid A and resid  17 and name o )  2.3 0.8 0.2
assign (segid A and resid  13 and name n ) (segid B and resid  17 and name o )  3.3 0.8 0.2
assign (segid B and resid  13 and name n ) (segid A and resid  17 and name o )  3.3 0.8 0.2
assign (segid A and resid  17 and name hn ) (segid B and resid  13 and name o )  2.3 0.8 0.2
assign (segid B and resid  17 and name hn ) (segid A and resid  13 and name o )  2.3 0.8 0.2
assign (segid A and resid  17 and name n ) (segid B and resid  13 and name o )  3.3 0.8 0.2
assign (segid B and resid  17 and name n ) (segid A and resid  13 and name o )  3.3 0.8 0.2
assign (segid A and resid  15 and name hn ) (segid B and resid  15 and name o )  2.3 0.8 0.2
assign (segid B and resid  15 and name hn ) (segid A and resid  15 and name o )  2.3 0.8 0.2
assign (segid A and resid  15 and name n ) (segid B and resid  15 and name o )  3.3 0.8 0.2
assign (segid B and resid  15 and name n ) (segid A and resid  15 and name o )  3.3 0.8 0.2

!Dihedral Angle constraints
!for unit A
!phi and psi
assign (segid A and resid    1 and name c ) (segid A and resid    2 and name n )
       (segid A and resid    2 and name ca) (segid A and resid    2 and name c ) 1.0  -92.580  25  2
assign (segid A and resid    2 and name n ) (segid A and resid    2 and name ca)
       (segid A and resid    2 and name c ) (segid A and resid    3 and name n ) 1.0  128.560  40  2

assign (segid A and resid    2 and name c ) (segid A and resid    3 and name n )
       (segid A and resid    3 and name ca) (segid A and resid    3 and name c ) 1.0 -112.250  25  2
assign (segid A and resid    3 and name n ) (segid A and resid    3 and name ca)
       (segid A and resid    3 and name c ) (segid A and resid    4 and name n ) 1.0  130.900   40 2

assign (segid A and resid    3 and name c ) (segid A and resid    4 and name n )
       (segid A and resid    4 and name ca) (segid A and resid    4 and name c ) 1.0 -117.880   25 2
assign (segid A and resid    4 and name n ) (segid A and resid    4 and name ca)
       (segid A and resid    4 and name c ) (segid A and resid    5 and name n ) 1.0  133.220   40 2

assign (segid A and resid    4 and name c ) (segid A and resid    5 and name n )
       (segid A and resid    5 and name ca) (segid A and resid    5 and name c ) 1.0 -120  25 2
assign (segid A and resid    5 and name n ) (segid A and resid    5 and name ca)
       (segid A and resid    5 and name c ) (segid A and resid    6 and name n ) 1.0  124  40 2

assign (segid A and resid    5 and name c ) (segid A and resid    6 and name n )
       (segid A and resid    6 and name ca) (segid A and resid    6 and name c ) 1.0 -120 25   2
assign (segid A and resid    6 and name n ) (segid A and resid    6 and name ca)
       (segid A and resid    6 and name c ) (segid A and resid    7 and name n ) 1.0  128.9 40   2

assign (segid A and resid    6 and name c ) (segid A and resid    7 and name n )
       (segid A and resid    7 and name ca) (segid A and resid    7 and name c ) 1.0  -120  25   2
assign (segid A and resid    7 and name n ) (segid A and resid    7 and name ca)
       (segid A and resid    7 and name c ) (segid A and resid    8 and name n ) 1.0  122.340  40  2

assign (segid A and resid    8 and name c ) (segid A and resid    9 and name n )
       (segid A and resid    9 and name ca) (segid A and resid    9 and name c ) 1.0  -94   25  2
assign (segid A and resid    9 and name n ) (segid A and resid    9 and name ca)
       (segid A and resid    9 and name c ) (segid A and resid   10 and name n ) 1.0  154   40  2

assign (segid A and resid    9 and name c ) (segid A and resid   10 and name n )
       (segid A and resid   10 and name ca) (segid A and resid   10 and name c ) 1.0 -70  25  2
assign (segid A and resid   10 and name n ) (segid A and resid   10 and name ca)
       (segid A and resid   10 and name c ) (segid A and resid   11 and name n ) 1.0  -18  40 2

assign (segid A and resid   11 and name c ) (segid A and resid   12 and name n )
       (segid A and resid   12 and name ca) (segid A and resid   12 and name c ) 1.0 -118.840  25  2
assign (segid A and resid   12 and name n ) (segid A and resid   12 and name ca)
       (segid A and resid   12 and name c ) (segid A and resid   13 and name n ) 1.0  140.630  40  2

assign (segid A and resid   12 and name c ) (segid A and resid   13 and name n )
       (segid A and resid   13 and name ca) (segid A and resid   13 and name c ) 1.0 -119.760  25  2
assign (segid A and resid   13 and name n ) (segid A and resid   13 and name ca)
       (segid A and resid   13 and name c ) (segid A and resid   14 and name n ) 1.0  149.290  40  2

assign (segid A and resid   13 and name c ) (segid A and resid   14 and name n )
       (segid A and resid   14 and name ca) (segid A and resid   14 and name c ) 1.0   -178 35 2
assign (segid A and resid   14 and name n ) (segid A and resid   14 and name ca)
       (segid A and resid   14 and name c ) (segid A and resid   15 and name n ) 1.0  179   50 2

assign (segid A and resid   14 and name c ) (segid A and resid   15 and name n )
       (segid A and resid   15 and name ca) (segid A and resid   15 and name c ) 1.0 -131 25   2
assign (segid A and resid   15 and name n ) (segid A and resid   15 and name ca)
       (segid A and resid   15 and name c ) (segid A and resid   16 and name n ) 1.0  138 40   2

assign (segid A and resid   15 and name c ) (segid A and resid   16 and name n )
       (segid A and resid   16 and name ca) (segid A and resid   16 and name c ) 1.0 -125.870 25   2
assign (segid A and resid   16 and name n ) (segid A and resid   16 and name ca)
       (segid A and resid   16 and name c ) (segid A and resid   17 and name n ) 1.0  128.810 40   2

assign (segid A and resid   16 and name c ) (segid A and resid   17 and name n )
       (segid A and resid   17 and name ca) (segid A and resid   17 and name c ) 1.0 -117.960  25  2
assign (segid A and resid   17 and name n ) (segid A and resid   17 and name ca)
       (segid A and resid   17 and name c ) (segid A and resid   18 and name n ) 1.0  134.850  40  2

assign (segid A and resid   17 and name c ) (segid A and resid   18 and name n )
       (segid A and resid   18 and name ca) (segid A and resid   18 and name c ) 1.0 -126.890  25  2
assign (segid A and resid   18 and name n ) (segid A and resid   18 and name ca)
       (segid A and resid   18 and name c ) (segid A and resid   19 and name n ) 1.0  133.500  40 2

assign (segid A and resid   18 and name c ) (segid A and resid   19 and name n )
       (segid A and resid   19 and name ca) (segid A and resid   19 and name c ) 1.0 -110.700  25  2
assign (segid A and resid   19 and name n ) (segid A and resid   19 and name ca)
       (segid A and resid   19 and name c ) (segid A and resid   20 and name n ) 1.0  135.430   40 2

assign (segid A and resid   19 and name c ) (segid A and resid   20 and name n )
       (segid A and resid   20 and name ca) (segid A and resid   20 and name c ) 1.0  -114   35 2
assign (segid A and resid   20 and name n ) (segid A and resid   20 and name ca)
       (segid A and resid   20 and name c ) (segid A and resid   21 and name n ) 1.0  158    40 2

assign (segid A and resid   20 and name c ) (segid A and resid   21 and name n )
       (segid A and resid   21 and name ca) (segid A and resid   21 and name c ) 1.0  -77   25  2
assign (segid A and resid   21 and name n ) (segid A and resid   21 and name ca)
       (segid A and resid   21 and name c ) (segid A and resid   22 and name n ) 1.0  -13   40  2

assign (segid A and resid   22 and name c ) (segid A and resid   23 and name n )
       (segid A and resid   23 and name ca) (segid A and resid   23 and name c ) 1.0  -64   25  2
assign (segid A and resid   23 and name n ) (segid A and resid   23 and name ca)
       (segid A and resid   23 and name c ) (segid A and resid   24 and name n ) 1.0  -30   40  2

assign (segid A and resid   23 and name c ) (segid A and resid   24 and name n )
       (segid A and resid   24 and name ca) (segid A and resid   24 and name c ) 1.0  -65.750  25   2
assign (segid A and resid   24 and name n ) (segid A and resid   24 and name ca)
       (segid A and resid   24 and name c ) (segid A and resid   25 and name n ) 1.0  -39.920  40   2

assign (segid A and resid   24 and name c ) (segid A and resid   25 and name n )
       (segid A and resid   25 and name ca) (segid A and resid   25 and name c ) 1.0  -70.630   25  2
assign (segid A and resid   25 and name n ) (segid A and resid   25 and name ca)
       (segid A and resid   25 and name c ) (segid A and resid   26 and name n ) 1.0  -39.880   40  2

assign (segid A and resid   25 and name c ) (segid A and resid   26 and name n )
       (segid A and resid   26 and name ca) (segid A and resid   26 and name c ) 1.0  -65.380   25  2
assign (segid A and resid   26 and name n ) (segid A and resid   26 and name ca)
       (segid A and resid   26 and name c ) (segid A and resid   27 and name n ) 1.0  -39.000   40  2

assign (segid A and resid   26 and name c ) (segid A and resid   27 and name n )
       (segid A and resid   27 and name ca) (segid A and resid   27 and name c ) 1.0  -65.690   25  2
assign (segid A and resid   27 and name n ) (segid A and resid   27 and name ca)
       (segid A and resid   27 and name c ) (segid A and resid   28 and name n ) 1.0  -35.480   40  2

assign (segid A and resid   27 and name c ) (segid A and resid   28 and name n )
       (segid A and resid   28 and name ca) (segid A and resid   28 and name c ) 1.0  -64.690   25  2
assign (segid A and resid   28 and name n ) (segid A and resid   28 and name ca)
       (segid A and resid   28 and name c ) (segid A and resid   29 and name n ) 1.0  -31.370   40  2

assign (segid A and resid   28 and name c ) (segid A and resid   29 and name n )
       (segid A and resid   29 and name ca) (segid A and resid   29 and name c ) 1.0  -68.780   25  2
assign (segid A and resid   29 and name n ) (segid A and resid   29 and name ca)
       (segid A and resid   29 and name c ) (segid A and resid   30 and name n ) 1.0  -43.850   40  2

assign (segid A and resid   29 and name c ) (segid A and resid   30 and name n )
       (segid A and resid   30 and name ca) (segid A and resid   30 and name c ) 1.0  -67.910   25  2
assign (segid A and resid   30 and name n ) (segid A and resid   30 and name ca)
       (segid A and resid   30 and name c ) (segid A and resid   31 and name n ) 1.0  -43.370   40  2

assign (segid A and resid   30 and name c ) (segid A and resid   31 and name n )
       (segid A and resid   31 and name ca) (segid A and resid   31 and name c ) 1.0  -62.460   25  2
assign (segid A and resid   31 and name n ) (segid A and resid   31 and name ca)
       (segid A and resid   31 and name c ) (segid A and resid   32 and name n ) 1.0  -38.160   40 2

assign (segid A and resid   31 and name c ) (segid A and resid   32 and name n )
       (segid A and resid   32 and name ca) (segid A and resid   32 and name c ) 1.0  -69.260   25 2
assign (segid A and resid   32 and name n ) (segid A and resid   32 and name ca)
       (segid A and resid   32 and name c ) (segid A and resid   33 and name n ) 1.0  -37.660   40 2

assign (segid A and resid   32 and name c ) (segid A and resid   33 and name n )
       (segid A and resid   33 and name ca) (segid A and resid   33 and name c ) 1.0  -67.670   25 2
assign (segid A and resid   33 and name n ) (segid A and resid   33 and name ca)
       (segid A and resid   33 and name c ) (segid A and resid   34 and name n ) 1.0  -41.970   40 2

assign (segid A and resid   33 and name c ) (segid A and resid   34 and name n )
       (segid A and resid   34 and name ca) (segid A and resid   34 and name c ) 1.0  -70.520   25 2
assign (segid A and resid   34 and name n ) (segid A and resid   34 and name ca)
       (segid A and resid   34 and name c ) (segid A and resid   35 and name n ) 1.0  -33.440   40 2

assign (segid A and resid   34 and name c ) (segid A and resid   35 and name n )
       (segid A and resid   35 and name ca) (segid A and resid   35 and name c ) 1.0  -66.670   25 2
assign (segid A and resid   35 and name n ) (segid A and resid   35 and name ca)
       (segid A and resid   35 and name c ) (segid A and resid   36 and name n ) 1.0  -40.600  40  2

assign (segid A and resid   35 and name c ) (segid A and resid   36 and name n )
       (segid A and resid   36 and name ca) (segid A and resid   36 and name c ) 1.0  -68.670   25 2
assign (segid A and resid   36 and name n ) (segid A and resid   36 and name ca)
       (segid A and resid   36 and name c ) (segid A and resid   37 and name n ) 1.0  -27.270  40  2

assign (segid A and resid   36 and name c ) (segid A and resid   37 and name n )
       (segid A and resid   37 and name ca) (segid A and resid   37 and name c ) 1.0  -90.620   25 2
assign (segid A and resid   37 and name n ) (segid A and resid   37 and name ca)
       (segid A and resid   37 and name c ) (segid A and resid   38 and name n ) 1.0   -5.940  40  2

assign (segid A and resid   38 and name c ) (segid A and resid   39 and name n )
       (segid A and resid   39 and name ca) (segid A and resid   39 and name c ) 1.0  -81.0  30 2
assign (segid A and resid   39 and name n ) (segid A and resid   39 and name ca)
       (segid A and resid   39 and name c ) (segid A and resid   40 and name n ) 1.0   -25.0 30 2

assign (segid A and resid   39 and name c ) (segid A and resid   40 and name n )
       (segid A and resid   40 and name ca) (segid A and resid   40 and name c ) 1.0  -95.0  30 2
assign (segid A and resid   40 and name n ) (segid A and resid   40 and name ca)
       (segid A and resid   40 and name c ) (segid A and resid   41 and name n ) 1.0   3.0  30  2

assign (segid A and resid   41 and name c ) (segid A and resid   42 and name n )
       (segid A and resid   42 and name ca) (segid A and resid   42 and name c ) 1.0  -92.370 25   2
assign (segid A and resid   42 and name n ) (segid A and resid   42 and name ca)
       (segid A and resid   42 and name c ) (segid A and resid   43 and name n ) 1.0  113.640 40   2

assign (segid A and resid   42 and name c ) (segid A and resid   43 and name n )
       (segid A and resid   43 and name ca) (segid A and resid   43 and name c ) 1.0 -105.520  25  2
assign (segid A and resid   43 and name n ) (segid A and resid   43 and name ca)
       (segid A and resid   43 and name c ) (segid A and resid   44 and name n ) 1.0  132.300  40  2

assign (segid A and resid   43 and name c ) (segid A and resid   44 and name n )
       (segid A and resid   44 and name ca) (segid A and resid   44 and name c ) 1.0  -98.680   25  2
assign (segid A and resid   44 and name n ) (segid A and resid   44 and name ca)
       (segid A and resid   44 and name c ) (segid A and resid   45 and name n ) 1.0  134.750  40  2

assign (segid A and resid   44 and name c ) (segid A and resid   45 and name n )
       (segid A and resid   45 and name ca) (segid A and resid   45 and name c ) 1.0 -109.500   25 2
assign (segid A and resid   45 and name n ) (segid A and resid   45 and name ca)
       (segid A and resid   45 and name c ) (segid A and resid   46 and name n ) 1.0  128.950  40  2

assign (segid A and resid   45 and name c ) (segid A and resid   46 and name n )
       (segid A and resid   46 and name ca) (segid A and resid   46 and name c ) 1.0 -98.0   25 2
assign (segid A and resid   46 and name n ) (segid A and resid   46 and name ca)
       (segid A and resid   46 and name c ) (segid A and resid   47 and name n ) 1.0  122.0  40 2

assign (segid A and resid   46 and name c ) (segid A and resid   47 and name n )
       (segid A and resid   47 and name ca) (segid A and resid   47 and name c ) 1.0 -67.0   25 2
assign (segid A and resid   47 and name n ) (segid A and resid   47 and name ca)
       (segid A and resid   47 and name c ) (segid A and resid   48 and name n ) 1.0  -29.0  40 2

assign (segid A and resid   47 and name c ) (segid A and resid   48 and name n )
       (segid A and resid   48 and name ca) (segid A and resid   48 and name c ) 1.0  -75.350 25   2
assign (segid A and resid   48 and name n ) (segid A and resid   48 and name ca)
       (segid A and resid   48 and name c ) (segid A and resid   49 and name n ) 1.0  -23.500 40   2

assign (segid A and resid   48 and name c ) (segid A and resid   49 and name n )
       (segid A and resid   49 and name ca) (segid A and resid   49 and name c ) 1.0  -103 25   2
assign (segid A and resid   49 and name n ) (segid A and resid   49 and name ca)
       (segid A and resid   49 and name c ) (segid A and resid   50 and name n ) 1.0  2 40   2

assign (segid A and resid   50 and name c ) (segid A and resid   51 and name n )
       (segid A and resid   51 and name ca) (segid A and resid   51 and name c ) 1.0 -119.910  25  2
assign (segid A and resid   51 and name n ) (segid A and resid   51 and name ca)
       (segid A and resid   51 and name c ) (segid A and resid   52 and name n ) 1.0  143.440  40  2

assign (segid A and resid   51 and name c ) (segid A and resid   52 and name n )
       (segid A and resid   52 and name ca) (segid A and resid   52 and name c ) 1.0 -113.820   25 2
assign (segid A and resid   52 and name n ) (segid A and resid   52 and name ca)
       (segid A and resid   52 and name c ) (segid A and resid   53 and name n ) 1.0  136.410   40 2

assign (segid A and resid   52 and name c ) (segid A and resid   53 and name n )
       (segid A and resid   53 and name ca) (segid A and resid   53 and name c ) 1.0  -97.280   25 2
assign (segid A and resid   53 and name n ) (segid A and resid   53 and name ca)
       (segid A and resid   53 and name c ) (segid A and resid   54 and name n ) 1.0  122.450   40 2

assign (segid A and resid   53 and name c ) (segid A and resid   54 and name n )
       (segid A and resid   54 and name ca) (segid A and resid   54 and name c ) 1.0 -108.060   25 2
assign (segid A and resid   54 and name n ) (segid A and resid   54 and name ca)
       (segid A and resid   54 and name c ) (segid A and resid   55 and name n ) 1.0  121.500   40 2

assign (segid A and resid   54 and name c ) (segid A and resid   55 and name n )
       (segid A and resid   55 and name ca) (segid A and resid   55 and name c ) 1.0 -110.640   25 2
assign (segid A and resid   55 and name n ) (segid A and resid   55 and name ca)
       (segid A and resid   55 and name c ) (segid A and resid   56 and name n ) 1.0  119.980   40 2

!aromatic residues chi1
assign (segid A and resid    3 and name n ) (segid A and resid    3 and name ca)
       (segid A and resid    3 and name cb) (segid A and resid    3 and name cg) 1.0   -60.0    20.0   2

assign (segid A and resid   33 and name n ) (segid A and resid   33 and name ca)
       (segid A and resid   33 and name cb) (segid A and resid   33 and name cg) 1.0   180.0    20.0   2

assign (segid A and resid   34 and name n ) (segid A and resid   34 and name ca)
       (segid A and resid   34 and name cb) (segid A and resid   34 and name cg) 1.0   -60.0    20.0   2

assign (segid A and resid   43 and name n ) (segid A and resid   43 and name ca)
       (segid A and resid   43 and name cb) (segid A and resid   43 and name cg) 1.0   -60.0    20.0   2

assign (segid A and resid   45 and name n ) (segid A and resid   45 and name ca)
       (segid A and resid   45 and name cb) (segid A and resid   45 and name cg) 1.0   180.0    20.0   2

assign (segid A and resid   52 and name n ) (segid A and resid   52 and name ca)
       (segid A and resid   52 and name cb) (segid A and resid   52 and name cg) 1.0   -60.0    20.0   2

!Ile chi1
assign (segid A and resid    6 and name n ) (segid A and resid    6 and name ca)
       (segid A and resid    6 and name cb) (segid A and resid    6 and name cg1) 1.0   -60.0    20.0   2

!Thr chi1
assign (segid A and resid   11 and name n ) (segid A and resid   11 and name ca)
       (segid A and resid   11 and name cb) (segid A and resid   11 and name og1) 1.0   60.0    20.0   2

assign (segid A and resid   16 and name n ) (segid A and resid   16 and name ca)
       (segid A and resid   16 and name cb) (segid A and resid   16 and name og1) 1.0  180.0    20.0   2

assign (segid A and resid   17 and name n ) (segid A and resid   17 and name ca)
       (segid A and resid   17 and name cb) (segid A and resid   17 and name og1) 1.0   60.0    20.0   2

assign (segid A and resid   18 and name n ) (segid A and resid   18 and name ca)
       (segid A and resid   18 and name cb) (segid A and resid   18 and name og1) 1.0  180.0    20.0   2

assign (segid A and resid   25 and name n ) (segid A and resid   25 and name ca)
       (segid A and resid   25 and name cb) (segid A and resid   25 and name og1) 1.0   60.0    20.0   2

assign (segid A and resid   44 and name n ) (segid A and resid   44 and name ca)
       (segid A and resid   44 and name cb) (segid A and resid   44 and name og1) 1.0   60.0    20.0   2

assign (segid A and resid   49 and name n ) (segid A and resid   49 and name ca)
       (segid A and resid   49 and name cb) (segid A and resid   49 and name og1) 1.0   60.0    20.0   2

assign (segid A and resid   51 and name n ) (segid A and resid   51 and name ca)
       (segid A and resid   51 and name cb) (segid A and resid   51 and name og1) 1.0  -60.0    20.0   2

assign (segid A and resid   53 and name n ) (segid A and resid   53 and name ca)
       (segid A and resid   53 and name cb) (segid A and resid   53 and name og1) 1.0   60.0    20.0   2

assign (segid A and resid   55 and name n ) (segid A and resid   55 and name ca)
       (segid A and resid   55 and name cb) (segid A and resid   55 and name og1) 1.0   -60.0    20.0   2   

!Val chi1
assign (segid A and resid    5 and name n ) (segid A and resid    5 and name ca)
       (segid A and resid    5 and name cb) (segid A and resid    5 and name cg1) 1.0  180    20.0   2

assign (segid A and resid   21 and name n ) (segid A and resid   21 and name ca)
       (segid A and resid   21 and name cb) (segid A and resid   21 and name cg1) 1.0  180    20.0   2

assign (segid A and resid   29 and name n ) (segid A and resid   29 and name ca)
       (segid A and resid   29 and name cb) (segid A and resid   29 and name cg1) 1.0  180    20.0   2

assign (segid A and resid   30 and name n ) (segid A and resid   30 and name ca)
       (segid A and resid   30 and name cb) (segid A and resid   30 and name cg1) 1.0  180    20.0   2

assign (segid A and resid   39 and name n ) (segid A and resid   39 and name ca)
       (segid A and resid   39 and name cb) (segid A and resid   39 and name cg1) 1.0  180    20.0   2

assign (segid A and resid   54 and name n ) (segid A and resid   54 and name ca)
       (segid A and resid   54 and name cb) (segid A and resid   54 and name cg1) 1.0  180    20.0   2

!chi1 for residues w/beta methylene group 
assign (segid A and resid    2 and name n ) (segid A and resid    2 and name ca)
       (segid A and resid    2 and name cb) (segid A and resid    2 and name cg) 1.0  180    20.0   2

assign (segid A and resid    4 and name n ) (segid A and resid    4 and name ca)
       (segid A and resid    4 and name cb) (segid A and resid    4 and name cg) 1.0  180   20.0   2

assign (segid A and resid    7 and name n ) (segid A and resid    7 and name ca)
       (segid A and resid    7 and name cb) (segid A and resid    7 and name cg) 1.0  -60    20.0   2

assign (segid A and resid   10 and name n ) (segid A and resid   10 and name ca)
       (segid A and resid   10 and name cb) (segid A and resid   10 and name cg) 1.0  -60    20.0   2

assign (segid A and resid   12 and name n ) (segid A and resid   12 and name ca)
       (segid A and resid   12 and name cb) (segid A and resid   12 and name cg) 1.0  180    20.0   2

assign (segid A and resid   13 and name n ) (segid A and resid   13 and name ca)
       (segid A and resid   13 and name cb) (segid A and resid   13 and name cg) 1.0  -60    20.0   2

assign (segid A and resid   15 and name n ) (segid A and resid   15 and name ca)
       (segid A and resid   15 and name cb) (segid A and resid   15 and name cg) 1.0  -60    20.0   2

assign (segid A and resid   19 and name n ) (segid A and resid   19 and name ca)
       (segid A and resid   19 and name cb) (segid A and resid   19 and name cg) 1.0  180   20.0   2

assign (segid A and resid   22 and name n ) (segid A and resid   22 and name ca)
       (segid A and resid   22 and name cb) (segid A and resid   22 and name cg) 1.0  60   20.0   2

assign (segid A and resid   27 and name n ) (segid A and resid   27 and name ca)
       (segid A and resid   27 and name cb) (segid A and resid   27 and name cg) 1.0  180   20.0   2

assign (segid A and resid   28 and name n ) (segid A and resid   28 and name ca)
       (segid A and resid   28 and name cb) (segid A and resid   28 and name cg) 1.0  -60   20.0   2

assign (segid A and resid   31 and name n ) (segid A and resid   31 and name ca)
       (segid A and resid   31 and name cb) (segid A and resid   31 and name cg) 1.0  -60   20.0   2

assign (segid A and resid   32 and name n ) (segid A and resid   32 and name ca)
       (segid A and resid   32 and name cb) (segid A and resid   32 and name cg) 1.0  180   20.0   2

assign (segid A and resid   35 and name n ) (segid A and resid   35 and name ca)
       (segid A and resid   35 and name cb) (segid A and resid   35 and name cg) 1.0  180   20.0   2

assign (segid A and resid   36 and name n ) (segid A and resid   36 and name ca)
       (segid A and resid   36 and name cb) (segid A and resid   36 and name cg) 1.0  -60   20.0   2

assign (segid A and resid   37 and name n ) (segid A and resid   37 and name ca)
       (segid A and resid   37 and name cb) (segid A and resid   37 and name cg) 1.0  -60   20.0   2

assign (segid A and resid   40 and name n ) (segid A and resid   40 and name ca)
       (segid A and resid   40 and name cb) (segid A and resid   40 and name cg) 1.0  -60   20.0   2

assign (segid A and resid   42 and name n ) (segid A and resid   42 and name ca)
       (segid A and resid   42 and name cb) (segid A and resid   42 and name cg) 1.0  -60   20.0   2

assign (segid A and resid   46 and name n ) (segid A and resid   46 and name ca)
       (segid A and resid   46 and name cb) (segid A and resid   46 and name cg) 1.0  180   20.0   2

assign (segid A and resid   47 and name n ) (segid A and resid   47 and name ca)
       (segid A and resid   47 and name cb) (segid A and resid   47 and name cg) 1.0  -60   20.0   2

assign (segid A and resid   50 and name n ) (segid A and resid   50 and name ca)
       (segid A and resid   50 and name cb) (segid A and resid   50 and name cg) 1.0  -60   20.0   2

!aromatic chi2
assign (segid A and resid    3 and name ca) (segid A and resid    3 and name cb)
       (segid A and resid    3 and name cg) (segid A and resid    3 and name cd1) 1.0 -90.0 35.0 2
assign (segid A and resid   33 and name ca) (segid A and resid   33 and name cb)
       (segid A and resid   33 and name cg) (segid A and resid   33 and name cd1) 1.0 90.0 35.0 2
assign (segid A and resid   34 and name ca) (segid A and resid   34 and name cb)
       (segid A and resid   34 and name cg) (segid A and resid   34 and name cd1) 1.0 -40.0 60.0 2
assign (segid A and resid   45 and name ca) (segid A and resid   45 and name cb)
       (segid A and resid   45 and name cg) (segid A and resid   45 and name cd1) 1.0 40.0 60.0 2
assign (segid A and resid   52 and name ca) (segid A and resid   52 and name cb)
       (segid A and resid   52 and name cg) (segid A and resid   52 and name cd1) 1.0 -90.0 35.0 2


!other chi2
assign (segid A and resid    6 and name ca) (segid A and resid    6 and name cb)
       (segid A and resid    6 and name cg1) (segid A and resid    6 and name cd1) 1.0 180.0 30.0 2

assign (segid A and resid    7 and name ca) (segid A and resid    7 and name cb)
       (segid A and resid    7 and name cg) (segid A and resid    7 and name cd1) 1.0 180.0 30.0 2

assign (segid A and resid   12 and name ca) (segid A and resid   12 and name cb)
       (segid A and resid   12 and name cg) (segid A and resid   12 and name cd1) 1.0 60.0 30.0 2

!Dihedral Angle constraints
!for unit B
!phi and psi
assign (segid B and resid    1 and name c ) (segid B and resid    2 and name n )
       (segid B and resid    2 and name ca) (segid B and resid    2 and name c ) 1.0  -92.580  25  2
assign (segid B and resid    2 and name n ) (segid B and resid    2 and name ca)
       (segid B and resid    2 and name c ) (segid B and resid    3 and name n ) 1.0  128.560  40  2

assign (segid B and resid    2 and name c ) (segid B and resid    3 and name n )
       (segid B and resid    3 and name ca) (segid B and resid    3 and name c ) 1.0 -112.250  25  2
assign (segid B and resid    3 and name n ) (segid B and resid    3 and name ca)
       (segid B and resid    3 and name c ) (segid B and resid    4 and name n ) 1.0  130.900   40 2

assign (segid B and resid    3 and name c ) (segid B and resid    4 and name n )
       (segid B and resid    4 and name ca) (segid B and resid    4 and name c ) 1.0 -117.880   25 2
assign (segid B and resid    4 and name n ) (segid B and resid    4 and name ca)
       (segid B and resid    4 and name c ) (segid B and resid    5 and name n ) 1.0  133.220   40 2

assign (segid B and resid    4 and name c ) (segid B and resid    5 and name n )
       (segid B and resid    5 and name ca) (segid B and resid    5 and name c ) 1.0 -120  25 2
assign (segid B and resid    5 and name n ) (segid B and resid    5 and name ca)
       (segid B and resid    5 and name c ) (segid B and resid    6 and name n ) 1.0  124  40 2

assign (segid B and resid    5 and name c ) (segid B and resid    6 and name n )
       (segid B and resid    6 and name ca) (segid B and resid    6 and name c ) 1.0 -120 25   2
assign (segid B and resid    6 and name n ) (segid B and resid    6 and name ca)
       (segid B and resid    6 and name c ) (segid B and resid    7 and name n ) 1.0  128.9 40   2

assign (segid B and resid    6 and name c ) (segid B and resid    7 and name n )
       (segid B and resid    7 and name ca) (segid B and resid    7 and name c ) 1.0  -120  25   2
assign (segid B and resid    7 and name n ) (segid B and resid    7 and name ca)
       (segid B and resid    7 and name c ) (segid B and resid    8 and name n ) 1.0  122.340  40  2

assign (segid B and resid    8 and name c ) (segid B and resid    9 and name n )
       (segid B and resid    9 and name ca) (segid B and resid    9 and name c ) 1.0  -94   25  2
assign (segid B and resid    9 and name n ) (segid B and resid    9 and name ca)
       (segid B and resid    9 and name c ) (segid B and resid   10 and name n ) 1.0  154   40  2

assign (segid B and resid    9 and name c ) (segid B and resid   10 and name n )
       (segid B and resid   10 and name ca) (segid B and resid   10 and name c ) 1.0 -70  25  2
assign (segid B and resid   10 and name n ) (segid B and resid   10 and name ca)
       (segid B and resid   10 and name c ) (segid B and resid   11 and name n ) 1.0  -18  40 2

assign (segid B and resid   11 and name c ) (segid B and resid   12 and name n )
       (segid B and resid   12 and name ca) (segid B and resid   12 and name c ) 1.0 -118.840  25  2
assign (segid B and resid   12 and name n ) (segid B and resid   12 and name ca)
       (segid B and resid   12 and name c ) (segid B and resid   13 and name n ) 1.0  140.630  40  2

assign (segid B and resid   12 and name c ) (segid B and resid   13 and name n )
       (segid B and resid   13 and name ca) (segid B and resid   13 and name c ) 1.0 -119.760  25  2
assign (segid B and resid   13 and name n ) (segid B and resid   13 and name ca)
       (segid B and resid   13 and name c ) (segid B and resid   14 and name n ) 1.0  149.290  40  2

assign (segid B and resid   13 and name c ) (segid B and resid   14 and name n )
       (segid B and resid   14 and name ca) (segid B and resid   14 and name c ) 1.0   -178 35 2
assign (segid B and resid   14 and name n ) (segid B and resid   14 and name ca)
       (segid B and resid   14 and name c ) (segid B and resid   15 and name n ) 1.0  179   50 2

assign (segid B and resid   14 and name c ) (segid B and resid   15 and name n )
       (segid B and resid   15 and name ca) (segid B and resid   15 and name c ) 1.0 -131 25   2
assign (segid B and resid   15 and name n ) (segid B and resid   15 and name ca)
       (segid B and resid   15 and name c ) (segid B and resid   16 and name n ) 1.0  138 40   2

assign (segid B and resid   15 and name c ) (segid B and resid   16 and name n )
       (segid B and resid   16 and name ca) (segid B and resid   16 and name c ) 1.0 -125.870 25   2
assign (segid B and resid   16 and name n ) (segid B and resid   16 and name ca)
       (segid B and resid   16 and name c ) (segid B and resid   17 and name n ) 1.0  128.810 40   2

assign (segid B and resid   16 and name c ) (segid B and resid   17 and name n )
       (segid B and resid   17 and name ca) (segid B and resid   17 and name c ) 1.0 -117.960  25  2
assign (segid B and resid   17 and name n ) (segid B and resid   17 and name ca)
       (segid B and resid   17 and name c ) (segid B and resid   18 and name n ) 1.0  134.850  40  2

assign (segid B and resid   17 and name c ) (segid B and resid   18 and name n )
       (segid B and resid   18 and name ca) (segid B and resid   18 and name c ) 1.0 -126.890  25  2
assign (segid B and resid   18 and name n ) (segid B and resid   18 and name ca)
       (segid B and resid   18 and name c ) (segid B and resid   19 and name n ) 1.0  133.500  40 2

assign (segid B and resid   18 and name c ) (segid B and resid   19 and name n )
       (segid B and resid   19 and name ca) (segid B and resid   19 and name c ) 1.0 -110.700  25  2
assign (segid B and resid   19 and name n ) (segid B and resid   19 and name ca)
       (segid B and resid   19 and name c ) (segid B and resid   20 and name n ) 1.0  135.430   40 2

assign (segid B and resid   19 and name c ) (segid B and resid   20 and name n )
       (segid B and resid   20 and name ca) (segid B and resid   20 and name c ) 1.0  -114   35 2
assign (segid B and resid   20 and name n ) (segid B and resid   20 and name ca)
       (segid B and resid   20 and name c ) (segid B and resid   21 and name n ) 1.0  158    40 2

assign (segid B and resid   20 and name c ) (segid B and resid   21 and name n )
       (segid B and resid   21 and name ca) (segid B and resid   21 and name c ) 1.0  -77   25  2
assign (segid B and resid   21 and name n ) (segid B and resid   21 and name ca)
       (segid B and resid   21 and name c ) (segid B and resid   22 and name n ) 1.0  -13   40  2

assign (segid B and resid   22 and name c ) (segid B and resid   23 and name n )
       (segid B and resid   23 and name ca) (segid B and resid   23 and name c ) 1.0  -64   25  2
assign (segid B and resid   23 and name n ) (segid B and resid   23 and name ca)
       (segid B and resid   23 and name c ) (segid B and resid   24 and name n ) 1.0  -30   40  2

assign (segid B and resid   23 and name c ) (segid B and resid   24 and name n )
       (segid B and resid   24 and name ca) (segid B and resid   24 and name c ) 1.0  -65.750  25   2
assign (segid B and resid   24 and name n ) (segid B and resid   24 and name ca)
       (segid B and resid   24 and name c ) (segid B and resid   25 and name n ) 1.0  -39.920  40   2

assign (segid B and resid   24 and name c ) (segid B and resid   25 and name n )
       (segid B and resid   25 and name ca) (segid B and resid   25 and name c ) 1.0  -70.630   25  2
assign (segid B and resid   25 and name n ) (segid B and resid   25 and name ca)
       (segid B and resid   25 and name c ) (segid B and resid   26 and name n ) 1.0  -39.880   40  2

assign (segid B and resid   25 and name c ) (segid B and resid   26 and name n )
       (segid B and resid   26 and name ca) (segid B and resid   26 and name c ) 1.0  -65.380   25  2
assign (segid B and resid   26 and name n ) (segid B and resid   26 and name ca)
       (segid B and resid   26 and name c ) (segid B and resid   27 and name n ) 1.0  -39.000   40  2

assign (segid B and resid   26 and name c ) (segid B and resid   27 and name n )
       (segid B and resid   27 and name ca) (segid B and resid   27 and name c ) 1.0  -65.690   25  2
assign (segid B and resid   27 and name n ) (segid B and resid   27 and name ca)
       (segid B and resid   27 and name c ) (segid B and resid   28 and name n ) 1.0  -35.480   40  2

assign (segid B and resid   27 and name c ) (segid B and resid   28 and name n )
       (segid B and resid   28 and name ca) (segid B and resid   28 and name c ) 1.0  -64.690   25  2
assign (segid B and resid   28 and name n ) (segid B and resid   28 and name ca)
       (segid B and resid   28 and name c ) (segid B and resid   29 and name n ) 1.0  -31.370   40  2

assign (segid B and resid   28 and name c ) (segid B and resid   29 and name n )
       (segid B and resid   29 and name ca) (segid B and resid   29 and name c ) 1.0  -68.780   25  2
assign (segid B and resid   29 and name n ) (segid B and resid   29 and name ca)
       (segid B and resid   29 and name c ) (segid B and resid   30 and name n ) 1.0  -43.850   40  2

assign (segid B and resid   29 and name c ) (segid B and resid   30 and name n )
       (segid B and resid   30 and name ca) (segid B and resid   30 and name c ) 1.0  -67.910   25  2
assign (segid B and resid   30 and name n ) (segid B and resid   30 and name ca)
       (segid B and resid   30 and name c ) (segid B and resid   31 and name n ) 1.0  -43.370   40  2

assign (segid B and resid   30 and name c ) (segid B and resid   31 and name n )
       (segid B and resid   31 and name ca) (segid B and resid   31 and name c ) 1.0  -62.460   25  2
assign (segid B and resid   31 and name n ) (segid B and resid   31 and name ca)
       (segid B and resid   31 and name c ) (segid B and resid   32 and name n ) 1.0  -38.160   40 2

assign (segid B and resid   31 and name c ) (segid B and resid   32 and name n )
       (segid B and resid   32 and name ca) (segid B and resid   32 and name c ) 1.0  -69.260   25 2
assign (segid B and resid   32 and name n ) (segid B and resid   32 and name ca)
       (segid B and resid   32 and name c ) (segid B and resid   33 and name n ) 1.0  -37.660   40 2

assign (segid B and resid   32 and name c ) (segid B and resid   33 and name n )
       (segid B and resid   33 and name ca) (segid B and resid   33 and name c ) 1.0  -67.670   25 2
assign (segid B and resid   33 and name n ) (segid B and resid   33 and name ca)
       (segid B and resid   33 and name c ) (segid B and resid   34 and name n ) 1.0  -41.970   40 2

assign (segid B and resid   33 and name c ) (segid B and resid   34 and name n )
       (segid B and resid   34 and name ca) (segid B and resid   34 and name c ) 1.0  -70.520   25 2
assign (segid B and resid   34 and name n ) (segid B and resid   34 and name ca)
       (segid B and resid   34 and name c ) (segid B and resid   35 and name n ) 1.0  -33.440   40 2

assign (segid B and resid   34 and name c ) (segid B and resid   35 and name n )
       (segid B and resid   35 and name ca) (segid B and resid   35 and name c ) 1.0  -66.670   25 2
assign (segid B and resid   35 and name n ) (segid B and resid   35 and name ca)
       (segid B and resid   35 and name c ) (segid B and resid   36 and name n ) 1.0  -40.600  40  2

assign (segid B and resid   35 and name c ) (segid B and resid   36 and name n )
       (segid B and resid   36 and name ca) (segid B and resid   36 and name c ) 1.0  -68.670   25 2
assign (segid B and resid   36 and name n ) (segid B and resid   36 and name ca)
       (segid B and resid   36 and name c ) (segid B and resid   37 and name n ) 1.0  -27.270  40  2

assign (segid B and resid   36 and name c ) (segid B and resid   37 and name n )
       (segid B and resid   37 and name ca) (segid B and resid   37 and name c ) 1.0  -90.620   25 2
assign (segid B and resid   37 and name n ) (segid B and resid   37 and name ca)
       (segid B and resid   37 and name c ) (segid B and resid   38 and name n ) 1.0   -5.940  40  2

assign (segid B and resid   38 and name c ) (segid B and resid   39 and name n )
       (segid B and resid   39 and name ca) (segid B and resid   39 and name c ) 1.0  -81.0  30 2
assign (segid B and resid   39 and name n ) (segid B and resid   39 and name ca)
       (segid B and resid   39 and name c ) (segid B and resid   40 and name n ) 1.0   -25.0 30 2

assign (segid B and resid   39 and name c ) (segid B and resid   40 and name n )
       (segid B and resid   40 and name ca) (segid B and resid   40 and name c ) 1.0  -95.0  30 2
assign (segid B and resid   40 and name n ) (segid B and resid   40 and name ca)
       (segid B and resid   40 and name c ) (segid B and resid   41 and name n ) 1.0   3.0  30  2

assign (segid B and resid   41 and name c ) (segid B and resid   42 and name n )
       (segid B and resid   42 and name ca) (segid B and resid   42 and name c ) 1.0  -92.370 25   2
assign (segid B and resid   42 and name n ) (segid B and resid   42 and name ca)
       (segid B and resid   42 and name c ) (segid B and resid   43 and name n ) 1.0  113.640 40   2

assign (segid B and resid   42 and name c ) (segid B and resid   43 and name n )
       (segid B and resid   43 and name ca) (segid B and resid   43 and name c ) 1.0 -105.520  25  2
assign (segid B and resid   43 and name n ) (segid B and resid   43 and name ca)
       (segid B and resid   43 and name c ) (segid B and resid   44 and name n ) 1.0  132.300  40  2

assign (segid B and resid   43 and name c ) (segid B and resid   44 and name n )
       (segid B and resid   44 and name ca) (segid B and resid   44 and name c ) 1.0  -98.680   25  2
assign (segid B and resid   44 and name n ) (segid B and resid   44 and name ca)
       (segid B and resid   44 and name c ) (segid B and resid   45 and name n ) 1.0  134.750  40  2

assign (segid B and resid   44 and name c ) (segid B and resid   45 and name n )
       (segid B and resid   45 and name ca) (segid B and resid   45 and name c ) 1.0 -109.500   25 2
assign (segid B and resid   45 and name n ) (segid B and resid   45 and name ca)
       (segid B and resid   45 and name c ) (segid B and resid   46 and name n ) 1.0  128.950  40  2

assign (segid B and resid   45 and name c ) (segid B and resid   46 and name n )
       (segid B and resid   46 and name ca) (segid B and resid   46 and name c ) 1.0 -98.0   25 2
assign (segid B and resid   46 and name n ) (segid B and resid   46 and name ca)
       (segid B and resid   46 and name c ) (segid B and resid   47 and name n ) 1.0  122.0  40 2

assign (segid B and resid   46 and name c ) (segid B and resid   47 and name n )
       (segid B and resid   47 and name ca) (segid B and resid   47 and name c ) 1.0 -67.0   25 2
assign (segid B and resid   47 and name n ) (segid B and resid   47 and name ca)
       (segid B and resid   47 and name c ) (segid B and resid   48 and name n ) 1.0  -29.0  40 2

assign (segid B and resid   47 and name c ) (segid B and resid   48 and name n )
       (segid B and resid   48 and name ca) (segid B and resid   48 and name c ) 1.0  -75.350 25   2
assign (segid B and resid   48 and name n ) (segid B and resid   48 and name ca)
       (segid B and resid   48 and name c ) (segid B and resid   49 and name n ) 1.0  -23.500 40   2

assign (segid B and resid   48 and name c ) (segid B and resid   49 and name n )
       (segid B and resid   49 and name ca) (segid B and resid   49 and name c ) 1.0  -103 25   2
assign (segid B and resid   49 and name n ) (segid B and resid   49 and name ca)
       (segid B and resid   49 and name c ) (segid B and resid   50 and name n ) 1.0  2 40   2

assign (segid B and resid   50 and name c ) (segid B and resid   51 and name n )
       (segid B and resid   51 and name ca) (segid B and resid   51 and name c ) 1.0 -119.910  25  2
assign (segid B and resid   51 and name n ) (segid B and resid   51 and name ca)
       (segid B and resid   51 and name c ) (segid B and resid   52 and name n ) 1.0  143.440  40  2

assign (segid B and resid   51 and name c ) (segid B and resid   52 and name n )
       (segid B and resid   52 and name ca) (segid B and resid   52 and name c ) 1.0 -113.820   25 2
assign (segid B and resid   52 and name n ) (segid B and resid   52 and name ca)
       (segid B and resid   52 and name c ) (segid B and resid   53 and name n ) 1.0  136.410   40 2

assign (segid B and resid   52 and name c ) (segid B and resid   53 and name n )
       (segid B and resid   53 and name ca) (segid B and resid   53 and name c ) 1.0  -97.280   25 2
assign (segid B and resid   53 and name n ) (segid B and resid   53 and name ca)
       (segid B and resid   53 and name c ) (segid B and resid   54 and name n ) 1.0  122.450   40 2

assign (segid B and resid   53 and name c ) (segid B and resid   54 and name n )
       (segid B and resid   54 and name ca) (segid B and resid   54 and name c ) 1.0 -108.060   25 2
assign (segid B and resid   54 and name n ) (segid B and resid   54 and name ca)
       (segid B and resid   54 and name c ) (segid B and resid   55 and name n ) 1.0  121.500   40 2

assign (segid B and resid   54 and name c ) (segid B and resid   55 and name n )
       (segid B and resid   55 and name ca) (segid B and resid   55 and name c ) 1.0 -110.640   25 2
assign (segid B and resid   55 and name n ) (segid B and resid   55 and name ca)
       (segid B and resid   55 and name c ) (segid B and resid   56 and name n ) 1.0  119.980   40 2

!aromatic residues chi1 
assign (segid B and resid    3 and name n ) (segid B and resid    3 and name ca)
       (segid B and resid    3 and name cb) (segid B and resid    3 and name cg) 1.0   -60.0    20.0   2

assign (segid B and resid   33 and name n ) (segid B and resid   33 and name ca)
       (segid B and resid   33 and name cb) (segid B and resid   33 and name cg) 1.0   180.0    20.0   2

assign (segid B and resid   34 and name n ) (segid B and resid   34 and name ca)
       (segid B and resid   34 and name cb) (segid B and resid   34 and name cg) 1.0   -60.0    20.0   2

assign (segid B and resid   43 and name n ) (segid B and resid   43 and name ca)
       (segid B and resid   43 and name cb) (segid B and resid   43 and name cg) 1.0   -60.0    20.0   2

assign (segid B and resid   45 and name n ) (segid B and resid   45 and name ca)
       (segid B and resid   45 and name cb) (segid B and resid   45 and name cg) 1.0   180.0    20.0   2

assign (segid B and resid   52 and name n ) (segid B and resid   52 and name ca)
       (segid B and resid   52 and name cb) (segid B and resid   52 and name cg) 1.0   -60.0    20.0   2

!Ile chi1 
assign (segid B and resid    6 and name n ) (segid B and resid    6 and name ca)
       (segid B and resid    6 and name cb) (segid B and resid    6 and name cg1) 1.0   -60.0    20.0   2

!Thr chi1 
assign (segid B and resid   11 and name n ) (segid B and resid   11 and name ca)
       (segid B and resid   11 and name cb) (segid B and resid   11 and name og1) 1.0   60.0    20.0   2

assign (segid B and resid   16 and name n ) (segid B and resid   16 and name ca)
       (segid B and resid   16 and name cb) (segid B and resid   16 and name og1) 1.0  180.0    20.0   2

assign (segid B and resid   17 and name n ) (segid B and resid   17 and name ca)
       (segid B and resid   17 and name cb) (segid B and resid   17 and name og1) 1.0   60.0    20.0   2

assign (segid B and resid   18 and name n ) (segid B and resid   18 and name ca)
       (segid B and resid   18 and name cb) (segid B and resid   18 and name og1) 1.0  180.0    20.0   2

assign (segid B and resid   25 and name n ) (segid B and resid   25 and name ca)
       (segid B and resid   25 and name cb) (segid B and resid   25 and name og1) 1.0   60.0    20.0   2

assign (segid B and resid   44 and name n ) (segid B and resid   44 and name ca)
       (segid B and resid   44 and name cb) (segid B and resid   44 and name og1) 1.0   60.0    20.0   2

assign (segid B and resid   49 and name n ) (segid B and resid   49 and name ca)
       (segid B and resid   49 and name cb) (segid B and resid   49 and name og1) 1.0   60.0    20.0   2

assign (segid B and resid   51 and name n ) (segid B and resid   51 and name ca)
       (segid B and resid   51 and name cb) (segid B and resid   51 and name og1) 1.0  -60.0    20.0   2

assign (segid B and resid   53 and name n ) (segid B and resid   53 and name ca)
       (segid B and resid   53 and name cb) (segid B and resid   53 and name og1) 1.0   60.0    20.0   2

assign (segid B and resid   55 and name n ) (segid B and resid   55 and name ca)
       (segid B and resid   55 and name cb) (segid B and resid   55 and name og1) 1.0   -60.0    20.0   2   

!Val chi1 
assign (segid B and resid    5 and name n ) (segid B and resid    5 and name ca)
       (segid B and resid    5 and name cb) (segid B and resid    5 and name cg1) 1.0  180    20.0   2

assign (segid B and resid   21 and name n ) (segid B and resid   21 and name ca)
       (segid B and resid   21 and name cb) (segid B and resid   21 and name cg1) 1.0  180    20.0   2

assign (segid B and resid   29 and name n ) (segid B and resid   29 and name ca)
       (segid B and resid   29 and name cb) (segid B and resid   29 and name cg1) 1.0  180    20.0   2

assign (segid B and resid   30 and name n ) (segid B and resid   30 and name ca)
       (segid B and resid   30 and name cb) (segid B and resid   30 and name cg1) 1.0  180    20.0   2

assign (segid B and resid   39 and name n ) (segid B and resid   39 and name ca)
       (segid B and resid   39 and name cb) (segid B and resid   39 and name cg1) 1.0  180    20.0   2

assign (segid B and resid   54 and name n ) (segid B and resid   54 and name ca)
       (segid B and resid   54 and name cb) (segid B and resid   54 and name cg1) 1.0  180    20.0   2

!chi1 for residues w/beta methylene group 
assign (segid B and resid    2 and name n ) (segid B and resid    2 and name ca)
       (segid B and resid    2 and name cb) (segid B and resid    2 and name cg) 1.0  180    20.0   2

assign (segid B and resid    4 and name n ) (segid B and resid    4 and name ca)
       (segid B and resid    4 and name cb) (segid B and resid    4 and name cg) 1.0  180   20.0   2

assign (segid B and resid    7 and name n ) (segid B and resid    7 and name ca)
       (segid B and resid    7 and name cb) (segid B and resid    7 and name cg) 1.0  -60    20.0   2

assign (segid B and resid   10 and name n ) (segid B and resid   10 and name ca)
       (segid B and resid   10 and name cb) (segid B and resid   10 and name cg) 1.0  -60    20.0   2

assign (segid B and resid   12 and name n ) (segid B and resid   12 and name ca)
       (segid B and resid   12 and name cb) (segid B and resid   12 and name cg) 1.0  180    20.0   2

assign (segid B and resid   13 and name n ) (segid B and resid   13 and name ca)
       (segid B and resid   13 and name cb) (segid B and resid   13 and name cg) 1.0  -60    20.0   2

assign (segid B and resid   15 and name n ) (segid B and resid   15 and name ca)
       (segid B and resid   15 and name cb) (segid B and resid   15 and name cg) 1.0  -60    20.0   2

assign (segid B and resid   19 and name n ) (segid B and resid   19 and name ca)
       (segid B and resid   19 and name cb) (segid B and resid   19 and name cg) 1.0  180   20.0   2

assign (segid B and resid   22 and name n ) (segid B and resid   22 and name ca)
       (segid B and resid   22 and name cb) (segid B and resid   22 and name cg) 1.0  60   20.0   2

assign (segid B and resid   27 and name n ) (segid B and resid   27 and name ca)
       (segid B and resid   27 and name cb) (segid B and resid   27 and name cg) 1.0  180   20.0   2

assign (segid B and resid   28 and name n ) (segid B and resid   28 and name ca)
       (segid B and resid   28 and name cb) (segid B and resid   28 and name cg) 1.0  -60   20.0   2

assign (segid B and resid   31 and name n ) (segid B and resid   31 and name ca)
       (segid B and resid   31 and name cb) (segid B and resid   31 and name cg) 1.0  -60   20.0   2

assign (segid B and resid   32 and name n ) (segid B and resid   32 and name ca)
       (segid B and resid   32 and name cb) (segid B and resid   32 and name cg) 1.0  180   20.0   2

assign (segid B and resid   35 and name n ) (segid B and resid   35 and name ca)
       (segid B and resid   35 and name cb) (segid B and resid   35 and name cg) 1.0  180   20.0   2

assign (segid B and resid   36 and name n ) (segid B and resid   36 and name ca)
       (segid B and resid   36 and name cb) (segid B and resid   36 and name cg) 1.0  -60   20.0   2

assign (segid B and resid   37 and name n ) (segid B and resid   37 and name ca)
       (segid B and resid   37 and name cb) (segid B and resid   37 and name cg) 1.0  -60   20.0   2

assign (segid B and resid   40 and name n ) (segid B and resid   40 and name ca)
       (segid B and resid   40 and name cb) (segid B and resid   40 and name cg) 1.0  -60   20.0   2

assign (segid B and resid   42 and name n ) (segid B and resid   42 and name ca)
       (segid B and resid   42 and name cb) (segid B and resid   42 and name cg) 1.0  -60   20.0   2

assign (segid B and resid   46 and name n ) (segid B and resid   46 and name ca)
       (segid B and resid   46 and name cb) (segid B and resid   46 and name cg) 1.0  180   20.0   2

assign (segid B and resid   47 and name n ) (segid B and resid   47 and name ca)
       (segid B and resid   47 and name cb) (segid B and resid   47 and name cg) 1.0  -60   20.0   2

assign (segid B and resid   50 and name n ) (segid B and resid   50 and name ca)
       (segid B and resid   50 and name cb) (segid B and resid   50 and name cg) 1.0  -60   20.0   2


!aromatic chi2
assign (segid B and resid    3 and name ca) (segid B and resid    3 and name cb)
       (segid B and resid    3 and name cg) (segid B and resid    3 and name cd1) 1.0 -90.0 35.0 2
assign (segid B and resid   33 and name ca) (segid B and resid   33 and name cb)
       (segid B and resid   33 and name cg) (segid B and resid   33 and name cd1) 1.0 90.0 35.0 2
assign (segid B and resid   34 and name ca) (segid B and resid   34 and name cb)
       (segid B and resid   34 and name cg) (segid B and resid   34 and name cd1) 1.0 -40.0 60.0 2
assign (segid B and resid   45 and name ca) (segid B and resid   45 and name cb)
       (segid B and resid   45 and name cg) (segid B and resid   45 and name cd1) 1.0 40.0 60.0 2
assign (segid B and resid   52 and name ca) (segid B and resid   52 and name cb)
       (segid B and resid   52 and name cg) (segid B and resid   52 and name cd1) 1.0 -90.0 35.0 2

!other chi2 
assign (segid B and resid    6 and name ca) (segid B and resid    6 and name cb)
       (segid B and resid    6 and name cg1) (segid B and resid    6 and name cd1) 1.0 180.0 30.0 2

assign (segid B and resid    7 and name ca) (segid B and resid    7 and name cb)
       (segid B and resid    7 and name cg) (segid B and resid    7 and name cd1) 1.0 180.0 30.0 2

assign (segid B and resid   12 and name ca) (segid B and resid   12 and name cb)
       (segid B and resid   12 and name cg) (segid B and resid   12 and name cd1) 1.0 60.0 30.0 2

!RDCs
!unit A
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 43   and name NE1 )
       ( segid A and resid 43   and name HE1 )  2.394  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 2   and name N   )
       ( segid A and resid 2   and name HN  )  -2.100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 3   and name N   )
       ( segid A and resid 3   and name HN  )  -25.600  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 4   and name N   )
       ( segid A and resid 4   and name HN  )  -32.000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 5   and name N   )
       ( segid A and resid 5   and name HN  )  -27.000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 6   and name N   )
       ( segid A and resid 6   and name HN  )  -23.700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 7   and name N   )
       ( segid A and resid 7   and name HN  )  -12.300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 8   and name N   )
       ( segid A and resid 8   and name HN  )  -2.100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 9   and name N   )
       ( segid A and resid 9   and name HN  )  -12.800  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 10   and name N   )
       ( segid A and resid 10   and name HN  )  2.200  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 11   and name N   )
       ( segid A and resid 11   and name HN  )  7.900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 12   and name N   )
       ( segid A and resid 12   and name HN  )  -26.100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 13   and name N   )
       ( segid A and resid 13   and name HN  )  -29.100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 14   and name N   )
       ( segid A and resid 14   and name HN  )  -29.200  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 15   and name N   )
       ( segid A and resid 15   and name HN  )  -33.300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 16   and name N   )
       ( segid A and resid 16   and name HN  )  -33.400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 17   and name N   )
       ( segid A and resid 17   and name HN  )  -33.200  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 18   and name N   )
       ( segid A and resid 18   and name HN  )  -29.200  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 19   and name N   )
       ( segid A and resid 19   and name HN  )  -25.100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 20   and name N   )
       ( segid A and resid 20   and name HN  )  -8.700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 21   and name N   )
       ( segid A and resid 21   and name HN  )  -12.700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 22   and name N   )
       ( segid A and resid 22   and name HN  )  -13.600  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 23   and name N   )
       ( segid A and resid 23   and name HN  )  -17.900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 24  and name N   )
       ( segid A and resid 24   and name HN  )  4.800  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 25  and name N   )
       ( segid A and resid 25   and name HN  )  2.900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 26   and name N   )
       ( segid A and resid 26   and name HN  )  -14.800  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 27   and name N   )
       ( segid A and resid 27   and name HN  )  -13.300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 28   and name N   )
       ( segid A and resid 28   and name HN  )  8.700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 29   and name N   )
       ( segid A and resid 29   and name HN  )  -4.500  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 30   and name N   )
       ( segid A and resid 30   and name HN  )  -22.100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 31   and name N   )
       ( segid A and resid 31   and name HN  )  -6.900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 32   and name N   )
       ( segid A and resid 32   and name HN  )  6.600  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 33   and name N   )
       ( segid A and resid 33   and name HN  )  -15.800  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 34   and name N   )
       ( segid A and resid 34   and name HN  )  -17.300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 35   and name N   )
       ( segid A and resid 35   and name HN  )  2.000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 36   and name N   )
       ( segid A and resid 36   and name HN  )  -0.900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 37   and name N   )
       ( segid A and resid 37   and name HN  )  -27.800  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 38   and name N   )
       ( segid A and resid 38   and name HN  )  -2.300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 39   and name N   )
       ( segid A and resid 39   and name HN  )  -2.100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 40   and name N   )
       ( segid A and resid 40   and name HN  )  -5.400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 41   and name N   )
       ( segid A and resid 41   and name HN  )  -3.100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 42   and name N   )
       ( segid A and resid 42   and name HN  )  15.500  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 43   and name N   )
       ( segid A and resid 43   and name HN  )  11.400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 44   and name N   )
       ( segid A and resid 44   and name HN  )  -6.700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 45   and name N   )
       ( segid A and resid 45   and name HN  )  -22.300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 46   and name N   )
       ( segid A and resid 46   and name HN  )  -31.100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 47   and name N   )
       ( segid A and resid 47   and name HN  )  -7.700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 48   and name N   )
       ( segid A and resid 48   and name HN  )  6.500  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 49   and name N   )
       ( segid A and resid 49   and name HN  )  8.100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 50   and name N   )
       ( segid A and resid 50   and name HN  )  -36.700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 51   and name N   )
       ( segid A and resid 51   and name HN  )  -29.800  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 52   and name N   )
       ( segid A and resid 52   and name HN  )  -29.300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 53   and name N   )
       ( segid A and resid 53   and name HN  )  -21.400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 54   and name N   )
       ( segid A and resid 54   and name HN  )  -11.400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 55   and name N   )
       ( segid A and resid 55   and name HN  )  -5.100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid A and resid 56   and name N   )
       ( segid A and resid 56   and name HN  )  -1.400  0.2000

!unit B
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 43   and name NE1 )
       ( segid B and resid 43   and name HE1 )  2.394  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 2   and name N   )
       ( segid B and resid 2   and name HN  )  -2.100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 3   and name N   )
       ( segid B and resid 3   and name HN  )  -25.600  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 4   and name N   )
       ( segid B and resid 4   and name HN  )  -32.000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 5   and name N   )
       ( segid B and resid 5   and name HN  )  -27.000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 6   and name N   )
       ( segid B and resid 6   and name HN  )  -23.700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 7   and name N   )
       ( segid B and resid 7   and name HN  )  -12.300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 8   and name N   )
       ( segid B and resid 8   and name HN  )  -2.100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 9   and name N   )
       ( segid B and resid 9   and name HN  )  -12.800  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 10   and name N   )
       ( segid B and resid 10   and name HN  )  2.200  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 11   and name N   )
       ( segid B and resid 11   and name HN  )  7.900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 12   and name N   )
       ( segid B and resid 12   and name HN  )  -26.100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 13   and name N   )
       ( segid B and resid 13   and name HN  )  -29.100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 14   and name N   )
       ( segid B and resid 14   and name HN  )  -29.200  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 15   and name N   )
       ( segid B and resid 15   and name HN  )  -33.300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 16   and name N   )
       ( segid B and resid 16   and name HN  )  -33.400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 17   and name N   )
       ( segid B and resid 17   and name HN  )  -33.200  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 18   and name N   )
       ( segid B and resid 18   and name HN  )  -29.200  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 19   and name N   )
       ( segid B and resid 19   and name HN  )  -25.100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 20   and name N   )
       ( segid B and resid 20   and name HN  )  -8.700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 21   and name N   )
       ( segid B and resid 21   and name HN  )  -12.700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 22   and name N   )
       ( segid B and resid 22   and name HN  )  -13.600  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 23   and name N   )
       ( segid B and resid 23   and name HN  )  -17.900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 24  and name N   )
       ( segid B and resid 24   and name HN  )  4.800  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 25  and name N   )
       ( segid B and resid 25   and name HN  )  2.900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 26   and name N   )
       ( segid B and resid 26   and name HN  )  -14.800  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 27   and name N   )
       ( segid B and resid 27   and name HN  )  -13.300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 28   and name N   )
       ( segid B and resid 28   and name HN  )  8.700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 29   and name N   )
       ( segid B and resid 29   and name HN  )  -4.500  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 30   and name N   )
       ( segid B and resid 30   and name HN  )  -22.100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 31   and name N   )
       ( segid B and resid 31   and name HN  )  -6.900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 32   and name N   )
       ( segid B and resid 32   and name HN  )  6.600  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 33   and name N   )
       ( segid B and resid 33   and name HN  )  -15.800  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 34   and name N   )
       ( segid B and resid 34   and name HN  )  -17.300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 35   and name N   )
       ( segid B and resid 35   and name HN  )  2.000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 36   and name N   )
       ( segid B and resid 36   and name HN  )  -0.900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 37   and name N   )
       ( segid B and resid 37   and name HN  )  -27.800  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 38   and name N   )
       ( segid B and resid 38   and name HN  )  -2.300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 39   and name N   )
       ( segid B and resid 39   and name HN  )  -2.100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 40   and name N   )
       ( segid B and resid 40   and name HN  )  -5.400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 41   and name N   )
       ( segid B and resid 41   and name HN  )  -3.100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 42   and name N   )
       ( segid B and resid 42   and name HN  )  15.500  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 43   and name N   )
       ( segid B and resid 43   and name HN  )  11.400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 44   and name N   )
       ( segid B and resid 44   and name HN  )  -6.700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 45   and name N   )
       ( segid B and resid 45   and name HN  )  -22.300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 46   and name N   )
       ( segid B and resid 46   and name HN  )  -31.100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 47   and name N   )
       ( segid B and resid 47   and name HN  )  -7.700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 48   and name N   )
       ( segid B and resid 48   and name HN  )  6.500  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 49   and name N   )
       ( segid B and resid 49   and name HN  )  8.100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 50   and name N   )
       ( segid B and resid 50   and name HN  )  -36.700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 51   and name N   )
       ( segid B and resid 51   and name HN  )  -29.800  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 52   and name N   )
       ( segid B and resid 52   and name HN  )  -29.300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 53   and name N   )
       ( segid B and resid 53   and name HN  )  -21.400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 54   and name N   )
       ( segid B and resid 54   and name HN  )  -11.400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 55   and name N   )
       ( segid B and resid 55   and name HN  )  -5.100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( segid B and resid 56   and name N   )
       ( segid B and resid 56   and name HN  )  -1.400  0.2000




  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1HT       MET   1   5.433 -18.910   2.938
    2   2H    MET   1          2HT       MET   1   5.152 -19.887   1.588
    3   3H    MET   1          3HT       MET   1   4.286 -18.447   1.783
    4    HA   MET   1           HA       MET   1   7.226 -18.435   1.581
    5   1HB   MET   1          2HB       MET   1   6.335 -19.669  -0.353
    6   2HB   MET   1          1HB       MET   1   5.230 -18.345  -0.694
    7   1HG   MET   1          2HG       MET   1   7.116 -16.873  -1.141
    8   2HG   MET   1          1HG       MET   1   8.235 -18.185  -0.774
    9   1HE   MET   1          1HE       MET   1   8.154 -16.621  -3.992
   10   2HE   MET   1          2HE       MET   1   8.975 -18.126  -4.404
   11   3HE   MET   1          3HE       MET   1   9.272 -17.357  -2.844
   12    H    GLN   2           H        GLN   2   7.941 -16.343   0.666
   13    HA   GLN   2           HA       GLN   2   6.178 -14.178   1.586
   14   1HB   GLN   2          2HB       GLN   2   8.343 -14.315   2.727
   15   2HB   GLN   2          1HB       GLN   2   9.176 -14.208   1.183
   16   1HG   GLN   2          2HG       GLN   2   8.273 -11.963   0.850
   17   2HG   GLN   2          1HG       GLN   2   7.439 -12.071   2.399
   18   1HE2  GLN   2          1HE2      GLN   2   8.426 -11.014   3.948
   19   2HE2  GLN   2          2HE2      GLN   2  10.132 -10.807   4.124
   20    H    TYR   3           H        TYR   3   5.648 -12.482   0.251
   21    HA   TYR   3           HA       TYR   3   6.667 -12.623  -2.508
   22   1HB   TYR   3          2HB       TYR   3   3.825 -12.055  -1.647
   23   2HB   TYR   3          1HB       TYR   3   4.421 -11.955  -3.300
   24    HD1  TYR   3           1HD      TYR   3   4.057 -13.776  -4.669
   25    HD2  TYR   3           2HD      TYR   3   4.343 -14.400  -0.471
   26    HE1  TYR   3           1HE      TYR   3   3.560 -16.162  -4.996
   27    HE2  TYR   3           2HE      TYR   3   3.848 -16.788  -0.787
   28    HH   TYR   3           HH       TYR   3   4.189 -18.410  -3.387
   29    H    LYS   4           H        LYS   4   6.971 -10.691  -3.587
   30    HA   LYS   4           HA       LYS   4   7.038  -8.326  -1.846
   31   1HB   LYS   4          2HB       LYS   4   9.167  -9.038  -2.889
   32   2HB   LYS   4          1HB       LYS   4   8.443  -8.825  -4.478
   33   1HG   LYS   4          2HG       LYS   4   8.173  -6.443  -4.047
   34   2HG   LYS   4          1HG       LYS   4   8.873  -6.650  -2.441
   35   1HD   LYS   4          2HD       LYS   4  10.958  -7.453  -3.481
   36   2HD   LYS   4          1HD       LYS   4  10.251  -7.178  -5.073
   37   1HE   LYS   4          2HE       LYS   4  11.704  -5.331  -4.435
   38   2HE   LYS   4          1HE       LYS   4  10.028  -4.798  -4.563
   39   1HZ   LYS   4          1HZ       LYS   4  11.587  -4.240  -2.489
   40   2HZ   LYS   4          2HZ       LYS   4  10.885  -5.675  -1.929
   41   3HZ   LYS   4          3HZ       LYS   4   9.904  -4.370  -2.371
   42    H    VAL   5           H        VAL   5   5.232  -7.142  -2.026
   43    HA   VAL   5           HA       VAL   5   3.883  -6.971  -4.611
   44    HB   VAL   5           HB       VAL   5   2.991  -5.925  -1.921
   45   1HG1  VAL   5          1HG1      VAL   5   1.757  -5.948  -4.636
   46   2HG1  VAL   5          2HG1      VAL   5   1.768  -4.675  -3.416
   47   3HG1  VAL   5          3HG1      VAL   5   0.724  -6.082  -3.213
   48   1HG2  VAL   5          1HG2      VAL   5   3.228  -8.539  -2.571
   49   2HG2  VAL   5          2HG2      VAL   5   1.597  -8.203  -3.152
   50   3HG2  VAL   5          3HG2      VAL   5   2.012  -7.901  -1.465
   51    H    ILE   6           H        ILE   6   3.884  -5.210  -5.848
   52    HA   ILE   6           HA       ILE   6   5.271  -2.825  -4.836
   53    HB   ILE   6           HB       ILE   6   4.902  -3.832  -7.659
   54   1HG1  ILE   6          2HG1      ILE   6   7.380  -3.397  -5.978
   55   2HG1  ILE   6          1HG1      ILE   6   6.645  -4.958  -6.327
   56   1HG2  ILE   6          1HG2      ILE   6   4.928  -1.659  -8.224
   57   2HG2  ILE   6          2HG2      ILE   6   6.654  -1.770  -7.877
   58   3HG2  ILE   6          3HG2      ILE   6   5.547  -1.152  -6.652
   59   1HD1  ILE   6          1HD1      ILE   6   8.604  -4.511  -7.719
   60   2HD1  ILE   6          2HD1      ILE   6   7.802  -3.084  -8.376
   61   3HD1  ILE   6          3HD1      ILE   6   7.137  -4.689  -8.681
   62    H    LEU   7           H        LEU   7   4.040  -1.158  -4.362
   63    HA   LEU   7           HA       LEU   7   1.360  -0.959  -5.530
   64   1HB   LEU   7          2HB       LEU   7   2.488   0.765  -3.331
   65   2HB   LEU   7          1HB       LEU   7   0.807   0.484  -3.732
   66    HG   LEU   7           HG       LEU   7   2.704  -1.453  -2.434
   67   1HD1  LEU   7          1HD1      LEU   7   1.741   0.268  -0.979
   68   2HD1  LEU   7          2HD1      LEU   7   1.138  -1.340  -0.582
   69   3HD1  LEU   7          3HD1      LEU   7   0.123  -0.217  -1.486
   70   1HD2  LEU   7          1HD2      LEU   7  -0.165  -1.961  -3.200
   71   2HD2  LEU   7          2HD2      LEU   7   0.984  -3.099  -2.495
   72   3HD2  LEU   7          3HD2      LEU   7   1.216  -2.520  -4.144
   73    H    ASN   8           H        ASN   8   2.125  -0.302  -7.582
   74    HA   ASN   8           HA       ASN   8   3.508   2.252  -7.776
   75   1HB   ASN   8          2HB       ASN   8   4.191   0.287  -9.153
   76   2HB   ASN   8          1HB       ASN   8   2.638   0.372  -9.976
   77   1HD2  ASN   8          1HD2      ASN   8   5.694   0.966 -10.469
   78   2HD2  ASN   8          2HD2      ASN   8   5.623   2.382 -11.458
   79    H    GLY   9           H        GLY   9   2.282   4.023  -7.652
   80   1HA   GLY   9          2HA       GLY   9  -0.256   4.042  -9.169
   81   2HA   GLY   9          1HA       GLY   9  -0.025   4.926  -7.667
   82    H    LYS  10           H        LYS  10  -0.802   6.720  -9.101
   83    HA   LYS  10           HA       LYS  10   1.166   7.718 -10.987
   84   1HB   LYS  10          2HB       LYS  10  -1.464   8.904 -10.071
   85   2HB   LYS  10          1HB       LYS  10  -0.454   9.550 -11.357
   86   1HG   LYS  10          2HG       LYS  10  -0.772   7.476 -12.630
   87   2HG   LYS  10          1HG       LYS  10  -1.819   6.866 -11.347
   88   1HD   LYS  10          2HD       LYS  10  -2.307   9.346 -12.997
   89   2HD   LYS  10          1HD       LYS  10  -3.119   7.793 -13.206
   90   1HE   LYS  10          2HE       LYS  10  -4.036   7.974 -10.941
   91   2HE   LYS  10          1HE       LYS  10  -3.229   9.529 -10.741
   92   1HZ   LYS  10          1HZ       LYS  10  -4.550  10.134 -12.870
   93   2HZ   LYS  10          2HZ       LYS  10  -5.330  10.156 -11.370
   94   3HZ   LYS  10          3HZ       LYS  10  -5.547   8.844 -12.414
   95    H    THR  11           H        THR  11  -0.468   8.993  -8.095
   96    HA   THR  11           HA       THR  11   1.702  10.882  -7.669
   97    HB   THR  11           HB       THR  11   0.105  11.599  -5.765
   98    HG1  THR  11           1HG      THR  11  -2.118  10.987  -6.387
   99   1HG2  THR  11          1HG2      THR  11   0.118  13.132  -7.469
  100   2HG2  THR  11          2HG2      THR  11  -1.559  12.588  -7.508
  101   3HG2  THR  11          3HG2      THR  11  -0.399  11.955  -8.676
  102    H    LEU  12           H        LEU  12   0.961   7.760  -6.816
  103    HA   LEU  12           HA       LEU  12   2.678   7.953  -4.456
  104   1HB   LEU  12          2HB       LEU  12   0.382   7.807  -3.658
  105   2HB   LEU  12          1HB       LEU  12   0.120   6.365  -4.623
  106    HG   LEU  12           HG       LEU  12   1.634   5.100  -3.269
  107   1HD1  LEU  12          1HD1      LEU  12   3.393   6.185  -2.456
  108   2HD1  LEU  12          2HD1      LEU  12   2.340   6.701  -1.136
  109   3HD1  LEU  12          3HD1      LEU  12   2.574   7.737  -2.540
  110   1HD2  LEU  12          1HD2      LEU  12   0.134   4.775  -1.653
  111   2HD2  LEU  12          2HD2      LEU  12  -0.765   6.108  -2.375
  112   3HD2  LEU  12          3HD2      LEU  12   0.328   6.412  -1.026
  113    H    LYS  13           H        LYS  13   4.173   6.413  -4.257
  114    HA   LYS  13           HA       LYS  13   3.989   3.960  -5.822
  115   1HB   LYS  13          2HB       LYS  13   6.295   5.901  -6.076
  116   2HB   LYS  13          1HB       LYS  13   6.287   4.265  -6.719
  117   1HG   LYS  13          2HG       LYS  13   4.405   4.841  -8.167
  118   2HG   LYS  13          1HG       LYS  13   4.416   6.483  -7.523
  119   1HD   LYS  13          2HD       LYS  13   6.697   5.165  -8.995
  120   2HD   LYS  13          1HD       LYS  13   5.565   6.324  -9.693
  121   1HE   LYS  13          2HE       LYS  13   7.448   6.848  -7.394
  122   2HE   LYS  13          1HE       LYS  13   7.665   7.400  -9.054
  123   1HZ   LYS  13          1HZ       LYS  13   6.657   9.232  -8.279
  124   2HZ   LYS  13          2HZ       LYS  13   5.938   8.435  -6.972
  125   3HZ   LYS  13          3HZ       LYS  13   5.231   8.349  -8.506
  126    H    GLY  14           H        GLY  14   5.190   2.243  -4.951
  127   1HA   GLY  14          2HA       GLY  14   7.180   2.563  -2.969
  128   2HA   GLY  14          1HA       GLY  14   5.628   2.299  -2.192
  129    H    GLU  15           H        GLU  15   7.032   0.451  -1.405
  130    HA   GLU  15           HA       GLU  15   6.391  -1.898  -3.023
  131   1HB   GLU  15          2HB       GLU  15   9.116  -1.404  -1.803
  132   2HB   GLU  15          1HB       GLU  15   8.609  -2.877  -2.621
  133   1HG   GLU  15          2HG       GLU  15   8.354  -1.660  -4.704
  134   2HG   GLU  15          1HG       GLU  15   8.797  -0.157  -3.895
  135    H    THR  16           H        THR  16   5.765  -3.644  -1.843
  136    HA   THR  16           HA       THR  16   6.147  -3.587   1.053
  137    HB   THR  16           HB       THR  16   4.032  -2.643   1.036
  138    HG1  THR  16           1HG      THR  16   3.409  -5.377   0.887
  139   1HG2  THR  16          1HG2      THR  16   3.819  -3.399  -1.582
  140   2HG2  THR  16          2HG2      THR  16   2.554  -2.642  -0.621
  141   3HG2  THR  16          3HG2      THR  16   2.601  -4.394  -0.791
  142    H    THR  17           H        THR  17   5.355  -5.714   2.069
  143    HA   THR  17           HA       THR  17   5.582  -7.972   0.224
  144    HB   THR  17           HB       THR  17   7.281  -9.047   1.696
  145    HG1  THR  17           1HG      THR  17   7.436  -6.458   2.841
  146   1HG2  THR  17          1HG2      THR  17   8.203  -8.130  -0.247
  147   2HG2  THR  17          2HG2      THR  17   9.201  -7.521   1.074
  148   3HG2  THR  17          3HG2      THR  17   7.990  -6.477   0.330
  149    H    THR  18           H        THR  18   4.032  -9.360   0.628
  150    HA   THR  18           HA       THR  18   2.956  -9.624   3.376
  151    HB   THR  18           HB       THR  18   1.342  -8.892   1.609
  152    HG1  THR  18           1HG      THR  18   0.683 -10.155   3.429
  153   1HG2  THR  18          1HG2      THR  18   0.705 -11.274   0.340
  154   2HG2  THR  18          2HG2      THR  18   2.452 -11.115   0.160
  155   3HG2  THR  18          3HG2      THR  18   1.387  -9.823  -0.393
  156    H    GLU  19           H        GLU  19   2.681 -11.724   4.231
  157    HA   GLU  19           HA       GLU  19   4.234 -13.803   2.837
  158   1HB   GLU  19          2HB       GLU  19   5.157 -13.139   5.008
  159   2HB   GLU  19          1HB       GLU  19   3.622 -13.504   5.784
  160   1HG   GLU  19          2HG       GLU  19   3.874 -15.855   5.182
  161   2HG   GLU  19          1HG       GLU  19   5.411 -15.490   4.400
  162    H    ALA  20           H        ALA  20   3.077 -15.413   1.943
  163    HA   ALA  20           HA       ALA  20   0.776 -16.461   3.374
  164   1HB   ALA  20          1HB       ALA  20   0.384 -15.779   0.489
  165   2HB   ALA  20          2HB       ALA  20   0.087 -14.579   1.746
  166   3HB   ALA  20          3HB       ALA  20  -0.821 -16.090   1.740
  167    H    VAL  21           H        VAL  21   0.188 -18.521   2.798
  168    HA   VAL  21           HA       VAL  21   2.143 -20.338   2.172
  169    HB   VAL  21           HB       VAL  21  -0.780 -20.763   1.556
  170   1HG1  VAL  21          1HG1      VAL  21  -0.118 -23.116   2.357
  171   2HG1  VAL  21          2HG1      VAL  21   1.539 -22.591   2.058
  172   3HG1  VAL  21          3HG1      VAL  21   0.370 -22.612   0.738
  173   1HG2  VAL  21          1HG2      VAL  21  -0.752 -21.715   3.943
  174   2HG2  VAL  21          2HG2      VAL  21  -0.817 -19.963   3.742
  175   3HG2  VAL  21          3HG2      VAL  21   0.707 -20.747   4.157
  176    H    ASP  22           H        ASP  22   0.250 -18.470  -0.045
  177    HA   ASP  22           HA       ASP  22   1.883 -19.390  -2.241
  178   1HB   ASP  22          2HB       ASP  22   0.068 -20.142  -3.677
  179   2HB   ASP  22          1HB       ASP  22   0.112 -21.104  -2.203
  180    H    ALA  23           H        ALA  23   1.064 -18.309  -4.372
  181    HA   ALA  23           HA       ALA  23   1.234 -15.547  -4.009
  182   1HB   ALA  23          1HB       ALA  23   1.533 -17.184  -6.129
  183   2HB   ALA  23          2HB       ALA  23   1.400 -15.430  -6.254
  184   3HB   ALA  23          3HB       ALA  23  -0.019 -16.443  -6.516
  185    H    ALA  24           H        ALA  24  -1.584 -17.594  -4.618
  186    HA   ALA  24           HA       ALA  24  -3.451 -15.493  -4.885
  187   1HB   ALA  24          1HB       ALA  24  -3.722 -18.017  -5.410
  188   2HB   ALA  24          2HB       ALA  24  -5.115 -17.122  -4.803
  189   3HB   ALA  24          3HB       ALA  24  -4.189 -18.156  -3.715
  190    H    THR  25           H        THR  25  -2.688 -17.555  -2.057
  191    HA   THR  25           HA       THR  25  -4.280 -16.308  -0.188
  192    HB   THR  25           HB       THR  25  -2.579 -17.071   1.476
  193    HG1  THR  25           1HG      THR  25  -1.102 -17.446  -0.865
  194   1HG2  THR  25          1HG2      THR  25  -2.444 -19.525   0.366
  195   2HG2  THR  25          2HG2      THR  25  -3.794 -18.822  -0.526
  196   3HG2  THR  25          3HG2      THR  25  -3.843 -18.897   1.236
  197    H    ALA  26           H        ALA  26  -0.989 -15.505  -1.244
  198    HA   ALA  26           HA       ALA  26  -0.575 -13.288   0.422
  199   1HB   ALA  26          1HB       ALA  26   0.828 -12.587  -1.771
  200   2HB   ALA  26          2HB       ALA  26   0.601 -14.305  -2.091
  201   3HB   ALA  26          3HB       ALA  26   1.387 -13.783  -0.602
  202    H    GLU  27           H        GLU  27  -1.764 -13.444  -2.946
  203    HA   GLU  27           HA       GLU  27  -2.333 -10.782  -3.342
  204   1HB   GLU  27          2HB       GLU  27  -2.469 -12.484  -5.099
  205   2HB   GLU  27          1HB       GLU  27  -3.891 -13.170  -4.328
  206   1HG   GLU  27          2HG       GLU  27  -5.117 -11.101  -4.734
  207   2HG   GLU  27          1HG       GLU  27  -3.690 -10.404  -5.497
  208    H    LYS  28           H        LYS  28  -4.363 -13.288  -1.881
  209    HA   LYS  28           HA       LYS  28  -6.616 -11.636  -1.434
  210   1HB   LYS  28          2HB       LYS  28  -5.749 -14.157  -0.006
  211   2HB   LYS  28          1HB       LYS  28  -7.335 -13.411   0.137
  212   1HG   LYS  28          2HG       LYS  28  -6.127 -14.593  -2.354
  213   2HG   LYS  28          1HG       LYS  28  -7.437 -15.272  -1.387
  214   1HD   LYS  28          2HD       LYS  28  -8.834 -13.340  -1.916
  215   2HD   LYS  28          1HD       LYS  28  -7.520 -12.645  -2.869
  216   1HE   LYS  28          2HE       LYS  28  -9.166 -13.742  -4.300
  217   2HE   LYS  28          1HE       LYS  28  -7.602 -14.550  -4.389
  218   1HZ   LYS  28          1HZ       LYS  28  -8.432 -16.219  -2.838
  219   2HZ   LYS  28          2HZ       LYS  28  -9.388 -16.151  -4.231
  220   3HZ   LYS  28          3HZ       LYS  28  -9.939 -15.452  -2.793
  221    H    VAL  29           H        VAL  29  -3.957 -12.674   0.692
  222    HA   VAL  29           HA       VAL  29  -4.730 -11.347   3.006
  223    HB   VAL  29           HB       VAL  29  -1.909 -11.767   1.995
  224   1HG1  VAL  29          1HG1      VAL  29  -1.882 -11.891   4.754
  225   2HG1  VAL  29          2HG1      VAL  29  -2.960 -10.539   4.407
  226   3HG1  VAL  29          3HG1      VAL  29  -1.318 -10.545   3.763
  227   1HG2  VAL  29          1HG2      VAL  29  -2.918 -13.530   4.094
  228   2HG2  VAL  29          2HG2      VAL  29  -2.028 -13.913   2.621
  229   3HG2  VAL  29          3HG2      VAL  29  -3.776 -13.692   2.562
  230    H    VAL  30           H        VAL  30  -2.918 -10.195   0.214
  231    HA   VAL  30           HA       VAL  30  -2.330  -7.611   1.199
  232    HB   VAL  30           HB       VAL  30  -2.740  -8.478  -1.671
  233   1HG1  VAL  30          1HG1      VAL  30  -1.580  -6.536  -2.339
  234   2HG1  VAL  30          2HG1      VAL  30  -1.082  -6.170  -0.687
  235   3HG1  VAL  30          3HG1      VAL  30  -2.772  -5.990  -1.159
  236   1HG2  VAL  30          1HG2      VAL  30  -0.653  -9.322  -1.720
  237   2HG2  VAL  30          2HG2      VAL  30  -0.903  -9.503   0.017
  238   3HG2  VAL  30          3HG2      VAL  30  -0.023  -8.108  -0.606
  239    H    LYS  31           H        LYS  31  -5.004  -8.866  -0.810
  240    HA   LYS  31           HA       LYS  31  -6.395  -6.522  -1.239
  241   1HB   LYS  31          2HB       LYS  31  -7.362  -9.343  -0.849
  242   2HB   LYS  31          1HB       LYS  31  -8.473  -8.026  -1.203
  243   1HG   LYS  31          2HG       LYS  31  -7.263  -7.564  -3.273
  244   2HG   LYS  31          1HG       LYS  31  -6.161  -8.897  -2.923
  245   1HD   LYS  31          2HD       LYS  31  -8.009 -10.475  -3.021
  246   2HD   LYS  31          1HD       LYS  31  -9.144  -9.152  -3.299
  247   1HE   LYS  31          2HE       LYS  31  -7.992  -8.612  -5.393
  248   2HE   LYS  31          1HE       LYS  31  -6.869  -9.942  -5.116
  249   1HZ   LYS  31          1HZ       LYS  31  -9.086 -10.169  -6.563
  250   2HZ   LYS  31          2HZ       LYS  31  -9.687 -10.635  -5.053
  251   3HZ   LYS  31          3HZ       LYS  31  -8.382 -11.466  -5.735
  252    H    GLN  32           H        GLN  32  -6.492  -8.657   1.568
  253    HA   GLN  32           HA       GLN  32  -8.517  -7.299   2.985
  254   1HB   GLN  32          2HB       GLN  32  -7.695  -9.550   3.609
  255   2HB   GLN  32          1HB       GLN  32  -6.157  -8.846   4.087
  256   1HG   GLN  32          2HG       GLN  32  -7.474  -9.268   6.039
  257   2HG   GLN  32          1HG       GLN  32  -7.319  -7.530   5.809
  258   1HE2  GLN  32          1HE2      GLN  32  -9.480  -8.849   3.573
  259   2HE2  GLN  32          2HE2      GLN  32 -10.945  -8.479   4.404
  260    H    PHE  33           H        PHE  33  -5.054  -6.870   2.752
  261    HA   PHE  33           HA       PHE  33  -4.570  -5.008   4.746
  262   1HB   PHE  33          2HB       PHE  33  -2.907  -6.176   3.217
  263   2HB   PHE  33          1HB       PHE  33  -3.318  -4.984   1.992
  264    HD1  PHE  33           1HD      PHE  33  -2.214  -5.150   5.543
  265    HD2  PHE  33           2HD      PHE  33  -1.995  -3.122   1.801
  266    HE1  PHE  33           1HE      PHE  33  -0.524  -3.618   6.467
  267    HE2  PHE  33           2HE      PHE  33  -0.304  -1.599   2.724
  268    HZ   PHE  33           HZ       PHE  33   0.434  -1.848   5.063
  269    H    PHE  34           H        PHE  34  -5.138  -4.338   1.333
  270    HA   PHE  34           HA       PHE  34  -5.576  -1.540   1.693
  271   1HB   PHE  34          2HB       PHE  34  -6.263  -3.302  -0.663
  272   2HB   PHE  34          1HB       PHE  34  -6.219  -1.535  -0.674
  273    HD1  PHE  34           1HD      PHE  34  -3.895  -0.802   0.736
  274    HD2  PHE  34           2HD      PHE  34  -4.463  -4.128  -1.848
  275    HE1  PHE  34           1HE      PHE  34  -1.478  -0.876   0.313
  276    HE2  PHE  34           2HE      PHE  34  -2.044  -4.205  -2.287
  277    HZ   PHE  34           HZ       PHE  34  -0.555  -2.577  -1.188
  278    H    ASN  35           H        ASN  35  -7.701  -4.313   1.330
  279    HA   ASN  35           HA       ASN  35 -10.167  -3.082   1.109
  280   1HB   ASN  35          2HB       ASN  35  -9.831  -5.517   1.006
  281   2HB   ASN  35          1HB       ASN  35  -9.439  -5.542   2.722
  282   1HD2  ASN  35          1HD2      ASN  35 -11.681  -6.463   0.752
  283   2HD2  ASN  35          2HD2      ASN  35 -13.115  -6.178   1.673
  284    H    ASP  36           H        ASP  36  -8.158  -3.639   3.898
  285    HA   ASP  36           HA       ASP  36 -10.074  -2.350   5.686
  286   1HB   ASP  36          2HB       ASP  36  -7.472  -3.774   6.263
  287   2HB   ASP  36          1HB       ASP  36  -8.492  -3.037   7.494
  288    H    ASN  37           H        ASN  37  -7.092  -1.597   4.047
  289    HA   ASN  37           HA       ASN  37  -6.469   0.618   5.807
  290   1HB   ASN  37          2HB       ASN  37  -5.347  -0.159   3.102
  291   2HB   ASN  37          1HB       ASN  37  -4.784   1.218   4.040
  292   1HD2  ASN  37          1HD2      ASN  37  -3.622  -1.463   3.128
  293   2HD2  ASN  37          2HD2      ASN  37  -2.886  -2.079   4.566
  294    H    GLY  38           H        GLY  38  -7.721   0.127   2.568
  295   1HA   GLY  38          2HA       GLY  38  -8.203   2.089   1.141
  296   2HA   GLY  38          1HA       GLY  38  -9.647   1.365   1.812
  297    H    VAL  39           H        VAL  39 -11.046   2.750   2.540
  298    HA   VAL  39           HA       VAL  39 -10.153   5.458   3.194
  299    HB   VAL  39           HB       VAL  39 -12.951   4.489   2.694
  300   1HG1  VAL  39          1HG1      VAL  39 -11.702   7.166   3.090
  301   2HG1  VAL  39          2HG1      VAL  39 -13.235   6.535   3.693
  302   3HG1  VAL  39          3HG1      VAL  39 -13.084   7.020   2.004
  303   1HG2  VAL  39          1HG2      VAL  39 -12.677   5.365   0.418
  304   2HG2  VAL  39          2HG2      VAL  39 -11.567   4.036   0.749
  305   3HG2  VAL  39          3HG2      VAL  39 -10.979   5.698   0.758
  306    H    ASP  40           H        ASP  40 -10.961   2.755   5.093
  307    HA   ASP  40           HA       ASP  40 -11.920   4.578   7.184
  308   1HB   ASP  40          2HB       ASP  40 -12.793   1.721   6.717
  309   2HB   ASP  40          1HB       ASP  40 -13.273   2.721   8.085
  310    H    GLY  41           H        GLY  41  -9.225   3.276   6.369
  311   1HA   GLY  41          2HA       GLY  41  -8.606   1.528   8.561
  312   2HA   GLY  41          1HA       GLY  41  -7.467   2.184   7.398
  313    H    GLU  42           H        GLU  42  -6.722   1.949   9.995
  314    HA   GLU  42           HA       GLU  42  -7.028   4.580  11.237
  315   1HB   GLU  42          2HB       GLU  42  -5.673   2.074  12.254
  316   2HB   GLU  42          1HB       GLU  42  -5.870   3.565  13.166
  317   1HG   GLU  42          2HG       GLU  42  -8.295   3.311  13.066
  318   2HG   GLU  42          1HG       GLU  42  -8.100   1.817  12.149
  319    H    TRP  43           H        TRP  43  -5.744   5.994  10.164
  320    HA   TRP  43           HA       TRP  43  -2.986   5.238   9.565
  321   1HB   TRP  43          2HB       TRP  43  -4.556   7.694   8.771
  322   2HB   TRP  43          1HB       TRP  43  -2.942   7.279   8.208
  323    HD1  TRP  43           HD       TRP  43  -5.659   4.571   8.353
  324    HE1  TRP  43           1HE      TRP  43  -6.246   3.891   5.942
  325    HE3  TRP  43           3HE      TRP  43  -2.991   8.123   5.834
  326    HZ2  TRP  43           2HZ      TRP  43  -5.654   4.743   3.321
  327    HZ3  TRP  43           3HZ      TRP  43  -3.054   8.122   3.381
  328    HH2  TRP  43           HH       TRP  43  -4.358   6.467   2.146
  329    H    THR  44           H        THR  44  -1.396   5.797  10.893
  330    HA   THR  44           HA       THR  44  -1.795   8.073  12.711
  331    HB   THR  44           HB       THR  44   0.091   7.088  14.012
  332    HG1  THR  44           1HG      THR  44  -0.187   4.880  12.262
  333   1HG2  THR  44          1HG2      THR  44  -1.170   4.800  14.468
  334   2HG2  THR  44          2HG2      THR  44  -2.443   5.635  13.578
  335   3HG2  THR  44          3HG2      THR  44  -1.777   6.352  15.045
  336    H    TYR  45           H        TYR  45  -0.390   9.805  12.657
  337    HA   TYR  45           HA       TYR  45   1.576   9.755  10.465
  338   1HB   TYR  45          2HB       TYR  45  -0.256  11.350  10.140
  339   2HB   TYR  45          1HB       TYR  45   0.126  12.115  11.678
  340    HD1  TYR  45           1HD      TYR  45   2.468  10.964   9.026
  341    HD2  TYR  45           2HD      TYR  45   0.758  14.282  11.067
  342    HE1  TYR  45           1HE      TYR  45   4.037  12.470   7.879
  343    HE2  TYR  45           2HE      TYR  45   2.322  15.798   9.925
  344    HH   TYR  45           HH       TYR  45   4.415  15.772   8.791
  345    H    ASP  46           H        ASP  46   3.634  10.452  10.756
  346    HA   ASP  46           HA       ASP  46   4.436  11.190  13.492
  347   1HB   ASP  46          2HB       ASP  46   5.127   8.883  12.985
  348   2HB   ASP  46          1HB       ASP  46   5.964   9.447  11.542
  349    H    ASP  47           H        ASP  47   4.258  13.397  12.804
  350    HA   ASP  47           HA       ASP  47   5.382  14.619  10.633
  351   1HB   ASP  47          2HB       ASP  47   5.289  15.691  13.459
  352   2HB   ASP  47          1HB       ASP  47   5.533  16.664  12.011
  353    H    ALA  48           H        ALA  48   7.030  13.604  13.579
  354    HA   ALA  48           HA       ALA  48   9.427  14.908  13.374
  355   1HB   ALA  48          1HB       ALA  48   9.379  13.679  15.271
  356   2HB   ALA  48          2HB       ALA  48  10.321  12.563  14.283
  357   3HB   ALA  48          3HB       ALA  48   8.589  12.306  14.497
  358    H    THR  49           H        THR  49   8.301  12.236  11.408
  359    HA   THR  49           HA       THR  49  10.791  12.443   9.848
  360    HB   THR  49           HB       THR  49  10.611  10.026   9.349
  361    HG1  THR  49           1HG      THR  49   8.299   9.965   9.884
  362   1HG2  THR  49          1HG2      THR  49  10.779  10.733  12.264
  363   2HG2  THR  49          2HG2      THR  49  12.107  10.549  11.119
  364   3HG2  THR  49          3HG2      THR  49  11.164   9.141  11.610
  365    H    LYS  50           H        LYS  50   7.832  13.412   9.688
  366    HA   LYS  50           HA       LYS  50   6.215  13.707   8.075
  367   1HB   LYS  50          2HB       LYS  50   8.715  13.487   6.392
  368   2HB   LYS  50          1HB       LYS  50   7.155  13.960   5.739
  369   1HG   LYS  50          2HG       LYS  50   8.599  15.428   7.935
  370   2HG   LYS  50          1HG       LYS  50   8.658  15.861   6.225
  371   1HD   LYS  50          2HD       LYS  50   6.159  16.057   6.284
  372   2HD   LYS  50          1HD       LYS  50   6.247  15.847   8.034
  373   1HE   LYS  50          2HE       LYS  50   7.556  18.045   6.436
  374   2HE   LYS  50          1HE       LYS  50   6.114  18.209   7.436
  375   1HZ   LYS  50          1HZ       LYS  50   7.438  17.638   9.375
  376   2HZ   LYS  50          2HZ       LYS  50   8.085  18.988   8.590
  377   3HZ   LYS  50          3HZ       LYS  50   8.821  17.476   8.415
  378    H    THR  51           H        THR  51   6.582  11.001   8.968
  379    HA   THR  51           HA       THR  51   5.839   9.548   6.520
  380    HB   THR  51           HB       THR  51   7.304   8.518   8.953
  381    HG1  THR  51           1HG      THR  51   8.586   9.686   7.464
  382   1HG2  THR  51          1HG2      THR  51   6.694   6.467   8.425
  383   2HG2  THR  51          2HG2      THR  51   7.453   6.670   6.846
  384   3HG2  THR  51          3HG2      THR  51   5.748   7.062   7.061
  385    H    PHE  52           H        PHE  52   4.124   8.181   6.564
  386    HA   PHE  52           HA       PHE  52   2.387   8.330   8.941
  387   1HB   PHE  52          2HB       PHE  52   1.603   7.693   6.084
  388   2HB   PHE  52          1HB       PHE  52   0.512   7.941   7.440
  389    HD1  PHE  52           1HD      PHE  52  -0.574   9.952   7.508
  390    HD2  PHE  52           2HD      PHE  52   3.298   9.771   5.747
  391    HE1  PHE  52           1HE      PHE  52  -0.723  12.342   6.936
  392    HE2  PHE  52           2HE      PHE  52   3.156  12.159   5.180
  393    HZ   PHE  52           HZ       PHE  52   1.144  13.448   5.774
  394    H    THR  53           H        THR  53   1.543   6.413   9.805
  395    HA   THR  53           HA       THR  53   2.578   3.942   8.589
  396    HB   THR  53           HB       THR  53   2.442   3.069  11.040
  397    HG1  THR  53           1HG      THR  53   2.700   5.861  11.431
  398   1HG2  THR  53          1HG2      THR  53   4.575   4.560   9.690
  399   2HG2  THR  53          2HG2      THR  53   4.584   2.953  10.422
  400   3HG2  THR  53          3HG2      THR  53   4.748   4.388  11.437
  401    H    VAL  54           H        VAL  54   0.910   3.131   7.578
  402    HA   VAL  54           HA       VAL  54  -1.760   3.135   8.705
  403    HB   VAL  54           HB       VAL  54  -0.732   1.754   6.211
  404   1HG1  VAL  54          1HG1      VAL  54  -2.830   0.817   7.192
  405   2HG1  VAL  54          2HG1      VAL  54  -3.020   1.483   5.570
  406   3HG1  VAL  54          3HG1      VAL  54  -3.577   2.399   6.971
  407   1HG2  VAL  54          1HG2      VAL  54  -1.096   3.636   5.016
  408   2HG2  VAL  54          2HG2      VAL  54  -0.810   4.418   6.571
  409   3HG2  VAL  54          3HG2      VAL  54  -2.460   4.137   6.016
  410    H    THR  55           H        THR  55  -2.156   1.783  10.339
  411    HA   THR  55           HA       THR  55  -0.842  -0.839  10.330
  412    HB   THR  55           HB       THR  55  -2.268   0.499  12.626
  413    HG1  THR  55           1HG      THR  55  -0.464   1.714  12.050
  414   1HG2  THR  55          1HG2      THR  55  -0.849  -1.020  13.986
  415   2HG2  THR  55          2HG2      THR  55  -0.392  -1.848  12.496
  416   3HG2  THR  55          3HG2      THR  55  -2.076  -1.845  13.024
  417    H    GLU  56           H        GLU  56  -1.942  -2.524   9.647
  418    HA   GLU  56           HA       GLU  56  -4.639  -2.564   9.004
  419   1HB   GLU  56          2HB       GLU  56  -3.066  -4.200   8.132
  420   2HB   GLU  56          1HB       GLU  56  -2.820  -4.862   9.741
  421   1HG   GLU  56          2HG       GLU  56  -4.273  -6.282   8.413
  422   2HG   GLU  56          1HG       GLU  56  -5.126  -5.619   9.805
  423   1H    MET   1          1HT       MET   1   5.932  18.825  -2.768
  424   2H    MET   1          2HT       MET   1   5.655  19.809  -1.420
  425   3H    MET   1          3HT       MET   1   4.758  18.390  -1.629
  426    HA   MET   1           HA       MET   1   7.692  18.308  -1.386
  427   1HB   MET   1          2HB       MET   1   6.805  19.563   0.536
  428   2HB   MET   1          1HB       MET   1   5.664  18.266   0.862
  429   1HG   MET   1          2HG       MET   1   7.508  16.748   1.335
  430   2HG   MET   1          1HG       MET   1   8.663  18.032   0.983
  431   1HE   MET   1          1HE       MET   1   8.498  16.472   4.200
  432   2HE   MET   1          2HE       MET   1   9.350  17.957   4.623
  433   3HE   MET   1          3HE       MET   1   9.650  17.181   3.068
  434    H    GLN   2           H        GLN   2   8.344  16.199  -0.461
  435    HA   GLN   2           HA       GLN   2   6.542  14.077  -1.406
  436   1HB   GLN   2          2HB       GLN   2   8.727  14.162  -2.516
  437   2HB   GLN   2          1HB       GLN   2   9.534  14.034  -0.960
  438   1HG   GLN   2          2HG       GLN   2   8.572  11.812  -0.640
  439   2HG   GLN   2          1HG       GLN   2   7.764  11.940  -2.202
  440   1HE2  GLN   2          1HE2      GLN   2   8.747  10.859  -3.736
  441   2HE2  GLN   2          2HE2      GLN   2  10.450  10.611  -3.889
  442    H    TYR   3           H        TYR   3   5.953  12.394  -0.079
  443    HA   TYR   3           HA       TYR   3   6.937  12.511   2.695
  444   1HB   TYR   3          2HB       TYR   3   4.093  12.012   1.793
  445   2HB   TYR   3          1HB       TYR   3   4.664  11.898   3.455
  446    HD1  TYR   3           1HD      TYR   3   4.325  13.727   4.819
  447    HD2  TYR   3           2HD      TYR   3   4.685  14.344   0.625
  448    HE1  TYR   3           1HE      TYR   3   3.881  16.124   5.139
  449    HE2  TYR   3           2HE      TYR   3   4.243  16.744   0.934
  450    HH   TYR   3           HH       TYR   3   4.587  18.357   3.539
  451    H    LYS   4           H        LYS   4   7.177  10.572   3.777
  452    HA   LYS   4           HA       LYS   4   7.211   8.205   2.038
  453   1HB   LYS   4          2HB       LYS   4   9.341   8.867   3.111
  454   2HB   LYS   4          1HB       LYS   4   8.591   8.671   4.689
  455   1HG   LYS   4          2HG       LYS   4   8.269   6.296   4.254
  456   2HG   LYS   4          1HG       LYS   4   8.997   6.486   2.657
  457   1HD   LYS   4          2HD       LYS   4  11.085   7.240   3.727
  458   2HD   LYS   4          1HD       LYS   4  10.350   6.980   5.310
  459   1HE   LYS   4          2HE       LYS   4  11.766   5.099   4.690
  460   2HE   LYS   4          1HE       LYS   4  10.076   4.607   4.795
  461   1HZ   LYS   4          1HZ       LYS   4  11.651   4.012   2.743
  462   2HZ   LYS   4          2HZ       LYS   4  10.992   5.462   2.174
  463   3HZ   LYS   4          3HZ       LYS   4   9.973   4.181   2.602
  464    H    VAL   5           H        VAL   5   5.376   7.066   2.191
  465    HA   VAL   5           HA       VAL   5   3.986   6.929   4.757
  466    HB   VAL   5           HB       VAL   5   3.107   5.905   2.054
  467   1HG1  VAL   5          1HG1      VAL   5   1.835   5.958   4.752
  468   2HG1  VAL   5          2HG1      VAL   5   1.833   4.685   3.532
  469   3HG1  VAL   5          3HG1      VAL   5   0.826   6.116   3.314
  470   1HG2  VAL   5          1HG2      VAL   5   3.398   8.512   2.708
  471   2HG2  VAL   5          2HG2      VAL   5   1.751   8.216   3.266
  472   3HG2  VAL   5          3HG2      VAL   5   2.182   7.903   1.584
  473    H    ILE   6           H        ILE   6   3.927   5.168   5.994
  474    HA   ILE   6           HA       ILE   6   5.269   2.751   5.001
  475    HB   ILE   6           HB       ILE   6   4.885   3.766   7.818
  476   1HG1  ILE   6          2HG1      ILE   6   7.375   3.272   6.172
  477   2HG1  ILE   6          1HG1      ILE   6   6.673   4.849   6.512
  478   1HG2  ILE   6          1HG2      ILE   6   4.851   1.594   8.382
  479   2HG2  ILE   6          2HG2      ILE   6   6.584   1.663   8.061
  480   3HG2  ILE   6          3HG2      ILE   6   5.479   1.071   6.820
  481   1HD1  ILE   6          1HD1      ILE   6   8.601   4.356   7.931
  482   2HD1  ILE   6          2HD1      ILE   6   7.756   2.949   8.576
  483   3HD1  ILE   6          3HD1      ILE   6   7.126   4.569   8.872
  484    H    LEU   7           H        LEU   7   4.006   1.114   4.509
  485    HA   LEU   7           HA       LEU   7   1.305   0.980   5.639
  486   1HB   LEU   7          2HB       LEU   7   2.421  -0.771   3.455
  487   2HB   LEU   7          1HB       LEU   7   0.742  -0.450   3.833
  488    HG   LEU   7           HG       LEU   7   2.704   1.441   2.562
  489   1HD1  LEU   7          1HD1      LEU   7   1.719  -0.257   1.093
  490   2HD1  LEU   7          2HD1      LEU   7   1.161   1.366   0.689
  491   3HD1  LEU   7          3HD1      LEU   7   0.107   0.267   1.578
  492   1HD2  LEU   7          1HD2      LEU   7  -0.162   2.019   3.288
  493   2HD2  LEU   7          2HD2      LEU   7   1.023   3.129   2.599
  494   3HD2  LEU   7          3HD2      LEU   7   1.218   2.544   4.251
  495    H    ASN   8           H        ASN   8   2.024   0.304   7.701
  496    HA   ASN   8           HA       ASN   8   3.342  -2.283   7.914
  497   1HB   ASN   8          2HB       ASN   8   4.054  -0.334   9.301
  498   2HB   ASN   8          1HB       ASN   8   2.487  -0.381  10.102
  499   1HD2  ASN   8          1HD2      ASN   8   5.521  -1.049  10.639
  500   2HD2  ASN   8          2HD2      ASN   8   5.402  -2.463  11.626
  501    H    GLY   9           H        GLY   9   2.075  -4.023   7.773
  502   1HA   GLY   9          2HA       GLY   9  -0.484  -3.979   9.253
  503   2HA   GLY   9          1HA       GLY   9  -0.252  -4.869   7.756
  504    H    LYS  10           H        LYS  10  -1.093  -6.643   9.177
  505    HA   LYS  10           HA       LYS  10   0.822  -7.689  11.091
  506   1HB   LYS  10          2HB       LYS  10  -1.821  -8.811  10.137
  507   2HB   LYS  10          1HB       LYS  10  -0.847  -9.481  11.438
  508   1HG   LYS  10          2HG       LYS  10  -1.132  -7.399  12.706
  509   2HG   LYS  10          1HG       LYS  10  -2.146  -6.764  11.410
  510   1HD   LYS  10          2HD       LYS  10  -2.717  -9.231  13.052
  511   2HD   LYS  10          1HD       LYS  10  -3.493  -7.659  13.249
  512   1HE   LYS  10          2HE       LYS  10  -4.382  -7.818  10.972
  513   2HE   LYS  10          1HE       LYS  10  -3.611  -9.392  10.783
  514   1HZ   LYS  10          1HZ       LYS  10  -4.977  -9.964  12.893
  515   2HZ   LYS  10          2HZ       LYS  10  -5.735  -9.969  11.382
  516   3HZ   LYS  10          3HZ       LYS  10  -5.935  -8.651  12.423
  517    H    THR  11           H        THR  11  -0.801  -8.924   8.175
  518    HA   THR  11           HA       THR  11   1.328 -10.866   7.781
  519    HB   THR  11           HB       THR  11  -0.258 -11.543   5.853
  520    HG1  THR  11           1HG      THR  11  -2.474 -10.878   6.445
  521   1HG2  THR  11          1HG2      THR  11  -0.307 -13.076   7.557
  522   2HG2  THR  11          2HG2      THR  11  -1.971 -12.492   7.574
  523   3HG2  THR  11          3HG2      THR  11  -0.812 -11.887   8.757
  524    H    LEU  12           H        LEU  12   0.676  -7.726   6.918
  525    HA   LEU  12           HA       LEU  12   2.420  -7.962   4.582
  526   1HB   LEU  12          2HB       LEU  12   0.141  -7.760   3.751
  527   2HB   LEU  12          1HB       LEU  12  -0.100  -6.312   4.713
  528    HG   LEU  12           HG       LEU  12   1.463  -5.085   3.381
  529   1HD1  LEU  12          1HD1      LEU  12   3.207  -6.211   2.593
  530   2HD1  LEU  12          2HD1      LEU  12   2.161  -6.702   1.258
  531   3HD1  LEU  12          3HD1      LEU  12   2.350  -7.743   2.665
  532   1HD2  LEU  12          1HD2      LEU  12  -0.005  -4.723   1.743
  533   2HD2  LEU  12          2HD2      LEU  12  -0.946  -6.034   2.454
  534   3HD2  LEU  12          3HD2      LEU  12   0.158  -6.365   1.119
  535    H    LYS  13           H        LYS  13   3.954  -6.459   4.405
  536    HA   LYS  13           HA       LYS  13   3.808  -4.003   5.967
  537   1HB   LYS  13          2HB       LYS  13   6.063  -5.998   6.253
  538   2HB   LYS  13          1HB       LYS  13   6.086  -4.361   6.896
  539   1HG   LYS  13          2HG       LYS  13   4.170  -4.891   8.317
  540   2HG   LYS  13          1HG       LYS  13   4.151  -6.534   7.673
  541   1HD   LYS  13          2HD       LYS  13   6.443  -5.271   9.177
  542   2HD   LYS  13          1HD       LYS  13   5.272  -6.403   9.860
  543   1HE   LYS  13          2HE       LYS  13   7.174  -6.972   7.587
  544   2HE   LYS  13          1HE       LYS  13   7.354  -7.529   9.251
  545   1HZ   LYS  13          1HZ       LYS  13   6.313  -9.336   8.460
  546   2HZ   LYS  13          2HZ       LYS  13   5.631  -8.522   7.144
  547   3HZ   LYS  13          3HZ       LYS  13   4.906  -8.418   8.667
  548    H    GLY  14           H        GLY  14   5.063  -2.314   5.113
  549   1HA   GLY  14          2HA       GLY  14   7.072  -2.682   3.160
  550   2HA   GLY  14          1HA       GLY  14   5.539  -2.381   2.361
  551    H    GLU  15           H        GLU  15   6.999  -0.568   1.594
  552    HA   GLU  15           HA       GLU  15   6.392   1.795   3.204
  553   1HB   GLU  15          2HB       GLU  15   9.121   1.237   2.023
  554   2HB   GLU  15          1HB       GLU  15   8.639   2.721   2.833
  555   1HG   GLU  15          2HG       GLU  15   8.325   1.510   4.912
  556   2HG   GLU  15          1HG       GLU  15   8.742  -0.003   4.109
  557    H    THR  16           H        THR  16   5.825   3.557   2.015
  558    HA   THR  16           HA       THR  16   6.248   3.488  -0.875
  559    HB   THR  16           HB       THR  16   4.109   2.597  -0.889
  560    HG1  THR  16           1HG      THR  16   3.550   5.346  -0.748
  561   1HG2  THR  16          1HG2      THR  16   3.878   3.358   1.726
  562   2HG2  THR  16          2HG2      THR  16   2.608   2.633   0.748
  563   3HG2  THR  16          3HG2      THR  16   2.695   4.383   0.917
  564    H    THR  17           H        THR  17   5.521   5.635  -1.902
  565    HA   THR  17           HA       THR  17   5.776   7.887  -0.054
  566    HB   THR  17           HB       THR  17   7.521   8.920  -1.502
  567    HG1  THR  17           1HG      THR  17   7.631   6.328  -2.644
  568   1HG2  THR  17          1HG2      THR  17   8.394   7.982   0.454
  569   2HG2  THR  17          2HG2      THR  17   9.395   7.348  -0.852
  570   3HG2  THR  17          3HG2      THR  17   8.148   6.335  -0.125
  571    H    THR  18           H        THR  18   4.267   9.312  -0.480
  572    HA   THR  18           HA       THR  18   3.237   9.602  -3.241
  573    HB   THR  18           HB       THR  18   1.580   8.911  -1.499
  574    HG1  THR  18           1HG      THR  18   0.979  10.189  -3.328
  575   1HG2  THR  18          1HG2      THR  18   0.983  11.308  -0.237
  576   2HG2  THR  18          2HG2      THR  18   2.723  11.106  -0.033
  577   3HG2  THR  18          3HG2      THR  18   1.619   9.840   0.505
  578    H    GLU  19           H        GLU  19   3.025  11.707  -4.100
  579    HA   GLU  19           HA       GLU  19   4.608  13.749  -2.684
  580   1HB   GLU  19          2HB       GLU  19   5.545  13.062  -4.842
  581   2HB   GLU  19          1HB       GLU  19   4.031  13.465  -5.640
  582   1HG   GLU  19          2HG       GLU  19   4.331  15.810  -5.034
  583   2HG   GLU  19          1HG       GLU  19   5.848  15.407  -4.230
  584    H    ALA  20           H        ALA  20   3.478  15.386  -1.807
  585    HA   ALA  20           HA       ALA  20   1.223  16.491  -3.270
  586   1HB   ALA  20          1HB       ALA  20   0.774  15.819  -0.392
  587   2HB   ALA  20          2HB       ALA  20   0.465  14.625  -1.653
  588   3HB   ALA  20          3HB       ALA  20  -0.404  16.158  -1.658
  589    H    VAL  21           H        VAL  21   0.678  18.564  -2.701
  590    HA   VAL  21           HA       VAL  21   2.667  20.333  -2.048
  591    HB   VAL  21           HB       VAL  21  -0.252  20.829  -1.474
  592   1HG1  VAL  21          1HG1      VAL  21   0.477  23.164  -2.264
  593   2HG1  VAL  21          2HG1      VAL  21   2.117  22.601  -1.942
  594   3HG1  VAL  21          3HG1      VAL  21   0.929  22.650  -0.639
  595   1HG2  VAL  21          1HG2      VAL  21  -0.169  21.779  -3.860
  596   2HG2  VAL  21          2HG2      VAL  21  -0.280  20.030  -3.660
  597   3HG2  VAL  21          3HG2      VAL  21   1.269  20.777  -4.054
  598    H    ASP  22           H        ASP  22   0.699  18.511   0.141
  599    HA   ASP  22           HA       ASP  22   2.321  19.392   2.359
  600   1HB   ASP  22          2HB       ASP  22   0.504  20.188   3.771
  601   2HB   ASP  22          1HB       ASP  22   0.593  21.148   2.298
  602    H    ALA  23           H        ALA  23   1.447  18.332   4.480
  603    HA   ALA  23           HA       ALA  23   1.554  15.566   4.119
  604   1HB   ALA  23          1HB       ALA  23   1.864  17.196   6.244
  605   2HB   ALA  23          2HB       ALA  23   1.686  15.446   6.366
  606   3HB   ALA  23          3HB       ALA  23   0.288  16.494   6.609
  607    H    ALA  24           H        ALA  24  -1.221  17.681   4.689
  608    HA   ALA  24           HA       ALA  24  -3.141  15.627   4.929
  609   1HB   ALA  24          1HB       ALA  24  -3.359  18.156   5.450
  610   2HB   ALA  24          2HB       ALA  24  -4.765  17.295   4.823
  611   3HB   ALA  24          3HB       ALA  24  -3.799  18.306   3.749
  612    H    THR  25           H        THR  25  -2.289  17.669   2.112
  613    HA   THR  25           HA       THR  25  -3.885  16.460   0.220
  614    HB   THR  25           HB       THR  25  -2.143  17.181  -1.420
  615    HG1  THR  25           1HG      THR  25  -0.691  17.521   0.942
  616   1HG2  THR  25          1HG2      THR  25  -1.963  19.632  -0.307
  617   2HG2  THR  25          2HG2      THR  25  -3.343  18.963   0.565
  618   3HG2  THR  25          3HG2      THR  25  -3.364  19.037  -1.197
  619    H    ALA  26           H        ALA  26  -0.630  15.578   1.323
  620    HA   ALA  26           HA       ALA  26  -0.246  13.351  -0.338
  621   1HB   ALA  26          1HB       ALA  26   1.108  12.616   1.875
  622   2HB   ALA  26          2HB       ALA  26   0.919  14.340   2.192
  623   3HB   ALA  26          3HB       ALA  26   1.713  13.798   0.713
  624    H    GLU  27           H        GLU  27  -1.478  13.537   3.013
  625    HA   GLU  27           HA       GLU  27  -2.117  10.889   3.401
  626   1HB   GLU  27          2HB       GLU  27  -2.237  12.594   5.156
  627   2HB   GLU  27          1HB       GLU  27  -3.631  13.315   4.365
  628   1HG   GLU  27          2HG       GLU  27  -4.913  11.277   4.752
  629   2HG   GLU  27          1HG       GLU  27  -3.514  10.545   5.536
  630    H    LYS  28           H        LYS  28  -4.066  13.444   1.910
  631    HA   LYS  28           HA       LYS  28  -6.351  11.847   1.433
  632   1HB   LYS  28          2HB       LYS  28  -5.403  14.346   0.016
  633   2HB   LYS  28          1HB       LYS  28  -7.005  13.639  -0.148
  634   1HG   LYS  28          2HG       LYS  28  -5.802  14.791   2.360
  635   2HG   LYS  28          1HG       LYS  28  -7.083  15.503   1.375
  636   1HD   LYS  28          2HD       LYS  28  -8.533  13.605   1.884
  637   2HD   LYS  28          1HD       LYS  28  -7.252  12.877   2.855
  638   1HE   LYS  28          2HE       LYS  28  -8.890  14.014   4.263
  639   2HE   LYS  28          1HE       LYS  28  -7.307  14.785   4.373
  640   1HZ   LYS  28          1HZ       LYS  28  -8.075  16.473   2.810
  641   2HZ   LYS  28          2HZ       LYS  28  -9.052  16.429   4.190
  642   3HZ   LYS  28          3HZ       LYS  28  -9.599  15.743   2.744
  643    H    VAL  29           H        VAL  29  -3.638  12.820  -0.656
  644    HA   VAL  29           HA       VAL  29  -4.410  11.511  -2.979
  645    HB   VAL  29           HB       VAL  29  -1.594  11.863  -1.929
  646   1HG1  VAL  29          1HG1      VAL  29  -1.525  11.986  -4.688
  647   2HG1  VAL  29          2HG1      VAL  29  -2.641  10.660  -4.357
  648   3HG1  VAL  29          3HG1      VAL  29  -1.008  10.627  -3.689
  649   1HG2  VAL  29          1HG2      VAL  29  -2.530  13.649  -4.043
  650   2HG2  VAL  29          2HG2      VAL  29  -1.652  14.011  -2.558
  651   3HG2  VAL  29          3HG2      VAL  29  -3.405  13.833  -2.522
  652    H    VAL  30           H        VAL  30  -2.666  10.316  -0.163
  653    HA   VAL  30           HA       VAL  30  -2.127   7.719  -1.140
  654    HB   VAL  30           HB       VAL  30  -2.556   8.595   1.724
  655   1HG1  VAL  30          1HG1      VAL  30  -1.454   6.625   2.408
  656   2HG1  VAL  30          2HG1      VAL  30  -0.942   6.248   0.762
  657   3HG1  VAL  30          3HG1      VAL  30  -2.642   6.109   1.211
  658   1HG2  VAL  30          1HG2      VAL  30  -0.450   9.389   1.801
  659   2HG2  VAL  30          2HG2      VAL  30  -0.671   9.576   0.062
  660   3HG2  VAL  30          3HG2      VAL  30   0.166   8.160   0.698
  661    H    LYS  31           H        LYS  31  -4.799   9.038   0.831
  662    HA   LYS  31           HA       LYS  31  -6.252   6.729   1.240
  663   1HB   LYS  31          2HB       LYS  31  -7.144   9.573   0.836
  664   2HB   LYS  31          1HB       LYS  31  -8.292   8.283   1.175
  665   1HG   LYS  31          2HG       LYS  31  -7.123   7.792   3.261
  666   2HG   LYS  31          1HG       LYS  31  -5.983   9.097   2.927
  667   1HD   LYS  31          2HD       LYS  31  -7.794  10.721   3.000
  668   2HD   LYS  31          1HD       LYS  31  -8.965   9.426   3.262
  669   1HE   LYS  31          2HE       LYS  31  -7.856   8.858   5.372
  670   2HE   LYS  31          1HE       LYS  31  -6.696  10.160   5.110
  671   1HZ   LYS  31          1HZ       LYS  31  -8.928  10.441   6.526
  672   2HZ   LYS  31          2HZ       LYS  31  -9.497  10.922   5.007
  673   3HZ   LYS  31          3HZ       LYS  31  -8.181  11.721   5.709
  674    H    GLN  32           H        GLN  32  -6.257   8.864  -1.568
  675    HA   GLN  32           HA       GLN  32  -8.295   7.557  -3.013
  676   1HB   GLN  32          2HB       GLN  32  -7.409   9.787  -3.626
  677   2HB   GLN  32          1HB       GLN  32  -5.883   9.046  -4.083
  678   1HG   GLN  32          2HG       GLN  32  -7.161   9.499  -6.052
  679   2HG   GLN  32          1HG       GLN  32  -7.051   7.759  -5.821
  680   1HE2  GLN  32          1HE2      GLN  32  -9.212   9.130  -3.614
  681   2HE2  GLN  32          2HE2      GLN  32 -10.672   8.794  -4.466
  682    H    PHE  33           H        PHE  33  -4.847   7.044  -2.732
  683    HA   PHE  33           HA       PHE  33  -4.380   5.170  -4.720
  684   1HB   PHE  33          2HB       PHE  33  -2.710   6.297  -3.167
  685   2HB   PHE  33          1HB       PHE  33  -3.167   5.116  -1.948
  686    HD1  PHE  33           1HD      PHE  33  -2.010   5.255  -5.484
  687    HD2  PHE  33           2HD      PHE  33  -1.894   3.223  -1.738
  688    HE1  PHE  33           1HE      PHE  33  -0.345   3.682  -6.384
  689    HE2  PHE  33           2HE      PHE  33  -0.227   1.659  -2.637
  690    HZ   PHE  33           HZ       PHE  33   0.551   1.890  -4.965
  691    H    PHE  34           H        PHE  34  -5.012   4.515  -1.315
  692    HA   PHE  34           HA       PHE  34  -5.512   1.729  -1.681
  693   1HB   PHE  34          2HB       PHE  34  -6.190   3.506   0.666
  694   2HB   PHE  34          1HB       PHE  34  -6.188   1.740   0.676
  695    HD1  PHE  34           1HD      PHE  34  -3.863   0.949  -0.701
  696    HD2  PHE  34           2HD      PHE  34  -4.387   4.289   1.876
  697    HE1  PHE  34           1HE      PHE  34  -1.451   0.965  -0.244
  698    HE2  PHE  34           2HE      PHE  34  -1.973   4.307   2.349
  699    HZ   PHE  34           HZ       PHE  34  -0.509   2.643   1.271
  700    H    ASN  35           H        ASN  35  -7.575   4.552  -1.348
  701    HA   ASN  35           HA       ASN  35 -10.073   3.382  -1.162
  702   1HB   ASN  35          2HB       ASN  35  -9.679   5.808  -1.054
  703   2HB   ASN  35          1HB       ASN  35  -9.262   5.823  -2.765
  704   1HD2  ASN  35          1HD2      ASN  35 -11.509   6.798  -0.825
  705   2HD2  ASN  35          2HD2      ASN  35 -12.936   6.548  -1.767
  706    H    ASP  36           H        ASP  36  -8.011   3.889  -3.922
  707    HA   ASP  36           HA       ASP  36  -9.933   2.646  -5.737
  708   1HB   ASP  36          2HB       ASP  36  -7.289   4.007  -6.277
  709   2HB   ASP  36          1HB       ASP  36  -8.310   3.295  -7.524
  710    H    ASN  37           H        ASN  37  -6.993   1.822  -4.056
  711    HA   ASN  37           HA       ASN  37  -6.399  -0.408  -5.808
  712   1HB   ASN  37          2HB       ASN  37  -5.297   0.341  -3.087
  713   2HB   ASN  37          1HB       ASN  37  -4.754  -1.049  -4.018
  714   1HD2  ASN  37          1HD2      ASN  37  -3.540   1.604  -3.089
  715   2HD2  ASN  37          2HD2      ASN  37  -2.770   2.202  -4.516
  716    H    GLY  38           H        GLY  38  -7.686   0.113  -2.587
  717   1HA   GLY  38          2HA       GLY  38  -8.234  -1.836  -1.168
  718   2HA   GLY  38          1HA       GLY  38  -9.651  -1.078  -1.858
  719    H    VAL  39           H        VAL  39 -11.073  -2.429  -2.606
  720    HA   VAL  39           HA       VAL  39 -10.236  -5.157  -3.248
  721    HB   VAL  39           HB       VAL  39 -13.017  -4.121  -2.787
  722   1HG1  VAL  39          1HG1      VAL  39 -11.828  -6.826  -3.166
  723   2HG1  VAL  39          2HG1      VAL  39 -13.336  -6.159  -3.791
  724   3HG1  VAL  39          3HG1      VAL  39 -13.221  -6.647  -2.099
  725   1HG2  VAL  39          1HG2      VAL  39 -12.796  -5.003  -0.509
  726   2HG2  VAL  39          2HG2      VAL  39 -11.650  -3.700  -0.823
  727   3HG2  VAL  39          3HG2      VAL  39 -11.103  -5.377  -0.825
  728    H    ASP  40           H        ASP  40 -10.953  -2.435  -5.158
  729    HA   ASP  40           HA       ASP  40 -11.925  -4.235  -7.263
  730   1HB   ASP  40          2HB       ASP  40 -12.735  -1.358  -6.807
  731   2HB   ASP  40          1HB       ASP  40 -13.219  -2.346  -8.182
  732    H    GLY  41           H        GLY  41  -9.211  -2.998  -6.409
  733   1HA   GLY  41          2HA       GLY  41  -8.519  -1.266  -8.592
  734   2HA   GLY  41          1HA       GLY  41  -7.412  -1.949  -7.412
  735    H    GLU  42           H        GLU  42  -6.625  -1.733 -10.000
  736    HA   GLU  42           HA       GLU  42  -6.978  -4.356 -11.245
  737   1HB   GLU  42          2HB       GLU  42  -5.548  -1.885 -12.245
  738   2HB   GLU  42          1HB       GLU  42  -5.768  -3.370 -13.158
  739   1HG   GLU  42          2HG       GLU  42  -8.188  -3.057 -13.092
  740   2HG   GLU  42          1HG       GLU  42  -7.969  -1.569 -12.173
  741    H    TRP  43           H        TRP  43  -5.743  -5.801 -10.156
  742    HA   TRP  43           HA       TRP  43  -2.977  -5.112  -9.517
  743   1HB   TRP  43          2HB       TRP  43  -4.617  -7.528  -8.746
  744   2HB   TRP  43          1HB       TRP  43  -3.002  -7.153  -8.160
  745    HD1  TRP  43           HD       TRP  43  -5.650  -4.381  -8.343
  746    HE1  TRP  43           1HE      TRP  43  -6.254  -3.685  -5.940
  747    HE3  TRP  43           3HE      TRP  43  -3.104  -7.995  -5.787
  748    HZ2  TRP  43           2HZ      TRP  43  -5.721  -4.551  -3.311
  749    HZ3  TRP  43           3HZ      TRP  43  -3.202  -7.993  -3.336
  750    HH2  TRP  43           HH       TRP  43  -4.483  -6.307  -2.119
  751    H    THR  44           H        THR  44  -1.382  -5.710 -10.822
  752    HA   THR  44           HA       THR  44  -1.810  -7.976 -12.648
  753    HB   THR  44           HB       THR  44   0.117  -7.038 -13.920
  754    HG1  THR  44           1HG      THR  44  -0.132  -4.823 -12.175
  755   1HG2  THR  44          1HG2      THR  44  -1.082  -4.719 -14.394
  756   2HG2  THR  44          2HG2      THR  44  -2.387  -5.522 -13.522
  757   3HG2  THR  44          3HG2      THR  44  -1.718  -6.256 -14.979
  758    H    TYR  45           H        TYR  45  -0.449  -9.741 -12.573
  759    HA   TYR  45           HA       TYR  45   1.485  -9.739 -10.354
  760   1HB   TYR  45          2HB       TYR  45  -0.387 -11.289 -10.054
  761   2HB   TYR  45          1HB       TYR  45  -0.003 -12.063 -11.587
  762    HD1  TYR  45           1HD      TYR  45   2.329 -10.968  -8.902
  763    HD2  TYR  45           2HD      TYR  45   0.569 -14.244 -10.968
  764    HE1  TYR  45           1HE      TYR  45   3.844 -12.512  -7.733
  765    HE2  TYR  45           2HE      TYR  45   2.078 -15.798  -9.804
  766    HH   TYR  45           HH       TYR  45   4.154 -15.823  -8.640
  767    H    ASP  46           H        ASP  46   3.530 -10.485 -10.615
  768    HA   ASP  46           HA       ASP  46   4.353 -11.243 -13.340
  769   1HB   ASP  46          2HB       ASP  46   5.093  -8.954 -12.823
  770   2HB   ASP  46          1HB       ASP  46   5.895  -9.538 -11.369
  771    H    ASP  47           H        ASP  47   4.112 -13.446 -12.654
  772    HA   ASP  47           HA       ASP  47   5.175 -14.694 -10.468
  773   1HB   ASP  47          2HB       ASP  47   5.096 -15.764 -13.295
  774   2HB   ASP  47          1HB       ASP  47   5.296 -16.741 -11.844
  775    H    ALA  48           H        ALA  48   6.889 -13.719 -13.391
  776    HA   ALA  48           HA       ALA  48   9.250 -15.082 -13.152
  777   1HB   ALA  48          1HB       ALA  48   9.259 -13.852 -15.050
  778   2HB   ALA  48          2HB       ALA  48  10.214 -12.760 -14.048
  779   3HB   ALA  48          3HB       ALA  48   8.492 -12.460 -14.285
  780    H    THR  49           H        THR  49   8.162 -12.382 -11.202
  781    HA   THR  49           HA       THR  49  10.624 -12.650  -9.606
  782    HB   THR  49           HB       THR  49  10.496 -10.229  -9.110
  783    HG1  THR  49           1HG      THR  49   8.193 -10.112  -9.678
  784   1HG2  THR  49          1HG2      THR  49  10.687 -10.940 -12.022
  785   2HG2  THR  49          2HG2      THR  49  12.003 -10.788 -10.858
  786   3HG2  THR  49          3HG2      THR  49  11.102  -9.358 -11.363
  787    H    LYS  50           H        LYS  50   7.639 -13.547  -9.488
  788    HA   LYS  50           HA       LYS  50   5.994 -13.803  -7.899
  789   1HB   LYS  50          2HB       LYS  50   8.475 -13.642  -6.180
  790   2HB   LYS  50          1HB       LYS  50   6.894 -14.078  -5.550
  791   1HG   LYS  50          2HG       LYS  50   8.333 -15.580  -7.725
  792   2HG   LYS  50          1HG       LYS  50   8.357 -16.015  -6.015
  793   1HD   LYS  50          2HD       LYS  50   5.855 -16.150  -6.109
  794   2HD   LYS  50          1HD       LYS  50   5.973 -15.942  -7.858
  795   1HE   LYS  50          2HE       LYS  50   7.205 -18.171  -6.241
  796   2HE   LYS  50          1HE       LYS  50   5.774 -18.300  -7.263
  797   1HZ   LYS  50          1HZ       LYS  50   7.139 -17.762  -9.183
  798   2HZ   LYS  50          2HZ       LYS  50   7.743 -19.127  -8.389
  799   3HZ   LYS  50          3HZ       LYS  50   8.512 -17.633  -8.202
  800    H    THR  51           H        THR  51   6.439 -11.106  -8.785
  801    HA   THR  51           HA       THR  51   5.697  -9.634  -6.348
  802    HB   THR  51           HB       THR  51   7.221  -8.641  -8.760
  803    HG1  THR  51           1HG      THR  51   8.452  -9.839  -7.254
  804   1HG2  THR  51          1HG2      THR  51   6.653  -6.575  -8.240
  805   2HG2  THR  51          2HG2      THR  51   7.385  -6.798  -6.651
  806   3HG2  THR  51          3HG2      THR  51   5.673  -7.147  -6.890
  807    H    PHE  52           H        PHE  52   4.016  -8.227  -6.417
  808    HA   PHE  52           HA       PHE  52   2.310  -8.333  -8.817
  809   1HB   PHE  52          2HB       PHE  52   1.501  -7.677  -5.973
  810   2HB   PHE  52          1HB       PHE  52   0.423  -7.899  -7.344
  811    HD1  PHE  52           1HD      PHE  52  -0.708  -9.883  -7.427
  812    HD2  PHE  52           2HD      PHE  52   3.141  -9.796  -5.612
  813    HE1  PHE  52           1HE      PHE  52  -0.924 -12.269  -6.857
  814    HE2  PHE  52           2HE      PHE  52   2.933 -12.180  -5.046
  815    HZ   PHE  52           HZ       PHE  52   0.899 -13.419  -5.670
  816    H    THR  53           H        THR  53   1.525  -6.396  -9.693
  817    HA   THR  53           HA       THR  53   2.603  -3.952  -8.462
  818    HB   THR  53           HB       THR  53   2.521  -3.077 -10.916
  819    HG1  THR  53           1HG      THR  53   2.719  -5.873 -11.303
  820   1HG2  THR  53          1HG2      THR  53   4.599  -4.618  -9.535
  821   2HG2  THR  53          2HG2      THR  53   4.658  -3.012 -10.267
  822   3HG2  THR  53          3HG2      THR  53   4.801  -4.451 -11.279
  823    H    VAL  54           H        VAL  54   0.941  -3.101  -7.474
  824    HA   VAL  54           HA       VAL  54  -1.713  -3.040  -8.640
  825    HB   VAL  54           HB       VAL  54  -0.687  -1.683  -6.131
  826   1HG1  VAL  54          1HG1      VAL  54  -2.746  -0.696  -7.141
  827   2HG1  VAL  54          2HG1      VAL  54  -2.977  -1.357  -5.522
  828   3HG1  VAL  54          3HG1      VAL  54  -3.535  -2.259  -6.932
  829   1HG2  VAL  54          1HG2      VAL  54  -1.113  -3.555  -4.942
  830   2HG2  VAL  54          2HG2      VAL  54  -0.824  -4.345  -6.492
  831   3HG2  VAL  54          3HG2      VAL  54  -2.474  -4.023  -5.960
  832    H    THR  55           H        THR  55  -2.053  -1.678 -10.278
  833    HA   THR  55           HA       THR  55  -0.675   0.912 -10.251
  834    HB   THR  55           HB       THR  55  -2.101  -0.392 -12.566
  835    HG1  THR  55           1HG      THR  55  -0.336  -1.651 -11.965
  836   1HG2  THR  55          1HG2      THR  55  -0.626   1.091 -13.906
  837   2HG2  THR  55          2HG2      THR  55  -0.170   1.908 -12.411
  838   3HG2  THR  55          3HG2      THR  55  -1.846   1.946 -12.962
  839    H    GLU  56           H        GLU  56  -1.744   2.623  -9.583
  840    HA   GLU  56           HA       GLU  56  -4.448   2.727  -8.978
  841   1HB   GLU  56          2HB       GLU  56  -2.848   4.325  -8.083
  842   2HB   GLU  56          1HB       GLU  56  -2.563   4.981  -9.689
  843   1HG   GLU  56          2HG       GLU  56  -4.000   6.436  -8.381
  844   2HG   GLU  56          1HG       GLU  56  -4.849   5.794  -9.786
  Start of MODEL    2
    1   1H    MET   1          1HT       MET   1   5.610 -18.778   2.890
    2   2H    MET   1          2HT       MET   1   5.295 -19.697   1.505
    3   3H    MET   1          3HT       MET   1   4.528 -18.206   1.722
    4    HA   MET   1           HA       MET   1   7.456 -18.330   1.649
    5   1HB   MET   1          2HB       MET   1   6.622 -19.614  -0.291
    6   2HB   MET   1          1HB       MET   1   5.638 -18.240  -0.769
    7   1HG   MET   1          2HG       MET   1   7.492 -16.972  -1.390
    8   2HG   MET   1          1HG       MET   1   8.608 -17.993  -0.485
    9   1HE   MET   1          1HE       MET   1   6.034 -17.859  -3.244
   10   2HE   MET   1          2HE       MET   1   5.795 -19.594  -3.041
   11   3HE   MET   1          3HE       MET   1   6.602 -18.978  -4.483
   12    H    GLN   2           H        GLN   2   8.269 -16.295   0.643
   13    HA   GLN   2           HA       GLN   2   6.678 -14.043   1.604
   14   1HB   GLN   2          2HB       GLN   2   9.003 -14.314   2.422
   15   2HB   GLN   2          1HB       GLN   2   9.584 -14.163   0.771
   16   1HG   GLN   2          2HG       GLN   2   9.905 -12.075   1.831
   17   2HG   GLN   2          1HG       GLN   2   8.576 -11.890   0.694
   18   1HE2  GLN   2          1HE2      GLN   2   7.461 -13.636   3.312
   19   2HE2  GLN   2          2HE2      GLN   2   6.788 -12.338   4.222
   20    H    TYR   3           H        TYR   3   5.809 -12.561   0.289
   21    HA   TYR   3           HA       TYR   3   6.619 -12.566  -2.544
   22   1HB   TYR   3          2HB       TYR   3   3.833 -12.253  -1.408
   23   2HB   TYR   3          1HB       TYR   3   4.253 -11.982  -3.096
   24    HD1  TYR   3           1HD      TYR   3   4.262 -13.759  -4.614
   25    HD2  TYR   3           2HD      TYR   3   4.264 -14.586  -0.440
   26    HE1  TYR   3           1HE      TYR   3   3.906 -16.144  -5.092
   27    HE2  TYR   3           2HE      TYR   3   3.913 -16.975  -0.906
   28    HH   TYR   3           HH       TYR   3   4.126 -18.274  -4.115
   29    H    LYS   4           H        LYS   4   6.874 -10.596  -3.528
   30    HA   LYS   4           HA       LYS   4   6.724  -8.270  -1.734
   31   1HB   LYS   4          2HB       LYS   4   8.956  -8.758  -2.596
   32   2HB   LYS   4          1HB       LYS   4   8.354  -8.688  -4.246
   33   1HG   LYS   4          2HG       LYS   4   7.825  -6.324  -3.962
   34   2HG   LYS   4          1HG       LYS   4   8.413  -6.391  -2.298
   35   1HD   LYS   4          2HD       LYS   4  10.058  -6.938  -4.769
   36   2HD   LYS   4          1HD       LYS   4  10.091  -5.450  -3.822
   37   1HE   LYS   4          2HE       LYS   4  10.846  -6.730  -1.866
   38   2HE   LYS   4          1HE       LYS   4  10.838  -8.201  -2.837
   39   1HZ   LYS   4          1HZ       LYS   4  12.408  -6.821  -4.354
   40   2HZ   LYS   4          2HZ       LYS   4  13.021  -7.568  -2.967
   41   3HZ   LYS   4          3HZ       LYS   4  12.676  -5.913  -2.951
   42    H    VAL   5           H        VAL   5   4.958  -7.079  -2.012
   43    HA   VAL   5           HA       VAL   5   3.731  -6.945  -4.662
   44    HB   VAL   5           HB       VAL   5   2.648  -5.978  -2.010
   45   1HG1  VAL   5          1HG1      VAL   5   1.763  -5.622  -4.764
   46   2HG1  VAL   5          2HG1      VAL   5   1.263  -4.783  -3.297
   47   3HG1  VAL   5          3HG1      VAL   5   0.526  -6.328  -3.723
   48   1HG2  VAL   5          1HG2      VAL   5   2.382  -8.184  -1.666
   49   2HG2  VAL   5          2HG2      VAL   5   2.589  -8.580  -3.372
   50   3HG2  VAL   5          3HG2      VAL   5   1.027  -8.008  -2.782
   51    H    ILE   6           H        ILE   6   3.622  -5.131  -5.830
   52    HA   ILE   6           HA       ILE   6   5.005  -2.757  -4.779
   53    HB   ILE   6           HB       ILE   6   4.668  -3.717  -7.623
   54   1HG1  ILE   6          2HG1      ILE   6   7.131  -3.366  -5.900
   55   2HG1  ILE   6          1HG1      ILE   6   6.374  -4.903  -6.301
   56   1HG2  ILE   6          1HG2      ILE   6   4.726  -1.530  -8.123
   57   2HG2  ILE   6          2HG2      ILE   6   6.450  -1.687  -7.787
   58   3HG2  ILE   6          3HG2      ILE   6   5.360  -1.076  -6.540
   59   1HD1  ILE   6          1HD1      ILE   6   8.026  -3.102  -7.980
   60   2HD1  ILE   6          2HD1      ILE   6   6.774  -4.068  -8.763
   61   3HD1  ILE   6          3HD1      ILE   6   8.049  -4.860  -7.838
   62    H    LEU   7           H        LEU   7   3.847  -0.976  -4.465
   63    HA   LEU   7           HA       LEU   7   1.142  -0.857  -5.596
   64   1HB   LEU   7          2HB       LEU   7   2.178   0.918  -3.404
   65   2HB   LEU   7          1HB       LEU   7   0.521   0.460  -3.756
   66    HG   LEU   7           HG       LEU   7   2.651  -1.281  -2.538
   67   1HD1  LEU   7          1HD1      LEU   7   1.632   0.352  -1.028
   68   2HD1  LEU   7          2HD1      LEU   7   1.191  -1.302  -0.604
   69   3HD1  LEU   7          3HD1      LEU   7   0.034  -0.268  -1.444
   70   1HD2  LEU   7          1HD2      LEU   7  -0.177  -1.993  -3.304
   71   2HD2  LEU   7          2HD2      LEU   7   0.954  -3.026  -2.430
   72   3HD2  LEU   7          3HD2      LEU   7   1.287  -2.570  -4.100
   73    H    ASN   8           H        ASN   8   1.614  -0.048  -7.614
   74    HA   ASN   8           HA       ASN   8   3.054   2.493  -7.798
   75   1HB   ASN   8          2HB       ASN   8   2.214   0.485  -9.881
   76   2HB   ASN   8          1HB       ASN   8   2.868   2.062 -10.298
   77   1HD2  ASN   8          1HD2      ASN   8   4.392   1.299  -7.518
   78   2HD2  ASN   8          2HD2      ASN   8   5.787   0.514  -8.155
   79    H    GLY   9           H        GLY   9   1.788   4.225  -7.452
   80   1HA   GLY   9          2HA       GLY   9  -0.845   4.255  -8.784
   81   2HA   GLY   9          1HA       GLY   9  -0.468   5.159  -7.325
   82    H    LYS  10           H        LYS  10  -1.459   6.860  -8.794
   83    HA   LYS  10           HA       LYS  10   0.181   7.856 -10.924
   84   1HB   LYS  10          2HB       LYS  10  -2.153   9.113  -9.472
   85   2HB   LYS  10          1HB       LYS  10  -1.397   9.772 -10.916
   86   1HG   LYS  10          2HG       LYS  10  -2.050   7.794 -12.177
   87   2HG   LYS  10          1HG       LYS  10  -2.784   7.106 -10.726
   88   1HD   LYS  10          2HD       LYS  10  -4.346   8.992 -10.627
   89   2HD   LYS  10          1HD       LYS  10  -3.613   9.672 -12.081
   90   1HE   LYS  10          2HE       LYS  10  -5.009   7.005 -11.889
   91   2HE   LYS  10          1HE       LYS  10  -5.685   8.474 -12.592
   92   1HZ   LYS  10          1HZ       LYS  10  -4.881   7.584 -14.476
   93   2HZ   LYS  10          2HZ       LYS  10  -3.735   6.622 -13.685
   94   3HZ   LYS  10          3HZ       LYS  10  -3.415   8.260 -13.965
   95    H    THR  11           H        THR  11  -0.711   9.142  -7.720
   96    HA   THR  11           HA       THR  11   1.672  10.847  -7.784
   97    HB   THR  11           HB       THR  11   0.416  11.950  -5.817
   98    HG1  THR  11           1HG      THR  11  -1.153  10.005  -6.008
   99   1HG2  THR  11          1HG2      THR  11   0.249  13.428  -7.480
  100   2HG2  THR  11          2HG2      THR  11  -1.395  12.806  -7.640
  101   3HG2  THR  11          3HG2      THR  11  -0.111  12.186  -8.679
  102    H    LEU  12           H        LEU  12   0.953   7.885  -6.763
  103    HA   LEU  12           HA       LEU  12   2.696   8.127  -4.424
  104   1HB   LEU  12          2HB       LEU  12   0.431   8.051  -3.566
  105   2HB   LEU  12          1HB       LEU  12   0.087   6.620  -4.515
  106    HG   LEU  12           HG       LEU  12   1.566   5.296  -3.170
  107   1HD1  LEU  12          1HD1      LEU  12   3.374   6.316  -2.373
  108   2HD1  LEU  12          2HD1      LEU  12   2.350   6.870  -1.048
  109   3HD1  LEU  12          3HD1      LEU  12   2.610   7.899  -2.452
  110   1HD2  LEU  12          1HD2      LEU  12  -0.787   6.392  -2.280
  111   2HD2  LEU  12          2HD2      LEU  12   0.317   6.684  -0.937
  112   3HD2  LEU  12          3HD2      LEU  12   0.071   5.043  -1.533
  113    H    LYS  13           H        LYS  13   4.159   6.530  -4.183
  114    HA   LYS  13           HA       LYS  13   3.904   4.075  -5.745
  115   1HB   LYS  13          2HB       LYS  13   6.302   5.910  -5.952
  116   2HB   LYS  13          1HB       LYS  13   6.176   4.308  -6.663
  117   1HG   LYS  13          2HG       LYS  13   4.421   5.033  -8.132
  118   2HG   LYS  13          1HG       LYS  13   4.363   6.609  -7.342
  119   1HD   LYS  13          2HD       LYS  13   5.569   6.787  -9.431
  120   2HD   LYS  13          1HD       LYS  13   6.677   7.037  -8.083
  121   1HE   LYS  13          2HE       LYS  13   6.329   4.384  -9.464
  122   2HE   LYS  13          1HE       LYS  13   7.522   5.580  -9.965
  123   1HZ   LYS  13          1HZ       LYS  13   7.900   5.312  -7.267
  124   2HZ   LYS  13          2HZ       LYS  13   8.863   4.646  -8.484
  125   3HZ   LYS  13          3HZ       LYS  13   7.619   3.729  -7.799
  126    H    GLY  14           H        GLY  14   5.035   2.320  -4.866
  127   1HA   GLY  14          2HA       GLY  14   7.021   2.597  -2.862
  128   2HA   GLY  14          1HA       GLY  14   5.456   2.328  -2.116
  129    H    GLU  15           H        GLU  15   6.985   0.478  -1.391
  130    HA   GLU  15           HA       GLU  15   6.293  -1.844  -3.035
  131   1HB   GLU  15          2HB       GLU  15   9.015  -1.451  -1.773
  132   2HB   GLU  15          1HB       GLU  15   8.485  -2.858  -2.682
  133   1HG   GLU  15          2HG       GLU  15   9.650  -1.795  -4.305
  134   2HG   GLU  15          1HG       GLU  15   8.075  -1.046  -4.560
  135    H    THR  16           H        THR  16   5.678  -3.614  -1.893
  136    HA   THR  16           HA       THR  16   6.029  -3.596   1.009
  137    HB   THR  16           HB       THR  16   3.889  -2.716   0.979
  138    HG1  THR  16           1HG      THR  16   3.345  -5.465   0.770
  139   1HG2  THR  16          1HG2      THR  16   3.288  -2.602  -1.270
  140   2HG2  THR  16          2HG2      THR  16   2.074  -3.647  -0.533
  141   3HG2  THR  16          3HG2      THR  16   3.386  -4.349  -1.476
  142    H    THR  17           H        THR  17   5.349  -5.739   1.990
  143    HA   THR  17           HA       THR  17   5.605  -7.977   0.130
  144    HB   THR  17           HB       THR  17   7.369  -9.000   1.554
  145    HG1  THR  17           1HG      THR  17   7.586  -6.416   2.688
  146   1HG2  THR  17          1HG2      THR  17   7.987  -6.383   0.229
  147   2HG2  THR  17          2HG2      THR  17   8.198  -8.012  -0.411
  148   3HG2  THR  17          3HG2      THR  17   9.232  -7.439   0.896
  149    H    THR  18           H        THR  18   4.160  -9.475   0.583
  150    HA   THR  18           HA       THR  18   3.073  -9.671   3.322
  151    HB   THR  18           HB       THR  18   1.445  -9.149   1.525
  152    HG1  THR  18           1HG      THR  18   0.865 -10.434   3.374
  153   1HG2  THR  18          1HG2      THR  18   0.778 -11.019   0.005
  154   2HG2  THR  18          2HG2      THR  18   2.308 -11.798   0.407
  155   3HG2  THR  18          3HG2      THR  18   2.304 -10.229  -0.396
  156    H    GLU  19           H        GLU  19   3.074 -11.607   4.385
  157    HA   GLU  19           HA       GLU  19   4.734 -13.744   3.224
  158   1HB   GLU  19          2HB       GLU  19   5.377 -12.811   5.441
  159   2HB   GLU  19          1HB       GLU  19   3.822 -13.314   6.084
  160   1HG   GLU  19          2HG       GLU  19   5.439 -14.912   6.757
  161   2HG   GLU  19          1HG       GLU  19   4.429 -15.663   5.522
  162    H    ALA  20           H        ALA  20   3.503 -15.242   2.151
  163    HA   ALA  20           HA       ALA  20   1.235 -16.378   3.598
  164   1HB   ALA  20          1HB       ALA  20   0.659 -14.511   1.813
  165   2HB   ALA  20          2HB       ALA  20  -0.354 -15.937   2.031
  166   3HB   ALA  20          3HB       ALA  20   0.808 -15.875   0.705
  167    H    VAL  21           H        VAL  21   0.723 -18.471   3.059
  168    HA   VAL  21           HA       VAL  21   2.748 -20.225   2.465
  169    HB   VAL  21           HB       VAL  21  -0.162 -20.759   1.873
  170   1HG1  VAL  21          1HG1      VAL  21   1.976 -22.672   2.784
  171   2HG1  VAL  21          2HG1      VAL  21   1.535 -22.431   1.094
  172   3HG1  VAL  21          3HG1      VAL  21   0.345 -23.056   2.235
  173   1HG2  VAL  21          1HG2      VAL  21  -0.069 -21.693   4.270
  174   2HG2  VAL  21          2HG2      VAL  21  -0.212 -19.948   4.054
  175   3HG2  VAL  21          3HG2      VAL  21   1.350 -20.663   4.458
  176    H    ASP  22           H        ASP  22   0.755 -18.478   0.220
  177    HA   ASP  22           HA       ASP  22   2.444 -19.313  -1.956
  178   1HB   ASP  22          2HB       ASP  22   0.690 -20.221  -3.391
  179   2HB   ASP  22          1HB       ASP  22   0.842 -21.172  -1.917
  180    H    ALA  23           H        ALA  23   1.501 -18.359  -4.115
  181    HA   ALA  23           HA       ALA  23   1.501 -15.590  -3.845
  182   1HB   ALA  23          1HB       ALA  23   1.056 -17.494  -6.045
  183   2HB   ALA  23          2HB       ALA  23   2.110 -16.083  -5.957
  184   3HB   ALA  23          3HB       ALA  23   0.389 -15.879  -6.284
  185    H    ALA  24           H        ALA  24  -1.225 -17.805  -4.261
  186    HA   ALA  24           HA       ALA  24  -3.215 -15.830  -4.526
  187   1HB   ALA  24          1HB       ALA  24  -4.588 -17.851  -3.378
  188   2HB   ALA  24          2HB       ALA  24  -3.158 -18.723  -3.931
  189   3HB   ALA  24          3HB       ALA  24  -4.140 -17.819  -5.084
  190    H    THR  25           H        THR  25  -2.216 -17.694  -1.640
  191    HA   THR  25           HA       THR  25  -3.809 -16.415   0.224
  192    HB   THR  25           HB       THR  25  -2.010 -17.031   1.865
  193    HG1  THR  25           1HG      THR  25  -0.621 -17.453  -0.503
  194   1HG2  THR  25          1HG2      THR  25  -3.228 -18.954   0.003
  195   2HG2  THR  25          2HG2      THR  25  -3.326 -18.851   1.761
  196   3HG2  THR  25          3HG2      THR  25  -1.898 -19.546   0.996
  197    H    ALA  26           H        ALA  26  -0.577 -15.536  -0.973
  198    HA   ALA  26           HA       ALA  26  -0.229 -13.232   0.600
  199   1HB   ALA  26          1HB       ALA  26   0.977 -14.342  -1.850
  200   2HB   ALA  26          2HB       ALA  26   1.746 -13.644  -0.425
  201   3HB   ALA  26          3HB       ALA  26   1.094 -12.592  -1.681
  202    H    GLU  27           H        GLU  27  -1.369 -13.582  -2.763
  203    HA   GLU  27           HA       GLU  27  -2.109 -11.021  -3.333
  204   1HB   GLU  27          2HB       GLU  27  -2.187 -12.884  -4.923
  205   2HB   GLU  27          1HB       GLU  27  -3.556 -13.570  -4.061
  206   1HG   GLU  27          2HG       GLU  27  -4.891 -11.608  -4.624
  207   2HG   GLU  27          1HG       GLU  27  -3.519 -10.931  -5.499
  208    H    LYS  28           H        LYS  28  -4.088 -13.507  -1.735
  209    HA   LYS  28           HA       LYS  28  -6.383 -11.940  -1.354
  210   1HB   LYS  28          2HB       LYS  28  -5.324 -14.265   0.261
  211   2HB   LYS  28          1HB       LYS  28  -6.931 -13.576   0.455
  212   1HG   LYS  28          2HG       LYS  28  -5.840 -14.910  -2.013
  213   2HG   LYS  28          1HG       LYS  28  -7.043 -15.564  -0.901
  214   1HD   LYS  28          2HD       LYS  28  -8.551 -13.710  -1.466
  215   2HD   LYS  28          1HD       LYS  28  -7.350 -13.092  -2.602
  216   1HE   LYS  28          2HE       LYS  28  -9.080 -14.368  -3.758
  217   2HE   LYS  28          1HE       LYS  28  -7.507 -15.152  -3.901
  218   1HZ   LYS  28          1HZ       LYS  28  -9.811 -16.337  -3.077
  219   2HZ   LYS  28          2HZ       LYS  28  -8.994 -16.055  -1.623
  220   3HZ   LYS  28          3HZ       LYS  28  -8.252 -16.951  -2.849
  221    H    VAL  29           H        VAL  29  -3.551 -12.469   0.692
  222    HA   VAL  29           HA       VAL  29  -4.367 -11.092   2.959
  223    HB   VAL  29           HB       VAL  29  -1.595 -11.294   1.765
  224   1HG1  VAL  29          1HG1      VAL  29  -2.542 -10.233   4.404
  225   2HG1  VAL  29          2HG1      VAL  29  -1.418  -9.508   3.254
  226   3HG1  VAL  29          3HG1      VAL  29  -0.922 -10.906   4.210
  227   1HG2  VAL  29          1HG2      VAL  29  -3.183 -13.291   2.765
  228   2HG2  VAL  29          2HG2      VAL  29  -2.222 -12.828   4.170
  229   3HG2  VAL  29          3HG2      VAL  29  -1.421 -13.329   2.681
  230    H    VAL  30           H        VAL  30  -2.935  -9.889  -0.024
  231    HA   VAL  30           HA       VAL  30  -2.590  -7.217   0.802
  232    HB   VAL  30           HB       VAL  30  -3.201  -8.168  -1.996
  233   1HG1  VAL  30          1HG1      VAL  30  -3.263  -5.687  -1.433
  234   2HG1  VAL  30          2HG1      VAL  30  -2.207  -6.178  -2.758
  235   3HG1  VAL  30          3HG1      VAL  30  -1.524  -5.818  -1.172
  236   1HG2  VAL  30          1HG2      VAL  30  -1.122  -8.984  -2.234
  237   2HG2  VAL  30          2HG2      VAL  30  -1.146  -9.099  -0.474
  238   3HG2  VAL  30          3HG2      VAL  30  -0.402  -7.704  -1.257
  239    H    LYS  31           H        LYS  31  -5.300  -8.869  -0.871
  240    HA   LYS  31           HA       LYS  31  -6.995  -6.732  -1.234
  241   1HB   LYS  31          2HB       LYS  31  -7.534  -9.612  -0.669
  242   2HB   LYS  31          1HB       LYS  31  -8.870  -8.475  -0.695
  243   1HG   LYS  31          2HG       LYS  31  -8.614  -9.601  -2.826
  244   2HG   LYS  31          1HG       LYS  31  -8.345  -7.869  -2.979
  245   1HD   LYS  31          2HD       LYS  31  -5.899  -8.303  -2.930
  246   2HD   LYS  31          1HD       LYS  31  -6.252 -10.035  -2.926
  247   1HE   LYS  31          2HE       LYS  31  -7.538  -9.721  -5.028
  248   2HE   LYS  31          1HE       LYS  31  -7.022  -8.037  -5.051
  249   1HZ   LYS  31          1HZ       LYS  31  -5.263  -8.726  -6.174
  250   2HZ   LYS  31          2HZ       LYS  31  -5.637 -10.351  -5.920
  251   3HZ   LYS  31          3HZ       LYS  31  -4.716  -9.508  -4.777
  252    H    GLN  32           H        GLN  32  -6.743  -8.757   1.679
  253    HA   GLN  32           HA       GLN  32  -8.662  -7.301   3.162
  254   1HB   GLN  32          2HB       GLN  32  -7.861  -9.578   3.773
  255   2HB   GLN  32          1HB       GLN  32  -6.302  -8.890   4.198
  256   1HG   GLN  32          2HG       GLN  32  -7.556  -9.253   6.195
  257   2HG   GLN  32          1HG       GLN  32  -7.409  -7.521   5.922
  258   1HE2  GLN  32          1HE2      GLN  32  -9.633  -8.849   3.768
  259   2HE2  GLN  32          2HE2      GLN  32 -11.072  -8.477   4.639
  260    H    PHE  33           H        PHE  33  -5.196  -7.028   2.766
  261    HA   PHE  33           HA       PHE  33  -4.567  -5.145   4.689
  262   1HB   PHE  33          2HB       PHE  33  -2.985  -6.406   3.185
  263   2HB   PHE  33          1HB       PHE  33  -3.402  -5.279   1.899
  264    HD1  PHE  33           1HD      PHE  33  -1.879  -5.566   5.237
  265    HD2  PHE  33           2HD      PHE  33  -2.352  -3.159   1.748
  266    HE1  PHE  33           1HE      PHE  33  -0.116  -4.050   6.036
  267    HE2  PHE  33           2HE      PHE  33  -0.590  -1.645   2.557
  268    HZ   PHE  33           HZ       PHE  33   0.524  -2.099   4.708
  269    H    PHE  34           H        PHE  34  -5.362  -4.534   1.294
  270    HA   PHE  34           HA       PHE  34  -5.618  -1.701   1.705
  271   1HB   PHE  34          2HB       PHE  34  -6.285  -3.409  -0.690
  272   2HB   PHE  34          1HB       PHE  34  -6.341  -1.644  -0.668
  273    HD1  PHE  34           1HD      PHE  34  -4.023  -0.922   0.878
  274    HD2  PHE  34           2HD      PHE  34  -4.472  -3.988  -2.035
  275    HE1  PHE  34           1HE      PHE  34  -1.610  -0.841   0.434
  276    HE2  PHE  34           2HE      PHE  34  -2.055  -3.908  -2.491
  277    HZ   PHE  34           HZ       PHE  34  -0.628  -2.337  -1.241
  278    H    ASN  35           H        ASN  35  -7.876  -4.381   1.354
  279    HA   ASN  35           HA       ASN  35 -10.275  -3.029   1.109
  280   1HB   ASN  35          2HB       ASN  35 -10.170  -5.454   1.064
  281   2HB   ASN  35          1HB       ASN  35  -9.632  -5.501   2.739
  282   1HD2  ASN  35          1HD2      ASN  35 -12.151  -6.131   0.897
  283   2HD2  ASN  35          2HD2      ASN  35 -13.452  -5.787   1.976
  284    H    ASP  36           H        ASP  36  -8.288  -3.586   3.928
  285    HA   ASP  36           HA       ASP  36 -10.153  -2.165   5.665
  286   1HB   ASP  36          2HB       ASP  36  -7.580  -3.609   6.329
  287   2HB   ASP  36          1HB       ASP  36  -8.668  -2.881   7.507
  288    H    ASN  37           H        ASN  37  -7.109  -1.579   4.047
  289    HA   ASN  37           HA       ASN  37  -6.428   0.654   5.753
  290   1HB   ASN  37          2HB       ASN  37  -5.321  -0.220   3.073
  291   2HB   ASN  37          1HB       ASN  37  -4.720   1.164   3.976
  292   1HD2  ASN  37          1HD2      ASN  37  -3.541  -1.472   3.136
  293   2HD2  ASN  37          2HD2      ASN  37  -2.865  -2.117   4.590
  294    H    GLY  38           H        GLY  38  -7.708   0.143   2.528
  295   1HA   GLY  38          2HA       GLY  38  -8.164   2.058   1.051
  296   2HA   GLY  38          1HA       GLY  38  -9.618   1.456   1.810
  297    H    VAL  39           H        VAL  39 -10.898   2.963   2.474
  298    HA   VAL  39           HA       VAL  39  -9.995   5.662   2.722
  299    HB   VAL  39           HB       VAL  39 -12.736   4.479   3.037
  300   1HG1  VAL  39          1HG1      VAL  39 -13.079   6.453   4.126
  301   2HG1  VAL  39          2HG1      VAL  39 -13.253   7.025   2.466
  302   3HG1  VAL  39          3HG1      VAL  39 -11.729   7.257   3.324
  303   1HG2  VAL  39          1HG2      VAL  39 -11.968   4.196   0.812
  304   2HG2  VAL  39          2HG2      VAL  39 -11.319   5.834   0.758
  305   3HG2  VAL  39          3HG2      VAL  39 -13.064   5.579   0.803
  306    H    ASP  40           H        ASP  40 -11.753   3.579   5.081
  307    HA   ASP  40           HA       ASP  40 -11.133   5.566   7.111
  308   1HB   ASP  40          2HB       ASP  40 -12.884   3.110   7.221
  309   2HB   ASP  40          1HB       ASP  40 -12.695   4.275   8.528
  310    H    GLY  41           H        GLY  41  -8.980   3.771   6.109
  311   1HA   GLY  41          2HA       GLY  41  -8.451   1.789   8.064
  312   2HA   GLY  41          1HA       GLY  41  -7.267   2.499   6.979
  313    H    GLU  42           H        GLU  42  -7.161   1.795   9.883
  314    HA   GLU  42           HA       GLU  42  -7.024   4.270  11.333
  315   1HB   GLU  42          2HB       GLU  42  -5.917   1.538  12.018
  316   2HB   GLU  42          1HB       GLU  42  -6.012   2.901  13.126
  317   1HG   GLU  42          2HG       GLU  42  -8.350   1.507  11.840
  318   2HG   GLU  42          1HG       GLU  42  -7.810   1.309  13.508
  319    H    TRP  43           H        TRP  43  -5.591   5.676  10.372
  320    HA   TRP  43           HA       TRP  43  -2.825   4.733  10.009
  321   1HB   TRP  43          2HB       TRP  43  -4.048   7.268   8.926
  322   2HB   TRP  43          1HB       TRP  43  -2.494   6.573   8.499
  323    HD1  TRP  43           HD       TRP  43  -5.014   3.859   8.530
  324    HE1  TRP  43           1HE      TRP  43  -5.808   3.354   6.148
  325    HE3  TRP  43           3HE      TRP  43  -3.073   7.938   6.178
  326    HZ2  TRP  43           2HZ      TRP  43  -5.632   4.542   3.580
  327    HZ3  TRP  43           3HZ      TRP  43  -3.417   8.190   3.766
  328    HH2  TRP  43           HH       TRP  43  -4.675   6.524   2.487
  329    H    THR  44           H        THR  44  -1.210   5.533  11.206
  330    HA   THR  44           HA       THR  44  -1.797   7.808  12.979
  331    HB   THR  44           HB       THR  44   0.118   6.987  14.341
  332    HG1  THR  44           1HG      THR  44   1.071   5.834  12.491
  333   1HG2  THR  44          1HG2      THR  44  -1.771   4.700  13.922
  334   2HG2  THR  44          2HG2      THR  44  -2.248   6.186  14.746
  335   3HG2  THR  44          3HG2      THR  44  -0.946   5.193  15.400
  336    H    TYR  45           H        TYR  45  -0.465   9.621  12.894
  337    HA   TYR  45           HA       TYR  45   1.495   9.605  10.695
  338   1HB   TYR  45          2HB       TYR  45  -0.436  11.089  10.341
  339   2HB   TYR  45          1HB       TYR  45  -0.053  11.940  11.834
  340    HD1  TYR  45           1HD      TYR  45   2.354  10.768   9.263
  341    HD2  TYR  45           2HD      TYR  45   0.388  14.106  11.021
  342    HE1  TYR  45           1HE      TYR  45   3.823  12.286   8.006
  343    HE2  TYR  45           2HE      TYR  45   1.853  15.635   9.768
  344    HH   TYR  45           HH       TYR  45   3.984  15.653   8.663
  345    H    ASP  46           H        ASP  46   3.532  10.354  10.980
  346    HA   ASP  46           HA       ASP  46   4.262  11.282  13.677
  347   1HB   ASP  46          2HB       ASP  46   5.031   8.969  13.331
  348   2HB   ASP  46          1HB       ASP  46   5.882   9.468  11.872
  349    H    ASP  47           H        ASP  47   4.032  13.439  12.840
  350    HA   ASP  47           HA       ASP  47   5.184  14.524  10.600
  351   1HB   ASP  47          2HB       ASP  47   4.944  15.808  13.329
  352   2HB   ASP  47          1HB       ASP  47   5.220  16.675  11.821
  353    H    ALA  48           H        ALA  48   6.726  13.762  13.667
  354    HA   ALA  48           HA       ALA  48   9.123  15.110  13.398
  355   1HB   ALA  48          1HB       ALA  48   8.196  13.640  15.328
  356   2HB   ALA  48          2HB       ALA  48   9.940  13.781  15.099
  357   3HB   ALA  48          3HB       ALA  48   9.089  12.345  14.530
  358    H    THR  49           H        THR  49   8.071  12.156  11.827
  359    HA   THR  49           HA       THR  49  10.678  12.020  10.459
  360    HB   THR  49           HB       THR  49  10.253   9.629  10.111
  361    HG1  THR  49           1HG      THR  49   7.841  10.234  11.438
  362   1HG2  THR  49          1HG2      THR  49  10.948   8.940  12.136
  363   2HG2  THR  49          2HG2      THR  49   9.696   9.837  12.997
  364   3HG2  THR  49          3HG2      THR  49  11.130  10.673  12.403
  365    H    LYS  50           H        LYS  50   7.806  13.267   9.908
  366    HA   LYS  50           HA       LYS  50   6.461  13.633   8.069
  367   1HB   LYS  50          2HB       LYS  50   9.155  13.159   6.791
  368   2HB   LYS  50          1HB       LYS  50   7.758  13.727   5.894
  369   1HG   LYS  50          2HG       LYS  50   8.828  15.173   8.297
  370   2HG   LYS  50          1HG       LYS  50   9.414  15.475   6.660
  371   1HD   LYS  50          2HD       LYS  50   6.567  15.776   7.619
  372   2HD   LYS  50          1HD       LYS  50   7.694  17.087   7.269
  373   1HE   LYS  50          2HE       LYS  50   6.533  15.103   5.323
  374   2HE   LYS  50          1HE       LYS  50   6.231  16.838   5.393
  375   1HZ   LYS  50          1HZ       LYS  50   7.784  16.370   3.648
  376   2HZ   LYS  50          2HZ       LYS  50   8.798  15.519   4.699
  377   3HZ   LYS  50          3HZ       LYS  50   8.600  17.188   4.885
  378    H    THR  51           H        THR  51   6.425  10.932   9.053
  379    HA   THR  51           HA       THR  51   5.790   9.537   6.548
  380    HB   THR  51           HB       THR  51   7.226   8.380   8.941
  381    HG1  THR  51           1HG      THR  51   8.024   9.020   6.312
  382   1HG2  THR  51          1HG2      THR  51   6.611   6.360   8.315
  383   2HG2  THR  51          2HG2      THR  51   7.339   6.637   6.733
  384   3HG2  THR  51          3HG2      THR  51   5.644   7.036   7.005
  385    H    PHE  52           H        PHE  52   4.064   8.147   6.584
  386    HA   PHE  52           HA       PHE  52   2.334   8.295   8.966
  387   1HB   PHE  52          2HB       PHE  52   1.498   7.678   6.122
  388   2HB   PHE  52          1HB       PHE  52   0.443   7.999   7.490
  389    HD1  PHE  52           1HD      PHE  52  -0.573  10.046   7.514
  390    HD2  PHE  52           2HD      PHE  52   3.268   9.691   5.713
  391    HE1  PHE  52           1HE      PHE  52  -0.654  12.423   6.875
  392    HE2  PHE  52           2HE      PHE  52   3.194  12.068   5.082
  393    HZ   PHE  52           HZ       PHE  52   1.234  13.434   5.664
  394    H    THR  53           H        THR  53   1.402   6.340   9.738
  395    HA   THR  53           HA       THR  53   2.447   3.908   8.456
  396    HB   THR  53           HB       THR  53   2.269   2.940  10.868
  397    HG1  THR  53           1HG      THR  53   2.768   5.654  11.474
  398   1HG2  THR  53          1HG2      THR  53   4.466   4.616   9.765
  399   2HG2  THR  53          2HG2      THR  53   4.388   2.869  10.012
  400   3HG2  THR  53          3HG2      THR  53   4.592   3.951  11.394
  401    H    VAL  54           H        VAL  54   0.775   3.150   7.389
  402    HA   VAL  54           HA       VAL  54  -1.899   3.163   8.492
  403    HB   VAL  54           HB       VAL  54  -0.847   1.903   5.949
  404   1HG1  VAL  54          1HG1      VAL  54  -2.948   0.907   6.823
  405   2HG1  VAL  54          2HG1      VAL  54  -3.135   1.694   5.257
  406   3HG1  VAL  54          3HG1      VAL  54  -3.698   2.496   6.721
  407   1HG2  VAL  54          1HG2      VAL  54  -1.061   3.872   4.906
  408   2HG2  VAL  54          2HG2      VAL  54  -1.039   4.579   6.522
  409   3HG2  VAL  54          3HG2      VAL  54  -2.576   4.243   5.727
  410    H    THR  55           H        THR  55  -2.529   1.657   9.907
  411    HA   THR  55           HA       THR  55  -1.279  -0.996   9.735
  412    HB   THR  55           HB       THR  55  -2.621   0.122  12.187
  413    HG1  THR  55           1HG      THR  55  -0.493   0.640  12.872
  414   1HG2  THR  55          1HG2      THR  55  -1.329  -1.494  13.388
  415   2HG2  THR  55          2HG2      THR  55  -0.490  -1.982  11.914
  416   3HG2  THR  55          3HG2      THR  55  -2.213  -2.319  12.103
  417    H    GLU  56           H        GLU  56  -2.510  -2.604   9.059
  418    HA   GLU  56           HA       GLU  56  -5.340  -2.209   8.715
  419   1HB   GLU  56          2HB       GLU  56  -5.333  -4.291   7.542
  420   2HB   GLU  56          1HB       GLU  56  -3.880  -3.421   7.076
  421   1HG   GLU  56          2HG       GLU  56  -2.944  -5.438   7.417
  422   2HG   GLU  56          1HG       GLU  56  -2.869  -4.855   9.076
  423   1H    MET   1          1HT       MET   1   6.104  18.688  -2.718
  424   2H    MET   1          2HT       MET   1   5.793  19.614  -1.338
  425   3H    MET   1          3HT       MET   1   4.993  18.143  -1.566
  426    HA   MET   1           HA       MET   1   7.922  18.196  -1.452
  427   1HB   MET   1          2HB       MET   1   7.092  19.501   0.477
  428   2HB   MET   1          1HB       MET   1   6.069  18.150   0.941
  429   1HG   MET   1          2HG       MET   1   7.881  16.838   1.588
  430   2HG   MET   1          1HG       MET   1   9.034  17.831   0.698
  431   1HE   MET   1          1HE       MET   1   6.419  17.761   3.421
  432   2HE   MET   1          2HE       MET   1   6.226  19.501   3.215
  433   3HE   MET   1          3HE       MET   1   6.996  18.865   4.668
  434    H    GLN   2           H        GLN   2   8.672  16.140  -0.433
  435    HA   GLN   2           HA       GLN   2   7.039  13.928  -1.418
  436   1HB   GLN   2          2HB       GLN   2   9.381  14.143  -2.203
  437   2HB   GLN   2          1HB       GLN   2   9.935  13.978  -0.544
  438   1HG   GLN   2          2HG       GLN   2  10.220  11.884  -1.600
  439   2HG   GLN   2          1HG       GLN   2   8.871  11.731  -0.481
  440   1HE2  GLN   2          1HE2      GLN   2   7.837  13.502  -3.114
  441   2HE2  GLN   2          2HE2      GLN   2   7.143  12.221  -4.034
  442    H    TYR   3           H        TYR   3   6.116  12.468  -0.116
  443    HA   TYR   3           HA       TYR   3   6.884  12.455   2.729
  444   1HB   TYR   3          2HB       TYR   3   4.108  12.209   1.554
  445   2HB   TYR   3          1HB       TYR   3   4.499  11.927   3.247
  446    HD1  TYR   3           1HD      TYR   3   4.530  13.705   4.766
  447    HD2  TYR   3           2HD      TYR   3   4.611  14.531   0.592
  448    HE1  TYR   3           1HE      TYR   3   4.226  16.097   5.238
  449    HE2  TYR   3           2HE      TYR   3   4.311  16.929   1.054
  450    HH   TYR   3           HH       TYR   3   4.511  18.222   4.266
  451    H    LYS   4           H        LYS   4   7.078  10.479   3.716
  452    HA   LYS   4           HA       LYS   4   6.898   8.156   1.920
  453   1HB   LYS   4          2HB       LYS   4   9.129   8.592   2.813
  454   2HB   LYS   4          1HB       LYS   4   8.501   8.535   4.454
  455   1HG   LYS   4          2HG       LYS   4   7.920   6.185   4.162
  456   2HG   LYS   4          1HG       LYS   4   8.533   6.238   2.507
  457   1HD   LYS   4          2HD       LYS   4  10.156   6.745   5.002
  458   2HD   LYS   4          1HD       LYS   4  10.165   5.257   4.054
  459   1HE   LYS   4          2HE       LYS   4  10.978   6.517   2.109
  460   2HE   LYS   4          1HE       LYS   4  10.994   7.990   3.080
  461   1HZ   LYS   4          1HZ       LYS   4  12.507   6.570   4.619
  462   2HZ   LYS   4          2HZ       LYS   4  13.159   7.303   3.241
  463   3HZ   LYS   4          3HZ       LYS   4  12.773   5.656   3.220
  464    H    VAL   5           H        VAL   5   5.100   7.009   2.171
  465    HA   VAL   5           HA       VAL   5   3.833   6.905   4.807
  466    HB   VAL   5           HB       VAL   5   2.765   5.965   2.137
  467   1HG1  VAL   5          1HG1      VAL   5   1.832   5.631   4.879
  468   2HG1  VAL   5          2HG1      VAL   5   1.333   4.804   3.403
  469   3HG1  VAL   5          3HG1      VAL   5   0.626   6.365   3.821
  470   1HG2  VAL   5          1HG2      VAL   5   2.557   8.177   1.790
  471   2HG2  VAL   5          2HG2      VAL   5   2.748   8.568   3.500
  472   3HG2  VAL   5          3HG2      VAL   5   1.183   8.034   2.887
  473    H    ILE   6           H        ILE   6   3.664   5.094   5.971
  474    HA   ILE   6           HA       ILE   6   5.003   2.688   4.939
  475    HB   ILE   6           HB       ILE   6   4.649   3.656   7.779
  476   1HG1  ILE   6          2HG1      ILE   6   7.126   3.246   6.090
  477   2HG1  ILE   6          1HG1      ILE   6   6.402   4.800   6.481
  478   1HG2  ILE   6          1HG2      ILE   6   4.646   1.467   8.279
  479   2HG2  ILE   6          2HG2      ILE   6   6.378   1.585   7.966
  480   3HG2  ILE   6          3HG2      ILE   6   5.292   1.000   6.705
  481   1HD1  ILE   6          1HD1      ILE   6   7.984   2.961   8.183
  482   2HD1  ILE   6          2HD1      ILE   6   6.747   3.957   8.948
  483   3HD1  ILE   6          3HD1      ILE   6   8.055   4.716   8.041
  484    H    LEU   7           H        LEU   7   3.807   0.936   4.608
  485    HA   LEU   7           HA       LEU   7   1.084   0.883   5.701
  486   1HB   LEU   7          2HB       LEU   7   2.107  -0.918   3.523
  487   2HB   LEU   7          1HB       LEU   7   0.456  -0.419   3.851
  488    HG   LEU   7           HG       LEU   7   2.647   1.270   2.665
  489   1HD1  LEU   7          1HD1      LEU   7   1.608  -0.338   1.139
  490   2HD1  LEU   7          2HD1      LEU   7   1.214   1.326   0.710
  491   3HD1  LEU   7          3HD1      LEU   7   0.020   0.320   1.534
  492   1HD2  LEU   7          1HD2      LEU   7  -0.176   2.049   3.392
  493   2HD2  LEU   7          2HD2      LEU   7   0.993   3.055   2.533
  494   3HD2  LEU   7          3HD2      LEU   7   1.290   2.592   4.207
  495    H    ASN   8           H        ASN   8   1.506   0.064   7.726
  496    HA   ASN   8           HA       ASN   8   2.883  -2.513   7.929
  497   1HB   ASN   8          2HB       ASN   8   2.061  -0.484  10.000
  498   2HB   ASN   8          1HB       ASN   8   2.671  -2.078  10.427
  499   1HD2  ASN   8          1HD2      ASN   8   4.252  -1.351   7.669
  500   2HD2  ASN   8          2HD2      ASN   8   5.657  -0.600   8.325
  501    H    GLY   9           H        GLY   9   1.579  -4.213   7.565
  502   1HA   GLY   9          2HA       GLY   9  -1.073  -4.179   8.859
  503   2HA   GLY   9          1HA       GLY   9  -0.697  -5.092   7.407
  504    H    LYS  10           H        LYS  10  -1.749  -6.769   8.862
  505    HA   LYS  10           HA       LYS  10  -0.164  -7.803  11.013
  506   1HB   LYS  10          2HB       LYS  10  -2.508  -9.005   9.528
  507   2HB   LYS  10          1HB       LYS  10  -1.788  -9.682  10.982
  508   1HG   LYS  10          2HG       LYS  10  -2.411  -7.687  12.234
  509   2HG   LYS  10          1HG       LYS  10  -3.107  -6.981  10.774
  510   1HD   LYS  10          2HD       LYS  10  -4.713  -8.829  10.654
  511   2HD   LYS  10          1HD       LYS  10  -4.016  -9.527  12.116
  512   1HE   LYS  10          2HE       LYS  10  -5.345  -6.826  11.904
  513   2HE   LYS  10          1HE       LYS  10  -6.066  -8.279  12.598
  514   1HZ   LYS  10          1HZ       LYS  10  -5.266  -7.408  14.494
  515   2HZ   LYS  10          2HZ       LYS  10  -4.089  -6.475  13.719
  516   3HZ   LYS  10          3HZ       LYS  10  -3.812  -8.119  14.003
  517    H    THR  11           H        THR  11  -1.043  -9.069   7.797
  518    HA   THR  11           HA       THR  11   1.298 -10.830   7.896
  519    HB   THR  11           HB       THR  11   0.043 -11.903   5.910
  520    HG1  THR  11           1HG      THR  11  -1.482  -9.920   6.078
  521   1HG2  THR  11          1HG2      THR  11  -0.184 -13.377   7.569
  522   2HG2  THR  11          2HG2      THR  11  -1.813 -12.715   7.707
  523   3HG2  THR  11          3HG2      THR  11  -0.531 -12.124   8.763
  524    H    LEU  12           H        LEU  12   0.666  -7.853   6.864
  525    HA   LEU  12           HA       LEU  12   2.435  -8.137   4.551
  526   1HB   LEU  12          2HB       LEU  12   0.185  -8.006   3.661
  527   2HB   LEU  12          1HB       LEU  12  -0.138  -6.567   4.604
  528    HG   LEU  12           HG       LEU  12   1.392  -5.278   3.280
  529   1HD1  LEU  12          1HD1      LEU  12   3.186  -6.343   2.509
  530   2HD1  LEU  12          2HD1      LEU  12   2.167  -6.872   1.169
  531   3HD1  LEU  12          3HD1      LEU  12   2.383  -7.907   2.577
  532   1HD2  LEU  12          1HD2      LEU  12  -0.975  -6.317   2.357
  533   2HD2  LEU  12          2HD2      LEU  12   0.141  -6.638   1.029
  534   3HD2  LEU  12          3HD2      LEU  12  -0.073  -4.991   1.623
  535    H    LYS  13           H        LYS  13   3.940  -6.576   4.329
  536    HA   LYS  13           HA       LYS  13   3.723  -4.115   5.889
  537   1HB   LYS  13          2HB       LYS  13   6.071  -6.008   6.128
  538   2HB   LYS  13          1HB       LYS  13   5.976  -4.403   6.838
  539   1HG   LYS  13          2HG       LYS  13   4.183  -5.086   8.282
  540   2HG   LYS  13          1HG       LYS  13   4.096  -6.660   7.491
  541   1HD   LYS  13          2HD       LYS  13   5.267  -6.866   9.597
  542   2HD   LYS  13          1HD       LYS  13   6.390  -7.143   8.265
  543   1HE   LYS  13          2HE       LYS  13   6.086  -4.482   9.641
  544   2HE   LYS  13          1HE       LYS  13   7.242  -5.706  10.159
  545   1HZ   LYS  13          1HZ       LYS  13   7.664  -5.448   7.466
  546   2HZ   LYS  13          2HZ       LYS  13   8.627  -4.804   8.698
  547   3HZ   LYS  13          3HZ       LYS  13   7.416  -3.859   7.995
  548    H    GLY  14           H        GLY  14   4.908  -2.388   5.026
  549   1HA   GLY  14          2HA       GLY  14   6.916  -2.714   3.049
  550   2HA   GLY  14          1HA       GLY  14   5.366  -2.407   2.282
  551    H    GLU  15           H        GLU  15   6.950  -0.595   1.580
  552    HA   GLU  15           HA       GLU  15   6.293   1.744   3.213
  553   1HB   GLU  15          2HB       GLU  15   9.022   1.283   1.991
  554   2HB   GLU  15          1HB       GLU  15   8.513   2.704   2.891
  555   1HG   GLU  15          2HG       GLU  15   9.628   1.614   4.531
  556   2HG   GLU  15          1HG       GLU  15   8.033   0.903   4.763
  557    H    THR  16           H        THR  16   5.736   3.528   2.065
  558    HA   THR  16           HA       THR  16   6.127   3.500  -0.834
  559    HB   THR  16           HB       THR  16   3.966   2.674  -0.835
  560    HG1  THR  16           1HG      THR  16   3.487   5.436  -0.632
  561   1HG2  THR  16          1HG2      THR  16   3.332   2.574   1.406
  562   2HG2  THR  16          2HG2      THR  16   2.154   3.648   0.651
  563   3HG2  THR  16          3HG2      THR  16   3.470   4.317   1.613
  564    H    THR  17           H        THR  17   5.515   5.660  -1.823
  565    HA   THR  17           HA       THR  17   5.799   7.892   0.040
  566    HB   THR  17           HB       THR  17   7.607   8.871  -1.359
  567    HG1  THR  17           1HG      THR  17   7.778   6.282  -2.490
  568   1HG2  THR  17          1HG2      THR  17   8.143   6.239  -0.026
  569   2HG2  THR  17          2HG2      THR  17   8.383   7.864   0.618
  570   3HG2  THR  17          3HG2      THR  17   9.421   7.265  -0.676
  571    H    THR  18           H        THR  18   4.396   9.423  -0.433
  572    HA   THR  18           HA       THR  18   3.355   9.645  -3.188
  573    HB   THR  18           HB       THR  18   1.688   9.164  -1.414
  574    HG1  THR  18           1HG      THR  18   1.166  10.462  -3.269
  575   1HG2  THR  18          1HG2      THR  18   1.046  11.050   0.097
  576   2HG2  THR  18          2HG2      THR  18   2.599  11.792  -0.284
  577   3HG2  THR  18          3HG2      THR  18   2.545  10.223   0.520
  578    H    GLU  19           H        GLU  19   3.417  11.581  -4.249
  579    HA   GLU  19           HA       GLU  19   5.112  13.677  -3.065
  580   1HB   GLU  19          2HB       GLU  19   5.764  12.728  -5.272
  581   2HB   GLU  19          1HB       GLU  19   4.231  13.269  -5.939
  582   1HG   GLU  19          2HG       GLU  19   5.894  14.828  -6.588
  583   2HG   GLU  19          1HG       GLU  19   4.887  15.602  -5.366
  584    H    ALA  20           H        ALA  20   3.902  15.204  -2.010
  585    HA   ALA  20           HA       ALA  20   1.683  16.395  -3.487
  586   1HB   ALA  20          1HB       ALA  20   1.037  14.543  -1.711
  587   2HB   ALA  20          2HB       ALA  20   0.062  15.994  -1.943
  588   3HB   ALA  20          3HB       ALA  20   1.204  15.904  -0.603
  589    H    VAL  21           H        VAL  21   1.214  18.500  -2.956
  590    HA   VAL  21           HA       VAL  21   3.272  20.204  -2.334
  591    HB   VAL  21           HB       VAL  21   0.369  20.809  -1.783
  592   1HG1  VAL  21          1HG1      VAL  21   2.566  22.669  -2.663
  593   2HG1  VAL  21          2HG1      VAL  21   2.095  22.439  -0.979
  594   3HG1  VAL  21          3HG1      VAL  21   0.937  23.093  -2.136
  595   1HG2  VAL  21          1HG2      VAL  21   0.517  21.741  -4.178
  596   2HG2  VAL  21          2HG2      VAL  21   0.330  19.999  -3.963
  597   3HG2  VAL  21          3HG2      VAL  21   1.914  20.676  -4.346
  598    H    ASP  22           H        ASP  22   1.206  18.505  -0.117
  599    HA   ASP  22           HA       ASP  22   2.885  19.301   2.083
  600   1HB   ASP  22          2HB       ASP  22   1.133  20.252   3.493
  601   2HB   ASP  22          1HB       ASP  22   1.330  21.199   2.022
  602    H    ALA  23           H        ALA  23   1.888  18.370   4.228
  603    HA   ALA  23           HA       ALA  23   1.825  15.602   3.957
  604   1HB   ALA  23          1HB       ALA  23   1.395  17.517   6.151
  605   2HB   ALA  23          2HB       ALA  23   2.415  16.080   6.079
  606   3HB   ALA  23          3HB       ALA  23   0.686  15.918   6.382
  607    H    ALA  24           H        ALA  24  -0.851  17.883   4.336
  608    HA   ALA  24           HA       ALA  24  -2.892  15.957   4.572
  609   1HB   ALA  24          1HB       ALA  24  -4.201  18.010   3.405
  610   2HB   ALA  24          2HB       ALA  24  -2.758  18.846   3.977
  611   3HB   ALA  24          3HB       ALA  24  -3.777  17.969   5.117
  612    H    THR  25           H        THR  25  -1.808  17.795   1.702
  613    HA   THR  25           HA       THR  25  -3.405  16.554  -0.185
  614    HB   THR  25           HB       THR  25  -1.568  17.128  -1.802
  615    HG1  THR  25           1HG      THR  25  -0.203  17.515   0.587
  616   1HG2  THR  25          1HG2      THR  25  -2.766  19.080   0.043
  617   2HG2  THR  25          2HG2      THR  25  -2.841  18.978  -1.716
  618   3HG2  THR  25          3HG2      THR  25  -1.407  19.639  -0.931
  619    H    ALA  26           H        ALA  26  -0.213  15.599   1.057
  620    HA   ALA  26           HA       ALA  26   0.102  13.285  -0.511
  621   1HB   ALA  26          1HB       ALA  26   1.298  14.368   1.955
  622   2HB   ALA  26          2HB       ALA  26   2.071  13.652   0.541
  623   3HB   ALA  26          3HB       ALA  26   1.376  12.614   1.786
  624    H    GLU  27           H        GLU  27  -1.078  13.664   2.835
  625    HA   GLU  27           HA       GLU  27  -1.888  11.123   3.395
  626   1HB   GLU  27          2HB       GLU  27  -1.943  12.987   4.984
  627   2HB   GLU  27          1HB       GLU  27  -3.283  13.706   4.101
  628   1HG   GLU  27          2HG       GLU  27  -4.672  11.777   4.645
  629   2HG   GLU  27          1HG       GLU  27  -3.329  11.067   5.539
  630    H    LYS  28           H        LYS  28  -3.782  13.655   1.768
  631    HA   LYS  28           HA       LYS  28  -6.110  12.144   1.355
  632   1HB   LYS  28          2HB       LYS  28  -4.972  14.444  -0.244
  633   2HB   LYS  28          1HB       LYS  28  -6.591  13.793  -0.461
  634   1HG   LYS  28          2HG       LYS  28  -5.503  15.100   2.022
  635   2HG   LYS  28          1HG       LYS  28  -6.675  15.783   0.893
  636   1HD   LYS  28          2HD       LYS  28  -8.235  13.968   1.436
  637   2HD   LYS  28          1HD       LYS  28  -7.067  13.320   2.589
  638   1HE   LYS  28          2HE       LYS  28  -8.780  14.637   3.722
  639   2HE   LYS  28          1HE       LYS  28  -7.192  15.385   3.886
  640   1HZ   LYS  28          1HZ       LYS  28  -9.455  16.625   3.030
  641   2HZ   LYS  28          2HZ       LYS  28  -8.623  16.322   1.588
  642   3HZ   LYS  28          3HZ       LYS  28  -7.876  17.200   2.824
  643    H    VAL  29           H        VAL  29  -3.237  12.604  -0.651
  644    HA   VAL  29           HA       VAL  29  -4.053  11.247  -2.930
  645    HB   VAL  29           HB       VAL  29  -1.296  11.383  -1.697
  646   1HG1  VAL  29          1HG1      VAL  29  -2.230  10.345  -4.349
  647   2HG1  VAL  29          2HG1      VAL  29  -1.141   9.593  -3.183
  648   3HG1  VAL  29          3HG1      VAL  29  -0.597  10.977  -4.132
  649   1HG2  VAL  29          1HG2      VAL  29  -2.818  13.417  -2.719
  650   2HG2  VAL  29          2HG2      VAL  29  -1.851  12.930  -4.110
  651   3HG2  VAL  29          3HG2      VAL  29  -1.058  13.411  -2.609
  652    H    VAL  30           H        VAL  30  -2.693  10.011   0.074
  653    HA   VAL  30           HA       VAL  30  -2.402   7.330  -0.749
  654    HB   VAL  30           HB       VAL  30  -3.029   8.296   2.041
  655   1HG1  VAL  30          1HG1      VAL  30  -3.144   5.818   1.477
  656   2HG1  VAL  30          2HG1      VAL  30  -2.096   6.283   2.817
  657   3HG1  VAL  30          3HG1      VAL  30  -1.398   5.906   1.241
  658   1HG2  VAL  30          1HG2      VAL  30  -0.934   9.062   2.310
  659   2HG2  VAL  30          2HG2      VAL  30  -0.930   9.176   0.549
  660   3HG2  VAL  30          3HG2      VAL  30  -0.233   7.765   1.342
  661    H    LYS  31           H        LYS  31  -5.094   9.048   0.886
  662    HA   LYS  31           HA       LYS  31  -6.845   6.952   1.225
  663   1HB   LYS  31          2HB       LYS  31  -7.307   9.845   0.653
  664   2HB   LYS  31          1HB       LYS  31  -8.672   8.740   0.660
  665   1HG   LYS  31          2HG       LYS  31  -8.416   9.861   2.794
  666   2HG   LYS  31          1HG       LYS  31  -8.193   8.123   2.951
  667   1HD   LYS  31          2HD       LYS  31  -5.737   8.497   2.937
  668   2HD   LYS  31          1HD       LYS  31  -6.046  10.239   2.928
  669   1HE   LYS  31          2HE       LYS  31  -7.369   9.955   5.012
  670   2HE   LYS  31          1HE       LYS  31  -6.896   8.259   5.041
  671   1HZ   LYS  31          1HZ       LYS  31  -5.136   8.904   6.190
  672   2HZ   LYS  31          2HZ       LYS  31  -5.467  10.538   5.931
  673   3HZ   LYS  31          3HZ       LYS  31  -4.549   9.674   4.800
  674    H    GLN  32           H        GLN  32  -6.505   8.970  -1.684
  675    HA   GLN  32           HA       GLN  32  -8.436   7.562  -3.193
  676   1HB   GLN  32          2HB       GLN  32  -7.573   9.817  -3.793
  677   2HB   GLN  32          1HB       GLN  32  -6.024   9.094  -4.196
  678   1HG   GLN  32          2HG       GLN  32  -7.240   9.485  -6.210
  679   2HG   GLN  32          1HG       GLN  32  -7.140   7.750  -5.936
  680   1HE2  GLN  32          1HE2      GLN  32  -9.360   9.133  -3.813
  681   2HE2  GLN  32          2HE2      GLN  32 -10.796   8.797  -4.704
  682    H    PHE  33           H        PHE  33  -4.984   7.205  -2.748
  683    HA   PHE  33           HA       PHE  33  -4.372   5.306  -4.663
  684   1HB   PHE  33          2HB       PHE  33  -2.784   6.529  -3.136
  685   2HB   PHE  33          1HB       PHE  33  -3.245   5.412  -1.857
  686    HD1  PHE  33           1HD      PHE  33  -1.668   5.662  -5.173
  687    HD2  PHE  33           2HD      PHE  33  -2.249   3.267  -1.692
  688    HE1  PHE  33           1HE      PHE  33   0.067   4.102  -5.946
  689    HE2  PHE  33           2HE      PHE  33  -0.513   1.711  -2.476
  690    HZ   PHE  33           HZ       PHE  33   0.642   2.137  -4.610
  691    H    PHE  34           H        PHE  34  -5.231   4.716  -1.279
  692    HA   PHE  34           HA       PHE  34  -5.551   1.889  -1.695
  693   1HB   PHE  34          2HB       PHE  34  -6.209   3.613   0.692
  694   2HB   PHE  34          1HB       PHE  34  -6.308   1.851   0.669
  695    HD1  PHE  34           1HD      PHE  34  -3.987   1.071  -0.846
  696    HD2  PHE  34           2HD      PHE  34  -4.403   4.148   2.062
  697    HE1  PHE  34           1HE      PHE  34  -1.584   0.934  -0.367
  698    HE2  PHE  34           2HE      PHE  34  -1.993   4.010   2.551
  699    HZ   PHE  34           HZ       PHE  34  -0.589   2.404   1.321
  700    H    ASN  35           H        ASN  35  -7.747   4.622  -1.377
  701    HA   ASN  35           HA       ASN  35 -10.181   3.330  -1.165
  702   1HB   ASN  35          2HB       ASN  35 -10.019   5.752  -1.117
  703   2HB   ASN  35          1HB       ASN  35  -9.456   5.786  -2.785
  704   1HD2  ASN  35          1HD2      ASN  35 -11.984   6.476  -0.979
  705   2HD2  ASN  35          2HD2      ASN  35 -13.279   6.164  -2.075
  706    H    ASP  36           H        ASP  36  -8.142   3.840  -3.954
  707    HA   ASP  36           HA       ASP  36 -10.016   2.463  -5.718
  708   1HB   ASP  36          2HB       ASP  36  -7.400   3.843  -6.347
  709   2HB   ASP  36          1HB       ASP  36  -8.488   3.141  -7.539
  710    H    ASN  37           H        ASN  37  -7.011   1.803  -4.057
  711    HA   ASN  37           HA       ASN  37  -6.359  -0.445  -5.755
  712   1HB   ASN  37          2HB       ASN  37  -5.271   0.402  -3.058
  713   2HB   ASN  37          1HB       ASN  37  -4.691  -0.997  -3.953
  714   1HD2  ASN  37          1HD2      ASN  37  -3.460   1.610  -3.095
  715   2HD2  ASN  37          2HD2      ASN  37  -2.748   2.238  -4.541
  716    H    GLY  38           H        GLY  38  -7.673   0.096  -2.547
  717   1HA   GLY  38          2HA       GLY  38  -8.196  -1.807  -1.077
  718   2HA   GLY  38          1HA       GLY  38  -9.624  -1.169  -1.857
  719    H    VAL  39           H        VAL  39 -10.931  -2.644  -2.539
  720    HA   VAL  39           HA       VAL  39 -10.090  -5.366  -2.774
  721    HB   VAL  39           HB       VAL  39 -12.796  -4.116  -3.129
  722   1HG1  VAL  39          1HG1      VAL  39 -13.172  -6.082  -4.222
  723   2HG1  VAL  39          2HG1      VAL  39 -13.384  -6.648  -2.566
  724   3HG1  VAL  39          3HG1      VAL  39 -11.854  -6.916  -3.402
  725   1HG2  VAL  39          1HG2      VAL  39 -12.054  -3.852  -0.892
  726   2HG2  VAL  39          2HG2      VAL  39 -11.445  -5.505  -0.830
  727   3HG2  VAL  39          3HG2      VAL  39 -13.182  -5.207  -0.899
  728    H    ASP  40           H        ASP  40 -11.763  -3.241  -5.158
  729    HA   ASP  40           HA       ASP  40 -11.163  -5.243  -7.179
  730   1HB   ASP  40          2HB       ASP  40 -12.852  -2.745  -7.313
  731   2HB   ASP  40          1HB       ASP  40 -12.673  -3.915  -8.617
  732    H    GLY  41           H        GLY  41  -8.981  -3.500  -6.147
  733   1HA   GLY  41          2HA       GLY  41  -8.378  -1.531  -8.095
  734   2HA   GLY  41          1HA       GLY  41  -7.226  -2.270  -6.994
  735    H    GLU  42           H        GLU  42  -7.063  -1.570  -9.895
  736    HA   GLU  42           HA       GLU  42  -6.965  -4.047 -11.343
  737   1HB   GLU  42          2HB       GLU  42  -5.781  -1.343 -12.011
  738   2HB   GLU  42          1HB       GLU  42  -5.894  -2.704 -13.119
  739   1HG   GLU  42          2HG       GLU  42  -8.217  -1.252 -11.868
  740   2HG   GLU  42          1HG       GLU  42  -7.647  -1.069 -13.527
  741    H    TRP  43           H        TRP  43  -5.580  -5.488 -10.361
  742    HA   TRP  43           HA       TRP  43  -2.797  -4.612  -9.959
  743   1HB   TRP  43          2HB       TRP  43  -4.096  -7.116  -8.893
  744   2HB   TRP  43          1HB       TRP  43  -2.532  -6.460  -8.445
  745    HD1  TRP  43           HD       TRP  43  -4.985  -3.686  -8.510
  746    HE1  TRP  43           1HE      TRP  43  -5.800  -3.161  -6.141
  747    HE3  TRP  43           3HE      TRP  43  -3.177  -7.809  -6.133
  748    HZ2  TRP  43           2HZ      TRP  43  -5.690  -4.352  -3.571
  749    HZ3  TRP  43           3HZ      TRP  43  -3.561  -8.052  -3.727
  750    HH2  TRP  43           HH       TRP  43  -4.797  -6.356  -2.464
  751    H    THR  44           H        THR  44  -1.187  -5.451 -11.134
  752    HA   THR  44           HA       THR  44  -1.802  -7.712 -12.915
  753    HB   THR  44           HB       THR  44   0.151  -6.937 -14.249
  754    HG1  THR  44           1HG      THR  44   1.105  -5.807 -12.385
  755   1HG2  THR  44          1HG2      THR  44  -1.688  -4.605 -13.858
  756   2HG2  THR  44          2HG2      THR  44  -2.189  -6.078 -14.687
  757   3HG2  THR  44          3HG2      THR  44  -0.853  -5.118 -15.325
  758    H    TYR  45           H        TYR  45  -0.516  -9.558 -12.811
  759    HA   TYR  45           HA       TYR  45   1.412  -9.588 -10.584
  760   1HB   TYR  45          2HB       TYR  45  -0.560 -11.024 -10.259
  761   2HB   TYR  45          1HB       TYR  45  -0.176 -11.885 -11.745
  762    HD1  TYR  45           1HD      TYR  45   2.223 -10.769  -9.141
  763    HD2  TYR  45           2HD      TYR  45   0.201 -14.061 -10.927
  764    HE1  TYR  45           1HE      TYR  45   3.637 -12.325  -7.865
  765    HE2  TYR  45           2HE      TYR  45   1.611 -15.624  -9.656
  766    HH   TYR  45           HH       TYR  45   3.724 -15.694  -8.520
  767    H    ASP  46           H        ASP  46   3.435 -10.386 -10.841
  768    HA   ASP  46           HA       ASP  46   4.180 -11.333 -13.529
  769   1HB   ASP  46          2HB       ASP  46   5.000  -9.038 -13.170
  770   2HB   ASP  46          1HB       ASP  46   5.817  -9.558 -11.700
  771    H    ASP  47           H        ASP  47   3.883 -13.482 -12.695
  772    HA   ASP  47           HA       ASP  47   4.980 -14.595 -10.438
  773   1HB   ASP  47          2HB       ASP  47   4.747 -15.872 -13.172
  774   2HB   ASP  47          1HB       ASP  47   4.980 -16.745 -11.660
  775    H    ALA  48           H        ALA  48   6.582 -13.870 -13.484
  776    HA   ALA  48           HA       ALA  48   8.943 -15.276 -13.181
  777   1HB   ALA  48          1HB       ALA  48   8.078 -13.785 -15.124
  778   2HB   ALA  48          2HB       ALA  48   9.814 -13.967 -14.870
  779   3HB   ALA  48          3HB       ALA  48   8.990 -12.512 -14.312
  780    H    THR  49           H        THR  49   7.939 -12.298 -11.625
  781    HA   THR  49           HA       THR  49  10.530 -12.224 -10.219
  782    HB   THR  49           HB       THR  49  10.159  -9.825  -9.876
  783    HG1  THR  49           1HG      THR  49   7.752 -10.371 -11.240
  784   1HG2  THR  49          1HG2      THR  49  10.898  -9.153 -11.893
  785   2HG2  THR  49          2HG2      THR  49   9.637 -10.018 -12.770
  786   3HG2  THR  49          3HG2      THR  49  11.043 -10.890 -12.156
  787    H    LYS  50           H        LYS  50   7.621 -13.401  -9.709
  788    HA   LYS  50           HA       LYS  50   6.240 -13.735  -7.888
  789   1HB   LYS  50          2HB       LYS  50   8.929 -13.327  -6.574
  790   2HB   LYS  50          1HB       LYS  50   7.505 -13.860  -5.697
  791   1HG   LYS  50          2HG       LYS  50   8.573 -15.332  -8.084
  792   2HG   LYS  50          1HG       LYS  50   9.129 -15.648  -6.440
  793   1HD   LYS  50          2HD       LYS  50   6.289 -15.879  -7.439
  794   2HD   LYS  50          1HD       LYS  50   7.379 -17.218  -7.073
  795   1HE   LYS  50          2HE       LYS  50   6.238 -15.205  -5.143
  796   2HE   LYS  50          1HE       LYS  50   5.895 -16.933  -5.217
  797   1HZ   LYS  50          1HZ       LYS  50   7.434 -16.503  -3.451
  798   2HZ   LYS  50          2HZ       LYS  50   8.484 -15.675  -4.487
  799   3HZ   LYS  50          3HZ       LYS  50   8.248 -17.340  -4.676
  800    H    THR  51           H        THR  51   6.285 -11.034  -8.873
  801    HA   THR  51           HA       THR  51   5.649  -9.623  -6.377
  802    HB   THR  51           HB       THR  51   7.146  -8.502  -8.750
  803    HG1  THR  51           1HG      THR  51   7.890  -9.161  -6.110
  804   1HG2  THR  51          1HG2      THR  51   6.571  -6.467  -8.132
  805   2HG2  THR  51          2HG2      THR  51   7.271  -6.762  -6.541
  806   3HG2  THR  51          3HG2      THR  51   5.570  -7.119  -6.837
  807    H    PHE  52           H        PHE  52   3.958  -8.194  -6.436
  808    HA   PHE  52           HA       PHE  52   2.260  -8.298  -8.844
  809   1HB   PHE  52          2HB       PHE  52   1.398  -7.660  -6.012
  810   2HB   PHE  52          1HB       PHE  52   0.354  -7.956  -7.395
  811    HD1  PHE  52           1HD      PHE  52  -0.711  -9.977  -7.434
  812    HD2  PHE  52           2HD      PHE  52   3.111  -9.716  -5.578
  813    HE1  PHE  52           1HE      PHE  52  -0.858 -12.353  -6.796
  814    HE2  PHE  52           2HE      PHE  52   2.971 -12.090  -4.948
  815    HZ   PHE  52           HZ       PHE  52   0.987 -13.409  -5.559
  816    H    THR  53           H        THR  53   1.385  -6.321  -9.628
  817    HA   THR  53           HA       THR  53   2.472  -3.915  -8.332
  818    HB   THR  53           HB       THR  53   2.351  -2.944 -10.747
  819    HG1  THR  53           1HG      THR  53   2.792  -5.668 -11.344
  820   1HG2  THR  53          1HG2      THR  53   4.490  -4.672  -9.613
  821   2HG2  THR  53          2HG2      THR  53   4.457  -2.924  -9.860
  822   3HG2  THR  53          3HG2      THR  53   4.655  -4.010 -11.240
  823    H    VAL  54           H        VAL  54   0.803  -3.117  -7.289
  824    HA   VAL  54           HA       VAL  54  -1.855  -3.064  -8.430
  825    HB   VAL  54           HB       VAL  54  -0.808  -1.831  -5.872
  826   1HG1  VAL  54          1HG1      VAL  54  -2.871  -0.784  -6.775
  827   2HG1  VAL  54          2HG1      VAL  54  -3.100  -1.566  -5.212
  828   3HG1  VAL  54          3HG1      VAL  54  -3.662  -2.354  -6.684
  829   1HG2  VAL  54          1HG2      VAL  54  -1.086  -3.791  -4.833
  830   2HG2  VAL  54          2HG2      VAL  54  -1.057  -4.501  -6.447
  831   3HG2  VAL  54          3HG2      VAL  54  -2.597  -4.127  -5.675
  832    H    THR  55           H        THR  55  -2.429  -1.544  -9.854
  833    HA   THR  55           HA       THR  55  -1.117   1.078  -9.663
  834    HB   THR  55           HB       THR  55  -2.452  -0.009 -12.134
  835    HG1  THR  55           1HG      THR  55  -0.326  -0.577 -12.789
  836   1HG2  THR  55          1HG2      THR  55  -1.103   1.575 -13.316
  837   2HG2  THR  55          2HG2      THR  55  -0.273   2.043 -11.829
  838   3HG2  THR  55          3HG2      THR  55  -1.984   2.423 -12.044
  839    H    GLU  56           H        GLU  56  -2.318   2.716  -9.005
  840    HA   GLU  56           HA       GLU  56  -5.161   2.389  -8.701
  841   1HB   GLU  56          2HB       GLU  56  -5.120   4.471  -7.525
  842   2HB   GLU  56          1HB       GLU  56  -3.695   3.565  -7.039
  843   1HG   GLU  56          2HG       GLU  56  -2.706   5.560  -7.366
  844   2HG   GLU  56          1HG       GLU  56  -2.622   4.975  -9.025
  Start of MODEL    3
    1   1H    MET   1          1HT       MET   1   7.220 -18.098   3.402
    2   2H    MET   1          2HT       MET   1   6.482 -19.295   2.463
    3   3H    MET   1          3HT       MET   1   5.634 -17.886   2.852
    4    HA   MET   1           HA       MET   1   8.148 -17.784   1.314
    5   1HB   MET   1          2HB       MET   1   6.294 -19.330   0.356
    6   2HB   MET   1          1HB       MET   1   5.408 -17.843   0.057
    7   1HG   MET   1          2HG       MET   1   8.144 -18.469  -1.033
    8   2HG   MET   1          1HG       MET   1   6.631 -18.665  -1.915
    9   1HE   MET   1          1HE       MET   1   8.461 -17.568  -3.335
   10   2HE   MET   1          2HE       MET   1   9.257 -16.059  -2.888
   11   3HE   MET   1          3HE       MET   1   7.853 -16.034  -3.955
   12    H    GLN   2           H        GLN   2   8.651 -15.719   0.756
   13    HA   GLN   2           HA       GLN   2   6.807 -13.614   1.632
   14   1HB   GLN   2          2HB       GLN   2   9.048 -13.552   2.625
   15   2HB   GLN   2          1HB       GLN   2   9.767 -13.478   1.022
   16   1HG   GLN   2          2HG       GLN   2   8.707 -11.322   0.634
   17   2HG   GLN   2          1HG       GLN   2   7.952 -11.397   2.222
   18   1HE2  GLN   2          1HE2      GLN   2  10.919 -12.764   2.611
   19   2HE2  GLN   2          2HE2      GLN   2  11.817 -11.372   3.088
   20    H    TYR   3           H        TYR   3   5.918 -12.216   0.228
   21    HA   TYR   3           HA       TYR   3   6.760 -12.425  -2.589
   22   1HB   TYR   3          2HB       TYR   3   4.006 -11.789  -1.510
   23   2HB   TYR   3          1HB       TYR   3   4.450 -11.865  -3.214
   24    HD1  TYR   3           1HD      TYR   3   4.054 -13.840  -4.358
   25    HD2  TYR   3           2HD      TYR   3   4.571 -13.977  -0.137
   26    HE1  TYR   3           1HE      TYR   3   3.550 -16.247  -4.378
   27    HE2  TYR   3           2HE      TYR   3   4.072 -16.383  -0.148
   28    HH   TYR   3           HH       TYR   3   4.234 -18.290  -1.883
   29    H    LYS   4           H        LYS   4   6.920 -10.564  -3.818
   30    HA   LYS   4           HA       LYS   4   7.207  -8.109  -2.246
   31   1HB   LYS   4          2HB       LYS   4   9.154  -8.812  -3.549
   32   2HB   LYS   4          1HB       LYS   4   8.191  -8.803  -5.020
   33   1HG   LYS   4          2HG       LYS   4   7.859  -6.386  -4.775
   34   2HG   LYS   4          1HG       LYS   4   8.864  -6.409  -3.324
   35   1HD   LYS   4          2HD       LYS   4  10.758  -7.214  -4.646
   36   2HD   LYS   4          1HD       LYS   4   9.752  -7.212  -6.096
   37   1HE   LYS   4          2HE       LYS   4   9.432  -4.790  -5.853
   38   2HE   LYS   4          1HE       LYS   4  10.470  -4.805  -4.427
   39   1HZ   LYS   4          1HZ       LYS   4  12.333  -5.364  -5.721
   40   2HZ   LYS   4          2HZ       LYS   4  11.551  -4.138  -6.584
   41   3HZ   LYS   4          3HZ       LYS   4  11.396  -5.748  -7.077
   42    H    VAL   5           H        VAL   5   5.398  -6.937  -2.180
   43    HA   VAL   5           HA       VAL   5   3.687  -6.814  -4.551
   44    HB   VAL   5           HB       VAL   5   3.161  -5.772  -1.761
   45   1HG1  VAL   5          1HG1      VAL   5   1.953  -4.610  -3.612
   46   2HG1  VAL   5          2HG1      VAL   5   0.899  -5.428  -2.460
   47   3HG1  VAL   5          3HG1      VAL   5   1.218  -6.158  -4.033
   48   1HG2  VAL   5          1HG2      VAL   5   1.398  -7.804  -2.173
   49   2HG2  VAL   5          2HG2      VAL   5   2.918  -7.952  -1.292
   50   3HG2  VAL   5          3HG2      VAL   5   2.836  -8.412  -2.992
   51    H    ILE   6           H        ILE   6   3.880  -5.175  -5.903
   52    HA   ILE   6           HA       ILE   6   5.225  -2.728  -5.015
   53    HB   ILE   6           HB       ILE   6   4.680  -3.791  -7.790
   54   1HG1  ILE   6          2HG1      ILE   6   7.248  -3.462  -6.224
   55   2HG1  ILE   6          1HG1      ILE   6   6.447  -4.988  -6.589
   56   1HG2  ILE   6          1HG2      ILE   6   6.531  -1.766  -8.035
   57   2HG2  ILE   6          2HG2      ILE   6   5.368  -1.118  -6.879
   58   3HG2  ILE   6          3HG2      ILE   6   4.821  -1.673  -8.461
   59   1HD1  ILE   6          1HD1      ILE   6   7.980  -5.012  -8.243
   60   2HD1  ILE   6          2HD1      ILE   6   8.105  -3.254  -8.304
   61   3HD1  ILE   6          3HD1      ILE   6   6.741  -4.066  -9.071
   62    H    LEU   7           H        LEU   7   3.977  -1.068  -4.487
   63    HA   LEU   7           HA       LEU   7   1.263  -0.901  -5.577
   64   1HB   LEU   7          2HB       LEU   7   2.396   0.886  -3.440
   65   2HB   LEU   7          1HB       LEU   7   0.720   0.454  -3.735
   66    HG   LEU   7           HG       LEU   7   2.857  -1.300  -2.552
   67   1HD1  LEU   7          1HD1      LEU   7   0.254  -0.302  -1.412
   68   2HD1  LEU   7          2HD1      LEU   7   1.843   0.371  -1.052
   69   3HD1  LEU   7          3HD1      LEU   7   1.462  -1.286  -0.584
   70   1HD2  LEU   7          1HD2      LEU   7   0.003  -2.014  -3.208
   71   2HD2  LEU   7          2HD2      LEU   7   1.195  -3.052  -2.424
   72   3HD2  LEU   7          3HD2      LEU   7   1.420  -2.563  -4.103
   73    H    ASN   8           H        ASN   8   1.800  -0.166  -7.647
   74    HA   ASN   8           HA       ASN   8   3.212   2.378  -7.889
   75   1HB   ASN   8          2HB       ASN   8   3.792   0.380  -9.304
   76   2HB   ASN   8          1HB       ASN   8   2.222   0.550 -10.079
   77   1HD2  ASN   8          1HD2      ASN   8   5.284   1.020 -10.641
   78   2HD2  ASN   8          2HD2      ASN   8   5.252   2.460 -11.598
   79    H    GLY   9           H        GLY   9   1.926   4.128  -7.620
   80   1HA   GLY   9          2HA       GLY   9  -0.683   4.109  -9.013
   81   2HA   GLY   9          1HA       GLY   9  -0.379   4.997  -7.530
   82    H    LYS  10           H        LYS  10  -1.316   6.738  -8.912
   83    HA   LYS  10           HA       LYS  10   0.330   7.803 -11.012
   84   1HB   LYS  10          2HB       LYS  10  -2.143   8.774  -9.604
   85   2HB   LYS  10          1HB       LYS  10  -1.283   9.794 -10.744
   86   1HG   LYS  10          2HG       LYS  10  -3.204   8.641 -11.748
   87   2HG   LYS  10          1HG       LYS  10  -1.678   8.226 -12.526
   88   1HD   LYS  10          2HD       LYS  10  -2.625   6.482 -10.316
   89   2HD   LYS  10          1HD       LYS  10  -3.475   6.388 -11.858
   90   1HE   LYS  10          2HE       LYS  10  -0.495   6.076 -11.508
   91   2HE   LYS  10          1HE       LYS  10  -1.637   4.743 -11.658
   92   1HZ   LYS  10          1HZ       LYS  10  -1.887   6.678 -13.761
   93   2HZ   LYS  10          2HZ       LYS  10  -1.722   4.997 -13.855
   94   3HZ   LYS  10          3HZ       LYS  10  -0.349   5.973 -13.708
   95    H    THR  11           H        THR  11  -0.623   9.029  -7.793
   96    HA   THR  11           HA       THR  11   1.738  10.759  -7.808
   97    HB   THR  11           HB       THR  11   0.456  11.783  -5.809
   98    HG1  THR  11           1HG      THR  11  -1.844  11.436  -6.070
   99   1HG2  THR  11          1HG2      THR  11  -0.537  12.007  -8.630
  100   2HG2  THR  11          2HG2      THR  11   0.575  13.078  -7.778
  101   3HG2  THR  11          3HG2      THR  11  -1.125  13.022  -7.315
  102    H    LEU  12           H        LEU  12   1.035   7.765  -6.831
  103    HA   LEU  12           HA       LEU  12   2.781   8.001  -4.497
  104   1HB   LEU  12          2HB       LEU  12   0.515   7.869  -3.645
  105   2HB   LEU  12          1HB       LEU  12   0.210   6.431  -4.600
  106    HG   LEU  12           HG       LEU  12   1.727   5.144  -3.265
  107   1HD1  LEU  12          1HD1      LEU  12   3.511   6.202  -2.466
  108   2HD1  LEU  12          2HD1      LEU  12   2.476   6.739  -1.142
  109   3HD1  LEU  12          3HD1      LEU  12   2.715   7.768  -2.551
  110   1HD2  LEU  12          1HD2      LEU  12  -0.636   6.254  -2.324
  111   2HD2  LEU  12          2HD2      LEU  12   0.499   6.432  -0.985
  112   3HD2  LEU  12          3HD2      LEU  12   0.196   4.840  -1.679
  113    H    LYS  13           H        LYS  13   4.274   6.460  -4.288
  114    HA   LYS  13           HA       LYS  13   4.088   4.005  -5.853
  115   1HB   LYS  13          2HB       LYS  13   6.530   5.779  -6.009
  116   2HB   LYS  13          1HB       LYS  13   6.262   4.270  -6.868
  117   1HG   LYS  13          2HG       LYS  13   5.818   5.783  -8.519
  118   2HG   LYS  13          1HG       LYS  13   4.202   5.546  -7.854
  119   1HD   LYS  13          2HD       LYS  13   4.571   7.899  -8.181
  120   2HD   LYS  13          1HD       LYS  13   4.540   7.568  -6.450
  121   1HE   LYS  13          2HE       LYS  13   6.974   7.603  -6.382
  122   2HE   LYS  13          1HE       LYS  13   7.029   7.880  -8.123
  123   1HZ   LYS  13          1HZ       LYS  13   5.521   9.748  -6.434
  124   2HZ   LYS  13          2HZ       LYS  13   6.326  10.030  -7.894
  125   3HZ   LYS  13          3HZ       LYS  13   7.209   9.859  -6.463
  126    H    GLY  14           H        GLY  14   5.265   2.281  -4.964
  127   1HA   GLY  14          2HA       GLY  14   7.239   2.608  -2.961
  128   2HA   GLY  14          1HA       GLY  14   5.678   2.335  -2.206
  129    H    GLU  15           H        GLU  15   7.085   0.497  -1.401
  130    HA   GLU  15           HA       GLU  15   6.470  -1.855  -3.020
  131   1HB   GLU  15          2HB       GLU  15   9.193  -1.336  -1.806
  132   2HB   GLU  15          1HB       GLU  15   8.697  -2.816  -2.612
  133   1HG   GLU  15          2HG       GLU  15   8.425  -1.611  -4.703
  134   2HG   GLU  15          1HG       GLU  15   8.861  -0.101  -3.904
  135    H    THR  16           H        THR  16   5.753  -3.530  -1.853
  136    HA   THR  16           HA       THR  16   6.191  -3.539   1.038
  137    HB   THR  16           HB       THR  16   4.083  -2.596   1.082
  138    HG1  THR  16           1HG      THR  16   3.434  -5.321   0.865
  139   1HG2  THR  16          1HG2      THR  16   3.204  -2.352  -0.978
  140   2HG2  THR  16          2HG2      THR  16   2.227  -3.717  -0.439
  141   3HG2  THR  16          3HG2      THR  16   3.623  -3.987  -1.478
  142    H    THR  17           H        THR  17   5.441  -5.673   2.038
  143    HA   THR  17           HA       THR  17   5.639  -7.904   0.159
  144    HB   THR  17           HB       THR  17   7.376  -8.981   1.582
  145    HG1  THR  17           1HG      THR  17   7.440  -6.422   2.791
  146   1HG2  THR  17          1HG2      THR  17   9.268  -7.751   0.782
  147   2HG2  THR  17          2HG2      THR  17   8.274  -6.320   0.511
  148   3HG2  THR  17          3HG2      THR  17   8.023  -7.766  -0.466
  149    H    THR  18           H        THR  18   4.165  -9.365   0.583
  150    HA   THR  18           HA       THR  18   3.114  -9.654   3.336
  151    HB   THR  18           HB       THR  18   1.468  -8.932   1.608
  152    HG1  THR  18           1HG      THR  18   0.859 -10.254   3.409
  153   1HG2  THR  18          1HG2      THR  18   2.278 -11.488   0.291
  154   2HG2  THR  18          2HG2      THR  18   2.043  -9.890  -0.416
  155   3HG2  THR  18          3HG2      THR  18   0.649 -10.840   0.098
  156    H    GLU  19           H        GLU  19   2.871 -11.764   4.180
  157    HA   GLU  19           HA       GLU  19   4.439 -13.826   2.764
  158   1HB   GLU  19          2HB       GLU  19   5.375 -13.152   4.928
  159   2HB   GLU  19          1HB       GLU  19   3.852 -13.534   5.719
  160   1HG   GLU  19          2HG       GLU  19   4.122 -15.883   5.118
  161   2HG   GLU  19          1HG       GLU  19   5.645 -15.503   4.316
  162    H    ALA  20           H        ALA  20   3.308 -15.473   1.917
  163    HA   ALA  20           HA       ALA  20   1.009 -16.520   3.359
  164   1HB   ALA  20          1HB       ALA  20   0.279 -14.679   1.731
  165   2HB   ALA  20          2HB       ALA  20  -0.578 -16.221   1.684
  166   3HB   ALA  20          3HB       ALA  20   0.641 -15.851   0.463
  167    H    VAL  21           H        VAL  21   0.417 -18.602   2.793
  168    HA   VAL  21           HA       VAL  21   2.403 -20.404   2.197
  169    HB   VAL  21           HB       VAL  21  -0.520 -20.863   1.603
  170   1HG1  VAL  21          1HG1      VAL  21  -0.081 -23.165   1.930
  171   2HG1  VAL  21          2HG1      VAL  21   1.539 -22.843   2.547
  172   3HG1  VAL  21          3HG1      VAL  21   1.174 -22.571   0.843
  173   1HG2  VAL  21          1HG2      VAL  21  -0.598 -20.083   3.779
  174   2HG2  VAL  21          2HG2      VAL  21   0.981 -20.753   4.188
  175   3HG2  VAL  21          3HG2      VAL  21  -0.413 -21.822   4.012
  176    H    ASP  22           H        ASP  22   0.423 -18.615  -0.030
  177    HA   ASP  22           HA       ASP  22   2.075 -19.520  -2.226
  178   1HB   ASP  22          2HB       ASP  22   0.249 -20.296  -3.643
  179   2HB   ASP  22          1HB       ASP  22   0.331 -21.254  -2.168
  180    H    ALA  23           H        ALA  23   1.171 -18.481  -4.368
  181    HA   ALA  23           HA       ALA  23   1.334 -15.709  -4.041
  182   1HB   ALA  23          1HB       ALA  23   0.046 -16.676  -6.510
  183   2HB   ALA  23          2HB       ALA  23   1.630 -17.357  -6.142
  184   3HB   ALA  23          3HB       ALA  23   1.435 -15.610  -6.293
  185    H    ALA  24           H        ALA  24  -1.478 -17.784  -4.591
  186    HA   ALA  24           HA       ALA  24  -3.372 -15.713  -4.849
  187   1HB   ALA  24          1HB       ALA  24  -3.519 -18.617  -4.173
  188   2HB   ALA  24          2HB       ALA  24  -4.233 -17.738  -5.524
  189   3HB   ALA  24          3HB       ALA  24  -4.942 -17.607  -3.915
  190    H    THR  25           H        THR  25  -2.572 -17.730  -2.012
  191    HA   THR  25           HA       THR  25  -4.119 -16.451  -0.126
  192    HB   THR  25           HB       THR  25  -2.400 -17.226   1.513
  193    HG1  THR  25           1HG      THR  25  -0.968 -17.664  -0.856
  194   1HG2  THR  25          1HG2      THR  25  -2.318 -19.680   0.645
  195   2HG2  THR  25          2HG2      THR  25  -3.441 -19.071  -0.571
  196   3HG2  THR  25          3HG2      THR  25  -3.849 -18.958   1.141
  197    H    ALA  26           H        ALA  26  -0.847 -15.687  -1.250
  198    HA   ALA  26           HA       ALA  26  -0.394 -13.453   0.393
  199   1HB   ALA  26          1HB       ALA  26   1.185 -12.757  -1.478
  200   2HB   ALA  26          2HB       ALA  26   0.668 -14.219  -2.318
  201   3HB   ALA  26          3HB       ALA  26   1.473 -14.340  -0.754
  202    H    GLU  27           H        GLU  27  -1.593 -13.655  -2.967
  203    HA   GLU  27           HA       GLU  27  -2.140 -11.013  -3.443
  204   1HB   GLU  27          2HB       GLU  27  -2.355 -12.791  -5.124
  205   2HB   GLU  27          1HB       GLU  27  -3.772 -13.413  -4.289
  206   1HG   GLU  27          2HG       GLU  27  -4.428 -12.130  -6.224
  207   2HG   GLU  27          1HG       GLU  27  -4.956 -11.325  -4.747
  208    H    LYS  28           H        LYS  28  -4.245 -13.427  -1.910
  209    HA   LYS  28           HA       LYS  28  -6.428 -11.709  -1.462
  210   1HB   LYS  28          2HB       LYS  28  -5.578 -14.167   0.084
  211   2HB   LYS  28          1HB       LYS  28  -7.154 -13.392   0.196
  212   1HG   LYS  28          2HG       LYS  28  -5.977 -14.739  -2.225
  213   2HG   LYS  28          1HG       LYS  28  -7.312 -15.320  -1.226
  214   1HD   LYS  28          2HD       LYS  28  -8.637 -13.365  -1.871
  215   2HD   LYS  28          1HD       LYS  28  -7.303 -12.794  -2.876
  216   1HE   LYS  28          2HE       LYS  28  -7.473 -14.818  -4.244
  217   2HE   LYS  28          1HE       LYS  28  -8.806 -15.385  -3.240
  218   1HZ   LYS  28          1HZ       LYS  28 -10.085 -13.441  -3.920
  219   2HZ   LYS  28          2HZ       LYS  28  -9.623 -14.364  -5.260
  220   3HZ   LYS  28          3HZ       LYS  28  -8.809 -12.925  -4.904
  221    H    VAL  29           H        VAL  29  -3.662 -12.599   0.570
  222    HA   VAL  29           HA       VAL  29  -4.361 -11.225   2.881
  223    HB   VAL  29           HB       VAL  29  -1.596 -11.638   1.728
  224   1HG1  VAL  29          1HG1      VAL  29  -2.552 -10.570   4.337
  225   2HG1  VAL  29          2HG1      VAL  29  -1.181 -10.071   3.347
  226   3HG1  VAL  29          3HG1      VAL  29  -1.086 -11.549   4.302
  227   1HG2  VAL  29          1HG2      VAL  29  -3.404 -13.541   2.554
  228   2HG2  VAL  29          2HG2      VAL  29  -2.406 -13.291   3.985
  229   3HG2  VAL  29          3HG2      VAL  29  -1.655 -13.748   2.457
  230    H    VAL  30           H        VAL  30  -2.703 -10.104  -0.022
  231    HA   VAL  30           HA       VAL  30  -2.166  -7.480   0.894
  232    HB   VAL  30           HB       VAL  30  -2.589  -8.434  -1.947
  233   1HG1  VAL  30          1HG1      VAL  30  -1.687  -6.461  -2.709
  234   2HG1  VAL  30          2HG1      VAL  30  -0.845  -6.136  -1.195
  235   3HG1  VAL  30          3HG1      VAL  30  -2.587  -5.891  -1.304
  236   1HG2  VAL  30          1HG2      VAL  30  -0.787  -9.538  -0.431
  237   2HG2  VAL  30          2HG2      VAL  30   0.086  -8.027  -0.682
  238   3HG2  VAL  30          3HG2      VAL  30  -0.361  -9.027  -2.064
  239    H    LYS  31           H        LYS  31  -4.813  -8.866  -1.067
  240    HA   LYS  31           HA       LYS  31  -6.277  -6.556  -1.475
  241   1HB   LYS  31          2HB       LYS  31  -7.094  -9.430  -1.212
  242   2HB   LYS  31          1HB       LYS  31  -8.300  -8.171  -1.448
  243   1HG   LYS  31          2HG       LYS  31  -7.162  -7.489  -3.510
  244   2HG   LYS  31          1HG       LYS  31  -5.997  -8.793  -3.282
  245   1HD   LYS  31          2HD       LYS  31  -7.728 -10.448  -3.507
  246   2HD   LYS  31          1HD       LYS  31  -8.974  -9.197  -3.545
  247   1HE   LYS  31          2HE       LYS  31  -8.552  -9.981  -5.789
  248   2HE   LYS  31          1HE       LYS  31  -7.981  -8.319  -5.627
  249   1HZ   LYS  31          1HZ       LYS  31  -6.438 -10.789  -5.948
  250   2HZ   LYS  31          2HZ       LYS  31  -5.746  -9.522  -5.072
  251   3HZ   LYS  31          3HZ       LYS  31  -6.218  -9.279  -6.677
  252    H    GLN  32           H        GLN  32  -6.348  -8.768   1.289
  253    HA   GLN  32           HA       GLN  32  -8.421  -7.467   2.695
  254   1HB   GLN  32          2HB       GLN  32  -7.575  -9.736   3.259
  255   2HB   GLN  32          1HB       GLN  32  -6.075  -9.015   3.824
  256   1HG   GLN  32          2HG       GLN  32  -7.456  -9.525   5.707
  257   2HG   GLN  32          1HG       GLN  32  -7.340  -7.777   5.532
  258   1HE2  GLN  32          1HE2      GLN  32  -9.372  -9.074   3.168
  259   2HE2  GLN  32          2HE2      GLN  32 -10.878  -8.770   3.948
  260    H    PHE  33           H        PHE  33  -4.952  -7.031   2.555
  261    HA   PHE  33           HA       PHE  33  -4.502  -5.227   4.601
  262   1HB   PHE  33          2HB       PHE  33  -2.802  -6.336   3.104
  263   2HB   PHE  33          1HB       PHE  33  -3.226  -5.172   1.857
  264    HD1  PHE  33           1HD      PHE  33  -1.953  -5.401   5.335
  265    HD2  PHE  33           2HD      PHE  33  -2.104  -3.154   1.714
  266    HE1  PHE  33           1HE      PHE  33  -0.270  -3.836   6.223
  267    HE2  PHE  33           2HE      PHE  33  -0.424  -1.595   2.608
  268    HZ   PHE  33           HZ       PHE  33   0.492  -1.944   4.868
  269    H    PHE  34           H        PHE  34  -4.974  -4.395   1.199
  270    HA   PHE  34           HA       PHE  34  -5.469  -1.632   1.671
  271   1HB   PHE  34          2HB       PHE  34  -6.116  -3.304  -0.759
  272   2HB   PHE  34          1HB       PHE  34  -6.095  -1.539  -0.698
  273    HD1  PHE  34           1HD      PHE  34  -3.795  -0.814   0.737
  274    HD2  PHE  34           2HD      PHE  34  -4.296  -4.079  -1.934
  275    HE1  PHE  34           1HE      PHE  34  -1.372  -0.850   0.337
  276    HE2  PHE  34           2HE      PHE  34  -1.874  -4.117  -2.351
  277    HZ   PHE  34           HZ       PHE  34  -0.416  -2.501  -1.195
  278    H    ASN  35           H        ASN  35  -7.555  -4.420   1.251
  279    HA   ASN  35           HA       ASN  35 -10.033  -3.206   1.013
  280   1HB   ASN  35          2HB       ASN  35  -9.688  -5.632   0.866
  281   2HB   ASN  35          1HB       ASN  35  -9.299  -5.692   2.582
  282   1HD2  ASN  35          1HD2      ASN  35 -11.538  -6.551   0.565
  283   2HD2  ASN  35          2HD2      ASN  35 -12.973  -6.306   1.494
  284    H    ASP  36           H        ASP  36  -8.055  -3.793   3.827
  285    HA   ASP  36           HA       ASP  36 -10.016  -2.567   5.608
  286   1HB   ASP  36          2HB       ASP  36  -7.380  -3.927   6.193
  287   2HB   ASP  36          1HB       ASP  36  -8.446  -3.251   7.421
  288    H    ASN  37           H        ASN  37  -7.035  -1.745   4.013
  289    HA   ASN  37           HA       ASN  37  -6.452   0.457   5.801
  290   1HB   ASN  37          2HB       ASN  37  -5.280  -0.254   3.102
  291   2HB   ASN  37          1HB       ASN  37  -4.706   1.052   4.133
  292   1HD2  ASN  37          1HD2      ASN  37  -3.591  -1.599   3.105
  293   2HD2  ASN  37          2HD2      ASN  37  -2.923  -2.321   4.526
  294    H    GLY  38           H        GLY  38  -7.649   0.020   2.524
  295   1HA   GLY  38          2HA       GLY  38  -8.055   2.053   1.141
  296   2HA   GLY  38          1HA       GLY  38  -9.525   1.305   1.726
  297    H    VAL  39           H        VAL  39 -10.942   2.595   2.616
  298    HA   VAL  39           HA       VAL  39 -10.082   5.282   3.454
  299    HB   VAL  39           HB       VAL  39 -12.831   4.370   2.690
  300   1HG1  VAL  39          1HG1      VAL  39 -12.857   6.967   2.148
  301   2HG1  VAL  39          2HG1      VAL  39 -11.614   6.984   3.398
  302   3HG1  VAL  39          3HG1      VAL  39 -13.219   6.346   3.758
  303   1HG2  VAL  39          1HG2      VAL  39 -11.244   4.058   0.832
  304   2HG2  VAL  39          2HG2      VAL  39 -10.802   5.761   0.947
  305   3HG2  VAL  39          3HG2      VAL  39 -12.444   5.304   0.491
  306    H    ASP  40           H        ASP  40 -10.812   2.492   5.071
  307    HA   ASP  40           HA       ASP  40 -12.164   4.009   7.194
  308   1HB   ASP  40          2HB       ASP  40 -12.615   1.118   6.430
  309   2HB   ASP  40          1HB       ASP  40 -13.307   1.905   7.846
  310    H    GLY  41           H        GLY  41  -9.265   2.915   6.481
  311   1HA   GLY  41          2HA       GLY  41  -8.694   1.248   8.761
  312   2HA   GLY  41          1HA       GLY  41  -7.526   1.883   7.616
  313    H    GLU  42           H        GLU  42  -6.781   1.801  10.171
  314    HA   GLU  42           HA       GLU  42  -7.226   4.454  11.336
  315   1HB   GLU  42          2HB       GLU  42  -5.821   2.022  12.462
  316   2HB   GLU  42          1HB       GLU  42  -6.033   3.543  13.312
  317   1HG   GLU  42          2HG       GLU  42  -7.659   1.958  14.081
  318   2HG   GLU  42          1HG       GLU  42  -8.472   3.245  13.191
  319    H    TRP  43           H        TRP  43  -5.935   5.924  10.375
  320    HA   TRP  43           HA       TRP  43  -3.165   5.193   9.771
  321   1HB   TRP  43          2HB       TRP  43  -4.802   7.576   8.910
  322   2HB   TRP  43          1HB       TRP  43  -3.152   7.247   8.407
  323    HD1  TRP  43           HD       TRP  43  -5.792   4.446   8.482
  324    HE1  TRP  43           1HE      TRP  43  -6.226   3.700   6.060
  325    HE3  TRP  43           3HE      TRP  43  -3.057   7.992   6.060
  326    HZ2  TRP  43           2HZ      TRP  43  -5.494   4.522   3.450
  327    HZ3  TRP  43           3HZ      TRP  43  -2.970   7.960   3.607
  328    HH2  TRP  43           HH       TRP  43  -4.165   6.254   2.324
  329    H    THR  44           H        THR  44  -1.551   5.857  11.013
  330    HA   THR  44           HA       THR  44  -1.975   8.166  12.789
  331    HB   THR  44           HB       THR  44  -0.108   7.233  14.137
  332    HG1  THR  44           1HG      THR  44  -0.310   5.017  12.381
  333   1HG2  THR  44          1HG2      THR  44  -2.464   5.446  13.651
  334   2HG2  THR  44          2HG2      THR  44  -2.202   6.590  14.967
  335   3HG2  THR  44          3HG2      THR  44  -1.251   5.107  14.886
  336    H    TYR  45           H        TYR  45  -0.573   9.898  12.657
  337    HA   TYR  45           HA       TYR  45   1.431   9.743  10.501
  338   1HB   TYR  45          2HB       TYR  45  -0.416  11.254   9.986
  339   2HB   TYR  45          1HB       TYR  45  -0.134  12.134  11.483
  340    HD1  TYR  45           1HD      TYR  45   2.295  10.908   8.932
  341    HD2  TYR  45           2HD      TYR  45   0.525  14.269  10.848
  342    HE1  TYR  45           1HE      TYR  45   3.861  12.396   7.757
  343    HE2  TYR  45           2HE      TYR  45   2.084  15.766   9.677
  344    HH   TYR  45           HH       TYR  45   3.456  15.745   7.612
  345    H    ASP  46           H        ASP  46   3.456  10.616  10.770
  346    HA   ASP  46           HA       ASP  46   4.151  11.520  13.485
  347   1HB   ASP  46          2HB       ASP  46   4.986   9.236  13.102
  348   2HB   ASP  46          1HB       ASP  46   5.823   9.783  11.653
  349    H    ASP  47           H        ASP  47   3.897  13.688  12.729
  350    HA   ASP  47           HA       ASP  47   4.988  14.859  10.502
  351   1HB   ASP  47          2HB       ASP  47   4.782  16.061  13.269
  352   2HB   ASP  47          1HB       ASP  47   5.006  16.974  11.779
  353    H    ALA  48           H        ALA  48   6.614  14.051  13.516
  354    HA   ALA  48           HA       ALA  48   8.959  15.457  13.300
  355   1HB   ALA  48          1HB       ALA  48  10.011  13.664  14.606
  356   2HB   ALA  48          2HB       ALA  48   8.622  12.628  14.285
  357   3HB   ALA  48          3HB       ALA  48   8.421  14.101  15.233
  358    H    THR  49           H        THR  49   7.959  12.680  11.426
  359    HA   THR  49           HA       THR  49  10.484  12.875   9.924
  360    HB   THR  49           HB       THR  49  10.387  10.443   9.532
  361    HG1  THR  49           1HG      THR  49   8.921   9.210  10.742
  362   1HG2  THR  49          1HG2      THR  49  11.672  11.316  11.467
  363   2HG2  THR  49          2HG2      THR  49  11.084   9.666  11.672
  364   3HG2  THR  49          3HG2      THR  49  10.264  11.002  12.481
  365    H    LYS  50           H        LYS  50   7.465  13.721   9.662
  366    HA   LYS  50           HA       LYS  50   5.898  13.911   7.990
  367   1HB   LYS  50          2HB       LYS  50   8.392  13.671   6.291
  368   2HB   LYS  50          1HB       LYS  50   6.839  14.266   5.728
  369   1HG   LYS  50          2HG       LYS  50   8.463  15.544   7.916
  370   2HG   LYS  50          1HG       LYS  50   8.476  16.052   6.227
  371   1HD   LYS  50          2HD       LYS  50   6.025  15.984   7.988
  372   2HD   LYS  50          1HD       LYS  50   6.988  17.424   7.657
  373   1HE   LYS  50          2HE       LYS  50   5.637  15.766   5.537
  374   2HE   LYS  50          1HE       LYS  50   4.939  17.216   6.255
  375   1HZ   LYS  50          1HZ       LYS  50   6.289  18.547   5.083
  376   2HZ   LYS  50          2HZ       LYS  50   6.446  17.215   4.054
  377   3HZ   LYS  50          3HZ       LYS  50   7.628  17.524   5.224
  378    H    THR  51           H        THR  51   6.420  11.230   8.969
  379    HA   THR  51           HA       THR  51   5.821   9.663   6.551
  380    HB   THR  51           HB       THR  51   7.138   8.781   9.126
  381    HG1  THR  51           1HG      THR  51   8.627   9.813   7.904
  382   1HG2  THR  51          1HG2      THR  51   5.666   7.129   7.576
  383   2HG2  THR  51          2HG2      THR  51   7.070   6.632   8.518
  384   3HG2  THR  51          3HG2      THR  51   7.243   7.003   6.802
  385    H    PHE  52           H        PHE  52   4.132   8.227   6.580
  386    HA   PHE  52           HA       PHE  52   2.311   8.415   8.894
  387   1HB   PHE  52          2HB       PHE  52   1.554   7.874   6.014
  388   2HB   PHE  52          1HB       PHE  52   0.454   8.129   7.362
  389    HD1  PHE  52           1HD      PHE  52  -0.546  10.179   7.500
  390    HD2  PHE  52           2HD      PHE  52   3.304   9.890   5.710
  391    HE1  PHE  52           1HE      PHE  52  -0.610  12.583   6.982
  392    HE2  PHE  52           2HE      PHE  52   3.249  12.294   5.193
  393    HZ   PHE  52           HZ       PHE  52   1.291  13.644   5.831
  394    H    THR  53           H        THR  53   1.412   6.525   9.697
  395    HA   THR  53           HA       THR  53   2.369   4.032   8.462
  396    HB   THR  53           HB       THR  53   2.075   3.119  10.887
  397    HG1  THR  53           1HG      THR  53   2.590   5.843  11.442
  398   1HG2  THR  53          1HG2      THR  53   4.240   2.920  10.345
  399   2HG2  THR  53          2HG2      THR  53   4.412   4.289  11.447
  400   3HG2  THR  53          3HG2      THR  53   4.347   4.565   9.706
  401    H    VAL  54           H        VAL  54   0.878   2.720   7.756
  402    HA   VAL  54           HA       VAL  54  -1.898   3.092   8.646
  403    HB   VAL  54           HB       VAL  54  -0.877   1.641   6.192
  404   1HG1  VAL  54          1HG1      VAL  54  -3.664   2.542   6.283
  405   2HG1  VAL  54          2HG1      VAL  54  -3.271   1.279   7.449
  406   3HG1  VAL  54          3HG1      VAL  54  -2.980   1.014   5.731
  407   1HG2  VAL  54          1HG2      VAL  54  -2.240   3.751   5.226
  408   2HG2  VAL  54          2HG2      VAL  54  -0.498   3.756   5.502
  409   3HG2  VAL  54          3HG2      VAL  54  -1.581   4.459   6.702
  410    H    THR  55           H        THR  55  -2.343   1.779  10.314
  411    HA   THR  55           HA       THR  55  -1.184  -0.907  10.329
  412    HB   THR  55           HB       THR  55  -2.690   0.448  12.562
  413    HG1  THR  55           1HG      THR  55   0.116   0.282  12.196
  414   1HG2  THR  55          1HG2      THR  55  -1.299  -1.115  13.951
  415   2HG2  THR  55          2HG2      THR  55  -0.888  -1.952  12.452
  416   3HG2  THR  55          3HG2      THR  55  -2.568  -1.872  12.990
  417    H    GLU  56           H        GLU  56  -2.344  -2.459   9.443
  418    HA   GLU  56           HA       GLU  56  -5.107  -2.256   8.891
  419   1HB   GLU  56          2HB       GLU  56  -3.605  -3.664   7.568
  420   2HB   GLU  56          1HB       GLU  56  -3.319  -4.694   8.963
  421   1HG   GLU  56          2HG       GLU  56  -5.675  -5.343   8.966
  422   2HG   GLU  56          1HG       GLU  56  -5.957  -4.313   7.564
  423   1H    MET   1          1HT       MET   1   7.705  17.969  -3.207
  424   2H    MET   1          2HT       MET   1   6.983  19.184  -2.279
  425   3H    MET   1          3HT       MET   1   6.106  17.795  -2.680
  426    HA   MET   1           HA       MET   1   8.595  17.633  -1.107
  427   1HB   MET   1          2HB       MET   1   6.766  19.224  -0.175
  428   2HB   MET   1          1HB       MET   1   5.840  17.760   0.112
  429   1HG   MET   1          2HG       MET   1   8.575  18.318   1.241
  430   2HG   MET   1          1HG       MET   1   7.055  18.553   2.102
  431   1HE   MET   1          1HE       MET   1   8.837  17.411   3.547
  432   2HE   MET   1          2HE       MET   1   9.602  15.883   3.111
  433   3HE   MET   1          3HE       MET   1   8.184  15.891   4.158
  434    H    GLN   2           H        GLN   2   9.041  15.557  -0.542
  435    HA   GLN   2           HA       GLN   2   7.157  13.498  -1.444
  436   1HB   GLN   2          2HB       GLN   2   9.411  13.381  -2.405
  437   2HB   GLN   2          1HB       GLN   2  10.105  13.289  -0.792
  438   1HG   GLN   2          2HG       GLN   2   8.987  11.158  -0.420
  439   2HG   GLN   2          1HG       GLN   2   8.257  11.253  -2.019
  440   1HE2  GLN   2          1HE2      GLN   2  11.261  12.548  -2.365
  441   2HE2  GLN   2          2HE2      GLN   2  12.131  11.134  -2.831
  442    H    TYR   3           H        TYR   3   6.216  12.121  -0.053
  443    HA   TYR   3           HA       TYR   3   7.023  12.310   2.775
  444   1HB   TYR   3          2HB       TYR   3   4.270  11.742   1.659
  445   2HB   TYR   3          1HB       TYR   3   4.691  11.807   3.368
  446    HD1  TYR   3           1HD      TYR   3   4.327  13.791   4.506
  447    HD2  TYR   3           2HD      TYR   3   4.907  13.915   0.292
  448    HE1  TYR   3           1HE      TYR   3   3.881  16.209   4.521
  449    HE2  TYR   3           2HE      TYR   3   4.466  16.333   0.298
  450    HH   TYR   3           HH       TYR   3   4.649  18.235   2.036
  451    H    LYS   4           H        LYS   4   7.121  10.445   4.007
  452    HA   LYS   4           HA       LYS   4   7.370   7.985   2.440
  453   1HB   LYS   4          2HB       LYS   4   9.315   8.641   3.769
  454   2HB   LYS   4          1HB       LYS   4   8.331   8.656   5.226
  455   1HG   LYS   4          2HG       LYS   4   7.943   6.247   4.975
  456   2HG   LYS   4          1HG       LYS   4   8.969   6.245   3.540
  457   1HD   LYS   4          2HD       LYS   4  10.863   7.003   4.888
  458   2HD   LYS   4          1HD       LYS   4   9.837   7.027   6.324
  459   1HE   LYS   4          2HE       LYS   4   9.462   4.612   6.077
  460   2HE   LYS   4          1HE       LYS   4  10.520   4.602   4.665
  461   1HZ   LYS   4          1HZ       LYS   4  12.378   5.117   5.985
  462   2HZ   LYS   4          2HZ       LYS   4  11.554   3.909   6.837
  463   3HZ   LYS   4          3HZ       LYS   4  11.432   5.522   7.328
  464    H    VAL   5           H        VAL   5   5.534   6.856   2.347
  465    HA   VAL   5           HA       VAL   5   3.786   6.776   4.692
  466    HB   VAL   5           HB       VAL   5   3.275   5.747   1.897
  467   1HG1  VAL   5          1HG1      VAL   5   2.013   4.614   3.730
  468   2HG1  VAL   5          2HG1      VAL   5   0.995   5.457   2.562
  469   3HG1  VAL   5          3HG1      VAL   5   1.311   6.179   4.139
  470   1HG2  VAL   5          1HG2      VAL   5   1.557   7.821   2.283
  471   2HG2  VAL   5          2HG2      VAL   5   3.092   7.932   1.424
  472   3HG2  VAL   5          3HG2      VAL   5   2.998   8.393   3.123
  473    H    ILE   6           H        ILE   6   3.921   5.133   6.049
  474    HA   ILE   6           HA       ILE   6   5.217   2.655   5.179
  475    HB   ILE   6           HB       ILE   6   4.661   3.729   7.946
  476   1HG1  ILE   6          2HG1      ILE   6   7.241   3.340   6.415
  477   2HG1  ILE   6          1HG1      ILE   6   6.471   4.882   6.769
  478   1HG2  ILE   6          1HG2      ILE   6   6.458   1.661   8.217
  479   2HG2  ILE   6          2HG2      ILE   6   5.296   1.041   7.043
  480   3HG2  ILE   6          3HG2      ILE   6   4.741   1.608   8.617
  481   1HD1  ILE   6          1HD1      ILE   6   7.982   4.869   8.445
  482   2HD1  ILE   6          2HD1      ILE   6   8.063   3.110   8.509
  483   3HD1  ILE   6          3HD1      ILE   6   6.708   3.957   9.256
  484    H    LEU   7           H        LEU   7   3.937   1.024   4.632
  485    HA   LEU   7           HA       LEU   7   1.206   0.923   5.684
  486   1HB   LEU   7          2HB       LEU   7   2.323  -0.890   3.563
  487   2HB   LEU   7          1HB       LEU   7   0.655  -0.418   3.836
  488    HG   LEU   7           HG       LEU   7   2.853   1.284   2.681
  489   1HD1  LEU   7          1HD1      LEU   7   0.241   0.348   1.505
  490   2HD1  LEU   7          2HD1      LEU   7   1.819  -0.363   1.168
  491   3HD1  LEU   7          3HD1      LEU   7   1.485   1.302   0.696
  492   1HD2  LEU   7          1HD2      LEU   7   0.006   2.067   3.298
  493   2HD2  LEU   7          2HD2      LEU   7   1.235   3.075   2.529
  494   3HD2  LEU   7          3HD2      LEU   7   1.423   2.581   4.212
  495    H    ASN   8           H        ASN   8   1.694   0.176   7.761
  496    HA   ASN   8           HA       ASN   8   3.042  -2.402   8.023
  497   1HB   ASN   8          2HB       ASN   8   3.650  -0.418   9.446
  498   2HB   ASN   8          1HB       ASN   8   2.065  -0.548  10.199
  499   1HD2  ASN   8          1HD2      ASN   8   5.107  -1.094  10.804
  500   2HD2  ASN   8          2HD2      ASN   8   5.026  -2.532  11.761
  501    H    GLY   9           H        GLY   9   1.717  -4.118   7.736
  502   1HA   GLY   9          2HA       GLY   9  -0.909  -4.037   9.090
  503   2HA   GLY   9          1HA       GLY   9  -0.605  -4.933   7.612
  504    H    LYS  10           H        LYS  10  -1.604  -6.649   8.982
  505    HA   LYS  10           HA       LYS  10  -0.014  -7.753  11.104
  506   1HB   LYS  10          2HB       LYS  10  -2.493  -8.665   9.661
  507   2HB   LYS  10          1HB       LYS  10  -1.671  -9.705  10.812
  508   1HG   LYS  10          2HG       LYS  10  -3.579  -8.505  11.789
  509   2HG   LYS  10          1HG       LYS  10  -2.054  -8.128  12.588
  510   1HD   LYS  10          2HD       LYS  10  -2.927  -6.362  10.365
  511   2HD   LYS  10          1HD       LYS  10  -3.796  -6.248  11.895
  512   1HE   LYS  10          2HE       LYS  10  -0.805  -6.007  11.588
  513   2HE   LYS  10          1HE       LYS  10  -1.916  -4.647  11.722
  514   1HZ   LYS  10          1HZ       LYS  10  -2.244  -6.574  13.821
  515   2HZ   LYS  10          2HZ       LYS  10  -2.039  -4.899  13.917
  516   3HZ   LYS  10          3HZ       LYS  10  -0.688  -5.908  13.789
  517    H    THR  11           H        THR  11  -0.952  -8.956   7.872
  518    HA   THR  11           HA       THR  11   1.365 -10.744   7.919
  519    HB   THR  11           HB       THR  11   0.087 -11.736   5.903
  520    HG1  THR  11           1HG      THR  11  -2.206 -11.332   6.127
  521   1HG2  THR  11          1HG2      THR  11  -0.951 -11.937   8.709
  522   2HG2  THR  11          2HG2      THR  11   0.147 -13.034   7.872
  523   3HG2  THR  11          3HG2      THR  11  -1.545 -12.937   7.384
  524    H    LEU  12           H        LEU  12   0.748  -7.734   6.933
  525    HA   LEU  12           HA       LEU  12   2.521  -8.012   4.624
  526   1HB   LEU  12          2HB       LEU  12   0.271  -7.826   3.739
  527   2HB   LEU  12          1HB       LEU  12  -0.012  -6.381   4.690
  528    HG   LEU  12           HG       LEU  12   1.554  -5.130   3.377
  529   1HD1  LEU  12          1HD1      LEU  12   3.324  -6.232   2.604
  530   2HD1  LEU  12          2HD1      LEU  12   2.295  -6.745   1.264
  531   3HD1  LEU  12          3HD1      LEU  12   2.489  -7.778   2.677
  532   1HD2  LEU  12          1HD2      LEU  12  -0.820  -6.186   2.402
  533   2HD2  LEU  12          2HD2      LEU  12   0.329  -6.389   1.080
  534   3HD2  LEU  12          3HD2      LEU  12   0.054  -4.791   1.772
  535    H    LYS  13           H        LYS  13   4.055  -6.508   4.436
  536    HA   LYS  13           HA       LYS  13   3.905  -4.049   5.999
  537   1HB   LYS  13          2HB       LYS  13   6.301  -5.882   6.189
  538   2HB   LYS  13          1HB       LYS  13   6.058  -4.367   7.044
  539   1HG   LYS  13          2HG       LYS  13   5.555  -5.867   8.688
  540   2HG   LYS  13          1HG       LYS  13   3.955  -5.592   7.999
  541   1HD   LYS  13          2HD       LYS  13   4.261  -7.954   8.332
  542   2HD   LYS  13          1HD       LYS  13   4.264  -7.623   6.603
  543   1HE   LYS  13          2HE       LYS  13   6.697  -7.717   6.569
  544   2HE   LYS  13          1HE       LYS  13   6.720  -7.994   8.309
  545   1HZ   LYS  13          1HZ       LYS  13   5.190  -9.826   6.599
  546   2HZ   LYS  13          2HZ       LYS  13   5.968 -10.127   8.070
  547   3HZ   LYS  13          3HZ       LYS  13   6.875  -9.977   6.652
  548    H    GLY  14           H        GLY  14   5.139  -2.355   5.126
  549   1HA   GLY  14          2HA       GLY  14   7.131  -2.730   3.151
  550   2HA   GLY  14          1HA       GLY  14   5.589  -2.418   2.376
  551    H    GLU  15           H        GLU  15   7.050  -0.617   1.591
  552    HA   GLU  15           HA       GLU  15   6.471   1.750   3.202
  553   1HB   GLU  15          2HB       GLU  15   9.196   1.164   2.025
  554   2HB   GLU  15          1HB       GLU  15   8.725   2.658   2.826
  555   1HG   GLU  15          2HG       GLU  15   8.393   1.459   4.911
  556   2HG   GLU  15          1HG       GLU  15   8.805  -0.060   4.118
  557    H    THR  16           H        THR  16   5.812   3.443   2.024
  558    HA   THR  16           HA       THR  16   6.289   3.440  -0.861
  559    HB   THR  16           HB       THR  16   4.161   2.549  -0.935
  560    HG1  THR  16           1HG      THR  16   3.574   5.288  -0.728
  561   1HG2  THR  16          1HG2      THR  16   3.246   2.327   1.113
  562   2HG2  THR  16          2HG2      THR  16   2.311   3.715   0.560
  563   3HG2  THR  16          3HG2      THR  16   3.699   3.951   1.618
  564    H    THR  17           H        THR  17   5.604   5.591  -1.870
  565    HA   THR  17           HA       THR  17   5.832   7.817   0.012
  566    HB   THR  17           HB       THR  17   7.613   8.851  -1.387
  567    HG1  THR  17           1HG      THR  17   7.632   6.290  -2.594
  568   1HG2  THR  17          1HG2      THR  17   9.464   7.576  -0.561
  569   2HG2  THR  17          2HG2      THR  17   8.431   6.169  -0.304
  570   3HG2  THR  17          3HG2      THR  17   8.203   7.621   0.670
  571    H    THR  18           H        THR  18   4.399   9.315  -0.432
  572    HA   THR  18           HA       THR  18   3.394   9.627  -3.200
  573    HB   THR  18           HB       THR  18   1.708   8.946  -1.496
  574    HG1  THR  18           1HG      THR  18   1.156  10.282  -3.304
  575   1HG2  THR  18          1HG2      THR  18   2.561  11.482  -0.167
  576   2HG2  THR  18          2HG2      THR  18   2.277   9.890   0.536
  577   3HG2  THR  18          3HG2      THR  18   0.915  10.875   0.002
  578    H    GLU  19           H        GLU  19   3.215  11.743  -4.048
  579    HA   GLU  19           HA       GLU  19   4.813  13.765  -2.610
  580   1HB   GLU  19          2HB       GLU  19   5.762  13.068  -4.762
  581   2HB   GLU  19          1HB       GLU  19   4.260  13.487  -5.573
  582   1HG   GLU  19          2HG       GLU  19   4.578  15.829  -4.968
  583   2HG   GLU  19          1HG       GLU  19   6.080  15.414  -4.143
  584    H    ALA  20           H        ALA  20   3.711  15.441  -1.779
  585    HA   ALA  20           HA       ALA  20   1.459  16.544  -3.253
  586   1HB   ALA  20          1HB       ALA  20   0.660  14.723  -1.636
  587   2HB   ALA  20          2HB       ALA  20  -0.158  16.283  -1.601
  588   3HB   ALA  20          3HB       ALA  20   1.032  15.883  -0.363
  589    H    VAL  21           H        VAL  21   0.909  18.640  -2.695
  590    HA   VAL  21           HA       VAL  21   2.928  20.393  -2.071
  591    HB   VAL  21           HB       VAL  21   0.010  20.922  -1.517
  592   1HG1  VAL  21          1HG1      VAL  21   0.508  23.214  -1.839
  593   2HG1  VAL  21          2HG1      VAL  21   2.129  22.851  -2.432
  594   3HG1  VAL  21          3HG1      VAL  21   1.733  22.589  -0.733
  595   1HG2  VAL  21          1HG2      VAL  21  -0.057  20.143  -3.695
  596   2HG2  VAL  21          2HG2      VAL  21   1.544  20.776  -4.081
  597   3HG2  VAL  21          3HG2      VAL  21   0.175  21.877  -3.925
  598    H    ASP  22           H        ASP  22   0.875  18.651   0.129
  599    HA   ASP  22           HA       ASP  22   2.517  19.516   2.348
  600   1HB   ASP  22          2HB       ASP  22   0.691  20.337   3.738
  601   2HB   ASP  22          1HB       ASP  22   0.816  21.293   2.265
  602    H    ALA  23           H        ALA  23   1.559  18.500   4.477
  603    HA   ALA  23           HA       ALA  23   1.658  15.726   4.152
  604   1HB   ALA  23          1HB       ALA  23   0.359  16.724   6.602
  605   2HB   ALA  23          2HB       ALA  23   1.965  17.366   6.256
  606   3HB   ALA  23          3HB       ALA  23   1.725  15.625   6.406
  607    H    ALA  24           H        ALA  24  -1.110  17.869   4.662
  608    HA   ALA  24           HA       ALA  24  -3.059  15.845   4.894
  609   1HB   ALA  24          1HB       ALA  24  -3.123  18.751   4.215
  610   2HB   ALA  24          2HB       ALA  24  -3.879  17.891   5.557
  611   3HB   ALA  24          3HB       ALA  24  -4.568  17.777   3.938
  612    H    THR  25           H        THR  25  -2.168  17.841   2.069
  613    HA   THR  25           HA       THR  25  -3.719  16.599   0.160
  614    HB   THR  25           HB       THR  25  -1.959  17.332  -1.454
  615    HG1  THR  25           1HG      THR  25  -0.551  17.737   0.936
  616   1HG2  THR  25          1HG2      THR  25  -1.830  19.783  -0.585
  617   2HG2  THR  25          2HG2      THR  25  -2.985  19.201   0.615
  618   3HG2  THR  25          3HG2      THR  25  -3.371  19.099  -1.103
  619    H    ALA  26           H        ALA  26  -0.484  15.755   1.329
  620    HA   ALA  26           HA       ALA  26  -0.062  13.510  -0.307
  621   1HB   ALA  26          1HB       ALA  26   1.474  12.778   1.586
  622   2HB   ALA  26          2HB       ALA  26   0.980  14.252   2.419
  623   3HB   ALA  26          3HB       ALA  26   1.809  14.353   0.866
  624    H    GLU  27           H        GLU  27  -1.303  13.743   3.035
  625    HA   GLU  27           HA       GLU  27  -1.921  11.114   3.503
  626   1HB   GLU  27          2HB       GLU  27  -2.116  12.897   5.183
  627   2HB   GLU  27          1HB       GLU  27  -3.505  13.554   4.328
  628   1HG   GLU  27          2HG       GLU  27  -4.219  12.288   6.253
  629   2HG   GLU  27          1HG       GLU  27  -4.746  11.494   4.769
  630    H    LYS  28           H        LYS  28  -3.947  13.578   1.942
  631    HA   LYS  28           HA       LYS  28  -6.164  11.915   1.463
  632   1HB   LYS  28          2HB       LYS  28  -5.232  14.350  -0.070
  633   2HB   LYS  28          1HB       LYS  28  -6.824  13.614  -0.205
  634   1HG   LYS  28          2HG       LYS  28  -5.648  14.932   2.231
  635   2HG   LYS  28          1HG       LYS  28  -6.954  15.547   1.214
  636   1HD   LYS  28          2HD       LYS  28  -8.335  13.623   1.841
  637   2HD   LYS  28          1HD       LYS  28  -7.031  13.021   2.863
  638   1HE   LYS  28          2HE       LYS  28  -7.171  15.048   4.230
  639   2HE   LYS  28          1HE       LYS  28  -8.476  15.647   3.207
  640   1HZ   LYS  28          1HZ       LYS  28  -9.810  13.735   3.869
  641   2HZ   LYS  28          2HZ       LYS  28  -9.344  14.647   5.215
  642   3HZ   LYS  28          3HZ       LYS  28  -8.560  13.188   4.871
  643    H    VAL  29           H        VAL  29  -3.349  12.738  -0.531
  644    HA   VAL  29           HA       VAL  29  -4.045  11.379  -2.852
  645    HB   VAL  29           HB       VAL  29  -1.289  11.725  -1.658
  646   1HG1  VAL  29          1HG1      VAL  29  -2.232  10.679  -4.282
  647   2HG1  VAL  29          2HG1      VAL  29  -0.888  10.147  -3.272
  648   3HG1  VAL  29          3HG1      VAL  29  -0.744  11.624  -4.225
  649   1HG2  VAL  29          1HG2      VAL  29  -3.038  13.672  -2.511
  650   2HG2  VAL  29          2HG2      VAL  29  -2.025  13.396  -3.927
  651   3HG2  VAL  29          3HG2      VAL  29  -1.286  13.835  -2.387
  652    H    VAL  30           H        VAL  30  -2.459  10.220   0.075
  653    HA   VAL  30           HA       VAL  30  -1.972   7.585  -0.834
  654    HB   VAL  30           HB       VAL  30  -2.411   8.547   2.001
  655   1HG1  VAL  30          1HG1      VAL  30  -1.568   6.552   2.775
  656   2HG1  VAL  30          2HG1      VAL  30  -0.713   6.206   1.273
  657   3HG1  VAL  30          3HG1      VAL  30  -2.462   6.005   1.357
  658   1HG2  VAL  30          1HG2      VAL  30  -0.560   9.607   0.511
  659   2HG2  VAL  30          2HG2      VAL  30   0.272   8.075   0.775
  660   3HG2  VAL  30          3HG2      VAL  30  -0.171   9.087   2.150
  661    H    LYS  31           H        LYS  31  -4.610   9.032   1.089
  662    HA   LYS  31           HA       LYS  31  -6.138   6.761   1.477
  663   1HB   LYS  31          2HB       LYS  31  -6.878   9.655   1.202
  664   2HB   LYS  31          1HB       LYS  31  -8.119   8.426   1.422
  665   1HG   LYS  31          2HG       LYS  31  -7.027   7.714   3.500
  666   2HG   LYS  31          1HG       LYS  31  -5.826   8.990   3.288
  667   1HD   LYS  31          2HD       LYS  31  -7.522  10.686   3.486
  668   2HD   LYS  31          1HD       LYS  31  -8.796   9.465   3.508
  669   1HE   LYS  31          2HE       LYS  31  -8.387  10.239   5.759
  670   2HE   LYS  31          1HE       LYS  31  -7.856   8.565   5.605
  671   1HZ   LYS  31          1HZ       LYS  31  -6.257  10.997   5.948
  672   2HZ   LYS  31          2HZ       LYS  31  -5.584   9.713   5.080
  673   3HZ   LYS  31          3HZ       LYS  31  -6.084   9.482   6.678
  674    H    GLN  32           H        GLN  32  -6.113   8.972  -1.289
  675    HA   GLN  32           HA       GLN  32  -8.198   7.721  -2.724
  676   1HB   GLN  32          2HB       GLN  32  -7.288   9.969  -3.275
  677   2HB   GLN  32          1HB       GLN  32  -5.799   9.211  -3.817
  678   1HG   GLN  32          2HG       GLN  32  -7.142   9.755  -5.719
  679   2HG   GLN  32          1HG       GLN  32  -7.070   8.006  -5.544
  680   1HE2  GLN  32          1HE2      GLN  32  -9.102   9.350  -3.208
  681   2HE2  GLN  32          2HE2      GLN  32 -10.605   9.084  -4.012
  682    H    PHE  33           H        PHE  33  -4.744   7.203  -2.533
  683    HA   PHE  33           HA       PHE  33  -4.308   5.386  -4.575
  684   1HB   PHE  33          2HB       PHE  33  -2.603   6.454  -3.053
  685   2HB   PHE  33          1HB       PHE  33  -3.071   5.303  -1.811
  686    HD1  PHE  33           1HD      PHE  33  -1.745   5.499  -5.271
  687    HD2  PHE  33           2HD      PHE  33  -2.002   3.256  -1.653
  688    HE1  PHE  33           1HE      PHE  33  -0.089   3.894  -6.136
  689    HE2  PHE  33           2HE      PHE  33  -0.349   1.658  -2.524
  690    HZ   PHE  33           HZ       PHE  33   0.608   1.984  -4.771
  691    H    PHE  34           H        PHE  34  -4.848   4.566  -1.178
  692    HA   PHE  34           HA       PHE  34  -5.404   1.817  -1.658
  693   1HB   PHE  34          2HB       PHE  34  -6.045   3.505   0.763
  694   2HB   PHE  34          1HB       PHE  34  -6.066   1.740   0.702
  695    HD1  PHE  34           1HD      PHE  34  -3.764   0.958  -0.700
  696    HD2  PHE  34           2HD      PHE  34  -4.222   4.236   1.963
  697    HE1  PHE  34           1HE      PHE  34  -1.346   0.934  -0.268
  698    HE2  PHE  34           2HE      PHE  34  -1.806   4.214   2.414
  699    HZ   PHE  34           HZ       PHE  34  -0.372   2.563   1.279
  700    H    ASN  35           H        ASN  35  -7.426   4.656  -1.269
  701    HA   ASN  35           HA       ASN  35  -9.936   3.501  -1.066
  702   1HB   ASN  35          2HB       ASN  35  -9.536   5.918  -0.912
  703   2HB   ASN  35          1HB       ASN  35  -9.121   5.969  -2.622
  704   1HD2  ASN  35          1HD2      ASN  35 -11.366   6.882  -0.638
  705   2HD2  ASN  35          2HD2      ASN  35 -12.794   6.671  -1.588
  706    H    ASP  36           H        ASP  36  -7.904   4.039  -3.851
  707    HA   ASP  36           HA       ASP  36  -9.870   2.863  -5.659
  708   1HB   ASP  36          2HB       ASP  36  -7.195   4.157  -6.205
  709   2HB   ASP  36          1HB       ASP  36  -8.259   3.507  -7.449
  710    H    ASN  37           H        ASN  37  -6.932   1.967  -4.023
  711    HA   ASN  37           HA       ASN  37  -6.379  -0.250  -5.802
  712   1HB   ASN  37          2HB       ASN  37  -5.228   0.435  -3.087
  713   2HB   ASN  37          1HB       ASN  37  -4.669  -0.886  -4.109
  714   1HD2  ASN  37          1HD2      ASN  37  -3.507   1.738  -3.066
  715   2HD2  ASN  37          2HD2      ASN  37  -2.801   2.443  -4.478
  716    H    GLY  38           H        GLY  38  -7.610   0.217  -2.544
  717   1HA   GLY  38          2HA       GLY  38  -8.086  -1.805  -1.164
  718   2HA   GLY  38          1HA       GLY  38  -9.528  -1.020  -1.771
  719    H    VAL  39           H        VAL  39 -10.964  -2.273  -2.683
  720    HA   VAL  39           HA       VAL  39 -10.156  -4.980  -3.506
  721    HB   VAL  39           HB       VAL  39 -12.894  -4.004  -2.782
  722   1HG1  VAL  39          1HG1      VAL  39 -12.990  -6.601  -2.242
  723   2HG1  VAL  39          2HG1      VAL  39 -11.730  -6.647  -3.476
  724   3HG1  VAL  39          3HG1      VAL  39 -13.314  -5.971  -3.857
  725   1HG2  VAL  39          1HG2      VAL  39 -11.325  -3.730  -0.901
  726   2HG2  VAL  39          2HG2      VAL  39 -10.924  -5.444  -1.010
  727   3HG2  VAL  39          3HG2      VAL  39 -12.561  -4.948  -0.579
  728    H    ASP  40           H        ASP  40 -10.798  -2.174  -5.135
  729    HA   ASP  40           HA       ASP  40 -12.155  -3.661  -7.277
  730   1HB   ASP  40          2HB       ASP  40 -12.547  -0.759  -6.522
  731   2HB   ASP  40          1HB       ASP  40 -13.236  -1.531  -7.945
  732    H    GLY  41           H        GLY  41  -9.241  -2.637  -6.522
  733   1HA   GLY  41          2HA       GLY  41  -8.595  -0.984  -8.792
  734   2HA   GLY  41          1HA       GLY  41  -7.461  -1.650  -7.631
  735    H    GLU  42           H        GLU  42  -6.678  -1.585 -10.175
  736    HA   GLU  42           HA       GLU  42  -7.172  -4.228 -11.348
  737   1HB   GLU  42          2HB       GLU  42  -5.691  -1.830 -12.451
  738   2HB   GLU  42          1HB       GLU  42  -5.929  -3.347 -13.305
  739   1HG   GLU  42          2HG       GLU  42  -7.504  -1.721 -14.098
  740   2HG   GLU  42          1HG       GLU  42  -8.362  -2.986 -13.220
  741    H    TRP  43           H        TRP  43  -5.929  -5.729 -10.371
  742    HA   TRP  43           HA       TRP  43  -3.151  -5.063  -9.725
  743   1HB   TRP  43          2HB       TRP  43  -4.859  -7.406  -8.889
  744   2HB   TRP  43          1HB       TRP  43  -3.207  -7.118  -8.363
  745    HD1  TRP  43           HD       TRP  43  -5.776  -4.252  -8.475
  746    HE1  TRP  43           1HE      TRP  43  -6.228  -3.496  -6.059
  747    HE3  TRP  43           3HE      TRP  43  -3.164  -7.864  -6.015
  748    HZ2  TRP  43           2HZ      TRP  43  -5.553  -4.335  -3.439
  749    HZ3  TRP  43           3HZ      TRP  43  -3.110  -7.833  -3.559
  750    HH2  TRP  43           HH       TRP  43  -4.282  -6.100  -2.295
  751    H    THR  44           H        THR  44  -1.537  -5.767 -10.944
  752    HA   THR  44           HA       THR  44  -1.992  -8.064 -12.728
  753    HB   THR  44           HB       THR  44  -0.084  -7.177 -14.049
  754    HG1  THR  44           1HG      THR  44  -0.257  -4.957 -12.294
  755   1HG2  THR  44          1HG2      THR  44  -2.402  -5.331 -13.597
  756   2HG2  THR  44          2HG2      THR  44  -2.149  -6.484 -14.909
  757   3HG2  THR  44          3HG2      THR  44  -1.164  -5.025 -14.815
  758    H    TYR  45           H        TYR  45  -0.636  -9.831 -12.576
  759    HA   TYR  45           HA       TYR  45   1.342  -9.723 -10.393
  760   1HB   TYR  45          2HB       TYR  45  -0.547 -11.188  -9.903
  761   2HB   TYR  45          1HB       TYR  45  -0.267 -12.077 -11.396
  762    HD1  TYR  45           1HD      TYR  45   2.155 -10.909  -8.811
  763    HD2  TYR  45           2HD      TYR  45   0.329 -14.227 -10.752
  764    HE1  TYR  45           1HE      TYR  45   3.667 -12.435  -7.614
  765    HE2  TYR  45           2HE      TYR  45   1.837 -15.761  -9.560
  766    HH   TYR  45           HH       TYR  45   3.179 -15.773  -7.476
  767    H    ASP  46           H        ASP  46   3.348 -10.647 -10.633
  768    HA   ASP  46           HA       ASP  46   4.061 -11.567 -13.338
  769   1HB   ASP  46          2HB       ASP  46   4.946  -9.304 -12.942
  770   2HB   ASP  46          1HB       ASP  46   5.748  -9.870 -11.482
  771    H    ASP  47           H        ASP  47   3.743 -13.728 -12.585
  772    HA   ASP  47           HA       ASP  47   4.772 -14.925 -10.343
  773   1HB   ASP  47          2HB       ASP  47   4.577 -16.122 -13.113
  774   2HB   ASP  47          1HB       ASP  47   4.759 -17.039 -11.622
  775    H    ALA  48           H        ALA  48   6.461 -14.157 -13.335
  776    HA   ALA  48           HA       ALA  48   8.768 -15.619 -13.083
  777   1HB   ALA  48          1HB       ALA  48   9.881 -13.855 -14.377
  778   2HB   ALA  48          2HB       ALA  48   8.513 -12.785 -14.074
  779   3HB   ALA  48          3HB       ALA  48   8.290 -14.251 -15.027
  780    H    THR  49           H        THR  49   7.809 -12.817 -11.226
  781    HA   THR  49           HA       THR  49  10.308 -13.076  -9.688
  782    HB   THR  49           HB       THR  49  10.264 -10.640  -9.296
  783    HG1  THR  49           1HG      THR  49   8.845  -9.373 -10.526
  784   1HG2  THR  49          1HG2      THR  49  11.554 -11.545 -11.213
  785   2HG2  THR  49          2HG2      THR  49  11.009  -9.881 -11.427
  786   3HG2  THR  49          3HG2      THR  49  10.169 -11.197 -12.248
  787    H    LYS  50           H        LYS  50   7.266 -13.847  -9.469
  788    HA   LYS  50           HA       LYS  50   5.671 -13.999  -7.819
  789   1HB   LYS  50          2HB       LYS  50   8.146 -13.820  -6.086
  790   2HB   LYS  50          1HB       LYS  50   6.571 -14.376  -5.544
  791   1HG   LYS  50          2HG       LYS  50   8.195 -15.695  -7.709
  792   2HG   LYS  50          1HG       LYS  50   8.168 -16.203  -6.020
  793   1HD   LYS  50          2HD       LYS  50   5.747 -16.074  -7.815
  794   2HD   LYS  50          1HD       LYS  50   6.669 -17.538  -7.472
  795   1HE   LYS  50          2HE       LYS  50   5.329 -15.847  -5.370
  796   2HE   LYS  50          1HE       LYS  50   4.607 -17.280  -6.098
  797   1HZ   LYS  50          1HZ       LYS  50   5.908 -18.642  -4.908
  798   2HZ   LYS  50          2HZ       LYS  50   6.083 -17.315  -3.876
  799   3HZ   LYS  50          3HZ       LYS  50   7.272 -17.652  -5.030
  800    H    THR  51           H        THR  51   6.271 -11.331  -8.790
  801    HA   THR  51           HA       THR  51   5.677  -9.750  -6.380
  802    HB   THR  51           HB       THR  51   7.050  -8.901  -8.936
  803    HG1  THR  51           1HG      THR  51   8.498  -9.966  -7.693
  804   1HG2  THR  51          1HG2      THR  51   5.596  -7.214  -7.408
  805   2HG2  THR  51          2HG2      THR  51   7.027  -6.751  -8.328
  806   3HG2  THR  51          3HG2      THR  51   7.166  -7.124  -6.610
  807    H    PHE  52           H        PHE  52   4.023  -8.273  -6.433
  808    HA   PHE  52           HA       PHE  52   2.231  -8.418  -8.772
  809   1HB   PHE  52          2HB       PHE  52   1.448  -7.857  -5.904
  810   2HB   PHE  52          1HB       PHE  52   0.361  -8.086  -7.268
  811    HD1  PHE  52           1HD      PHE  52  -0.687 -10.111  -7.419
  812    HD2  PHE  52           2HD      PHE  52   3.143  -9.916  -5.574
  813    HE1  PHE  52           1HE      PHE  52  -0.817 -12.514  -6.902
  814    HE2  PHE  52           2HE      PHE  52   3.022 -12.317  -5.060
  815    HZ   PHE  52           HZ       PHE  52   1.041 -13.619  -5.724
  816    H    THR  53           H        THR  53   1.390  -6.506  -9.589
  817    HA   THR  53           HA       THR  53   2.390  -4.037  -8.339
  818    HB   THR  53           HB       THR  53   2.152  -3.118 -10.767
  819    HG1  THR  53           1HG      THR  53   2.608  -5.854 -11.316
  820   1HG2  THR  53          1HG2      THR  53   4.313  -2.972 -10.194
  821   2HG2  THR  53          2HG2      THR  53   4.468  -4.345 -11.296
  822   3HG2  THR  53          3HG2      THR  53   4.372  -4.619  -9.556
  823    H    VAL  54           H        VAL  54   0.921  -2.690  -7.655
  824    HA   VAL  54           HA       VAL  54  -1.851  -2.994  -8.584
  825    HB   VAL  54           HB       VAL  54  -0.829  -1.567  -6.116
  826   1HG1  VAL  54          1HG1      VAL  54  -3.636  -2.401  -6.246
  827   2HG1  VAL  54          2HG1      VAL  54  -3.196  -1.147  -7.405
  828   3HG1  VAL  54          3HG1      VAL  54  -2.922  -0.889  -5.682
  829   1HG2  VAL  54          1HG2      VAL  54  -2.257  -3.644  -5.170
  830   2HG2  VAL  54          2HG2      VAL  54  -0.511  -3.690  -5.420
  831   3HG2  VAL  54          3HG2      VAL  54  -1.594  -4.368  -6.636
  832    H    THR  55           H        THR  55  -2.239  -1.670 -10.257
  833    HA   THR  55           HA       THR  55  -1.016   0.986 -10.255
  834    HB   THR  55           HB       THR  55  -2.524  -0.332 -12.509
  835    HG1  THR  55           1HG      THR  55   0.281  -0.234 -12.104
  836   1HG2  THR  55          1HG2      THR  55  -1.074   1.196 -13.879
  837   2HG2  THR  55          2HG2      THR  55  -0.665   2.023 -12.375
  838   3HG2  THR  55          3HG2      THR  55  -2.338   1.984 -12.935
  839    H    GLU  56           H        GLU  56  -2.150   2.567  -9.385
  840    HA   GLU  56           HA       GLU  56  -4.924   2.430  -8.872
  841   1HB   GLU  56          2HB       GLU  56  -3.408   3.801  -7.528
  842   2HB   GLU  56          1HB       GLU  56  -3.077   4.824  -8.919
  843   1HG   GLU  56          2HG       GLU  56  -5.416   5.531  -8.955
  844   2HG   GLU  56          1HG       GLU  56  -5.743   4.507  -7.558
  Start of MODEL    4
    1   1H    MET   1          1HT       MET   1   6.259 -19.830   2.214
    2   2H    MET   1          2HT       MET   1   5.096 -19.060   1.257
    3   3H    MET   1          3HT       MET   1   5.491 -18.432   2.776
    4    HA   MET   1           HA       MET   1   7.865 -18.268   1.822
    5   1HB   MET   1          2HB       MET   1   7.276 -19.537  -0.213
    6   2HB   MET   1          1HB       MET   1   6.135 -18.278  -0.664
    7   1HG   MET   1          2HG       MET   1   7.913 -16.694  -0.960
    8   2HG   MET   1          1HG       MET   1   9.096 -17.848  -0.346
    9   1HE   MET   1          1HE       MET   1   6.072 -18.648  -2.696
   10   2HE   MET   1          2HE       MET   1   6.794 -18.478  -4.297
   11   3HE   MET   1          3HE       MET   1   6.570 -17.057  -3.273
   12    H    GLN   2           H        GLN   2   8.452 -16.093   0.865
   13    HA   GLN   2           HA       GLN   2   6.502 -14.108   1.788
   14   1HB   GLN   2          2HB       GLN   2   8.688 -14.028   2.890
   15   2HB   GLN   2          1HB       GLN   2   9.483 -13.860   1.331
   16   1HG   GLN   2          2HG       GLN   2   8.366 -11.711   0.996
   17   2HG   GLN   2          1HG       GLN   2   7.582 -11.879   2.566
   18   1HE2  GLN   2          1HE2      GLN   2   8.505 -10.730   4.089
   19   2HE2  GLN   2          2HE2      GLN   2  10.187 -10.362   4.220
   20    H    TYR   3           H        TYR   3   5.811 -12.457   0.479
   21    HA   TYR   3           HA       TYR   3   6.758 -12.503  -2.307
   22   1HB   TYR   3          2HB       TYR   3   3.911 -12.199  -1.331
   23   2HB   TYR   3          1HB       TYR   3   4.425 -11.955  -2.999
   24    HD1  TYR   3           1HD      TYR   3   4.097 -13.720  -4.440
   25    HD2  TYR   3           2HD      TYR   3   4.774 -14.551  -0.323
   26    HE1  TYR   3           1HE      TYR   3   3.822 -16.122  -4.885
   27    HE2  TYR   3           2HE      TYR   3   4.500 -16.956  -0.757
   28    HH   TYR   3           HH       TYR   3   3.413 -18.157  -3.849
   29    H    LYS   4           H        LYS   4   6.879 -10.529  -3.373
   30    HA   LYS   4           HA       LYS   4   6.783  -8.202  -1.571
   31   1HB   LYS   4          2HB       LYS   4   8.958  -8.968  -2.732
   32   2HB   LYS   4          1HB       LYS   4   8.249  -8.306  -4.197
   33   1HG   LYS   4          2HG       LYS   4   8.121  -6.113  -3.184
   34   2HG   LYS   4          1HG       LYS   4   8.736  -6.758  -1.661
   35   1HD   LYS   4          2HD       LYS   4  10.775  -7.510  -2.993
   36   2HD   LYS   4          1HD       LYS   4  10.175  -6.470  -4.286
   37   1HE   LYS   4          2HE       LYS   4  10.911  -5.628  -1.486
   38   2HE   LYS   4          1HE       LYS   4  11.810  -5.277  -2.961
   39   1HZ   LYS   4          1HZ       LYS   4   9.400  -4.039  -1.918
   40   2HZ   LYS   4          2HZ       LYS   4   9.438  -4.276  -3.592
   41   3HZ   LYS   4          3HZ       LYS   4  10.651  -3.370  -2.839
   42    H    VAL   5           H        VAL   5   4.920  -7.134  -1.803
   43    HA   VAL   5           HA       VAL   5   3.652  -6.997  -4.426
   44    HB   VAL   5           HB       VAL   5   2.620  -6.076  -1.742
   45   1HG1  VAL   5          1HG1      VAL   5   1.755  -5.371  -4.306
   46   2HG1  VAL   5          2HG1      VAL   5   0.895  -5.137  -2.784
   47   3HG1  VAL   5          3HG1      VAL   5   0.614  -6.593  -3.740
   48   1HG2  VAL   5          1HG2      VAL   5   1.128  -8.235  -2.802
   49   2HG2  VAL   5          2HG2      VAL   5   2.107  -8.195  -1.336
   50   3HG2  VAL   5          3HG2      VAL   5   2.834  -8.680  -2.867
   51    H    ILE   6           H        ILE   6   4.071  -5.400  -5.693
   52    HA   ILE   6           HA       ILE   6   5.120  -2.875  -4.658
   53    HB   ILE   6           HB       ILE   6   4.979  -3.995  -7.459
   54   1HG1  ILE   6          2HG1      ILE   6   7.335  -3.405  -5.662
   55   2HG1  ILE   6          1HG1      ILE   6   6.640  -5.000  -5.913
   56   1HG2  ILE   6          1HG2      ILE   6   6.665  -1.644  -7.014
   57   2HG2  ILE   6          2HG2      ILE   6   4.935  -1.329  -6.904
   58   3HG2  ILE   6          3HG2      ILE   6   5.607  -2.051  -8.366
   59   1HD1  ILE   6          1HD1      ILE   6   8.204  -3.301  -7.805
   60   2HD1  ILE   6          2HD1      ILE   6   7.127  -4.563  -8.406
   61   3HD1  ILE   6          3HD1      ILE   6   8.462  -4.981  -7.333
   62    H    LEU   7           H        LEU   7   3.996  -1.021  -4.647
   63    HA   LEU   7           HA       LEU   7   1.315  -1.040  -5.868
   64   1HB   LEU   7          2HB       LEU   7   2.176   0.794  -3.649
   65   2HB   LEU   7          1HB       LEU   7   0.552   0.306  -4.098
   66    HG   LEU   7           HG       LEU   7   2.614  -1.445  -2.772
   67   1HD1  LEU   7          1HD1      LEU   7   1.577   0.350  -1.372
   68   2HD1  LEU   7          2HD1      LEU   7   1.269  -1.295  -0.816
   69   3HD1  LEU   7          3HD1      LEU   7   0.012  -0.403  -1.677
   70   1HD2  LEU   7          1HD2      LEU   7   0.948  -3.148  -2.704
   71   2HD2  LEU   7          2HD2      LEU   7   1.085  -2.606  -4.376
   72   3HD2  LEU   7          3HD2      LEU   7  -0.269  -2.067  -3.382
   73    H    ASN   8           H        ASN   8   1.451  -0.008  -7.797
   74    HA   ASN   8           HA       ASN   8   2.993   2.498  -7.925
   75   1HB   ASN   8          2HB       ASN   8   2.135   0.693 -10.191
   76   2HB   ASN   8          1HB       ASN   8   3.117   2.147 -10.342
   77   1HD2  ASN   8          1HD2      ASN   8   5.195   1.789 -10.526
   78   2HD2  ASN   8          2HD2      ASN   8   6.060   0.441  -9.878
   79    H    GLY   9           H        GLY   9   1.703   4.230  -7.659
   80   1HA   GLY   9          2HA       GLY   9  -0.922   4.182  -9.016
   81   2HA   GLY   9          1HA       GLY   9  -0.607   5.068  -7.533
   82    H    LYS  10           H        LYS  10  -1.601   6.796  -8.905
   83    HA   LYS  10           HA       LYS  10  -0.030   7.895 -11.038
   84   1HB   LYS  10          2HB       LYS  10  -2.324   9.104  -9.480
   85   2HB   LYS  10          1HB       LYS  10  -1.645   9.753 -10.966
   86   1HG   LYS  10          2HG       LYS  10  -2.340   7.746 -12.167
   87   2HG   LYS  10          1HG       LYS  10  -3.012   7.086 -10.676
   88   1HD   LYS  10          2HD       LYS  10  -3.902   9.631 -12.034
   89   2HD   LYS  10          1HD       LYS  10  -4.751   8.085 -12.088
   90   1HE   LYS  10          2HE       LYS  10  -5.024   8.162  -9.650
   91   2HE   LYS  10          1HE       LYS  10  -4.195   9.718  -9.612
   92   1HZ   LYS  10          1HZ       LYS  10  -6.066  10.322 -11.330
   93   2HZ   LYS  10          2HZ       LYS  10  -6.349  10.405  -9.664
   94   3HZ   LYS  10          3HZ       LYS  10  -6.891   9.069 -10.547
   95    H    THR  11           H        THR  11  -0.855   9.052  -7.762
   96    HA   THR  11           HA       THR  11   1.495  10.797  -7.841
   97    HB   THR  11           HB       THR  11   0.259  11.817  -5.813
   98    HG1  THR  11           1HG      THR  11  -1.934  10.526  -7.039
   99   1HG2  THR  11          1HG2      THR  11  -1.585  12.435  -7.903
  100   2HG2  THR  11          2HG2      THR  11   0.054  12.355  -8.551
  101   3HG2  THR  11          3HG2      THR  11  -0.310  13.434  -7.204
  102    H    LEU  12           H        LEU  12   0.864   7.796  -6.884
  103    HA   LEU  12           HA       LEU  12   2.647   8.035  -4.584
  104   1HB   LEU  12          2HB       LEU  12   0.396   7.911  -3.678
  105   2HB   LEU  12          1HB       LEU  12   0.083   6.454  -4.602
  106    HG   LEU  12           HG       LEU  12   1.679   5.213  -3.293
  107   1HD1  LEU  12          1HD1      LEU  12   2.405   6.866  -1.197
  108   2HD1  LEU  12          2HD1      LEU  12   2.599   7.871  -2.632
  109   3HD1  LEU  12          3HD1      LEU  12   3.440   6.334  -2.523
  110   1HD2  LEU  12          1HD2      LEU  12   0.182   4.874  -1.681
  111   2HD2  LEU  12          2HD2      LEU  12  -0.703   6.261  -2.317
  112   3HD2  LEU  12          3HD2      LEU  12   0.451   6.479  -1.002
  113    H    LYS  13           H        LYS  13   4.120   6.470  -4.374
  114    HA   LYS  13           HA       LYS  13   3.889   4.016  -5.926
  115   1HB   LYS  13          2HB       LYS  13   6.338   5.774  -6.148
  116   2HB   LYS  13          1HB       LYS  13   6.056   4.247  -6.972
  117   1HG   LYS  13          2HG       LYS  13   5.580   5.719  -8.647
  118   2HG   LYS  13          1HG       LYS  13   3.977   5.509  -7.940
  119   1HD   LYS  13          2HD       LYS  13   4.297   7.553  -6.623
  120   2HD   LYS  13          1HD       LYS  13   5.889   7.765  -7.348
  121   1HE   LYS  13          2HE       LYS  13   4.865   7.961  -9.554
  122   2HE   LYS  13          1HE       LYS  13   3.270   7.724  -8.843
  123   1HZ   LYS  13          1HZ       LYS  13   4.962  10.080  -8.853
  124   2HZ   LYS  13          2HZ       LYS  13   4.163   9.770  -7.396
  125   3HZ   LYS  13          3HZ       LYS  13   3.274   9.957  -8.822
  126    H    GLY  14           H        GLY  14   5.098   2.299  -5.083
  127   1HA   GLY  14          2HA       GLY  14   7.124   2.554  -3.154
  128   2HA   GLY  14          1HA       GLY  14   5.590   2.381  -2.318
  129    H    GLU  15           H        GLU  15   6.770   0.452  -1.503
  130    HA   GLU  15           HA       GLU  15   5.933  -1.852  -3.050
  131   1HB   GLU  15          2HB       GLU  15   8.797  -1.586  -2.114
  132   2HB   GLU  15          1HB       GLU  15   8.089  -2.969  -2.939
  133   1HG   GLU  15          2HG       GLU  15   7.694  -1.579  -4.916
  134   2HG   GLU  15          1HG       GLU  15   8.433  -0.209  -4.090
  135    H    THR  16           H        THR  16   5.565  -3.677  -1.810
  136    HA   THR  16           HA       THR  16   6.089  -3.529   1.055
  137    HB   THR  16           HB       THR  16   3.961  -2.628   1.151
  138    HG1  THR  16           1HG      THR  16   3.376  -5.375   1.095
  139   1HG2  THR  16          1HG2      THR  16   3.066  -4.471  -1.045
  140   2HG2  THR  16          2HG2      THR  16   3.366  -2.741  -1.195
  141   3HG2  THR  16          3HG2      THR  16   2.046  -3.324  -0.180
  142    H    THR  17           H        THR  17   5.375  -5.673   2.152
  143    HA   THR  17           HA       THR  17   5.640  -7.937   0.308
  144    HB   THR  17           HB       THR  17   7.370  -8.942   1.805
  145    HG1  THR  17           1HG      THR  17   8.443  -7.529   3.219
  146   1HG2  THR  17          1HG2      THR  17   9.247  -7.420   1.128
  147   2HG2  THR  17          2HG2      THR  17   8.025  -6.360   0.425
  148   3HG2  THR  17          3HG2      THR  17   8.222  -8.004  -0.183
  149    H    THR  18           H        THR  18   4.137  -9.375   0.714
  150    HA   THR  18           HA       THR  18   3.042  -9.654   3.446
  151    HB   THR  18           HB       THR  18   1.430  -9.050   1.644
  152    HG1  THR  18           1HG      THR  18   0.807 -10.343   3.459
  153   1HG2  THR  18          1HG2      THR  18   2.170 -11.727   0.495
  154   2HG2  THR  18          2HG2      THR  18   2.344 -10.149  -0.275
  155   3HG2  THR  18          3HG2      THR  18   0.738 -10.799   0.050
  156    H    GLU  19           H        GLU  19   2.977 -11.667   4.410
  157    HA   GLU  19           HA       GLU  19   4.621 -13.753   3.140
  158   1HB   GLU  19          2HB       GLU  19   5.409 -13.024   5.321
  159   2HB   GLU  19          1HB       GLU  19   3.826 -13.303   6.028
  160   1HG   GLU  19          2HG       GLU  19   5.336 -15.071   6.645
  161   2HG   GLU  19          1HG       GLU  19   4.068 -15.702   5.597
  162    H    ALA  20           H        ALA  20   3.442 -15.277   2.082
  163    HA   ALA  20           HA       ALA  20   1.159 -16.442   3.471
  164   1HB   ALA  20          1HB       ALA  20   0.546 -14.521   1.782
  165   2HB   ALA  20          2HB       ALA  20  -0.428 -15.987   1.894
  166   3HB   ALA  20          3HB       ALA  20   0.751 -15.809   0.595
  167    H    VAL  21           H        VAL  21   0.616 -18.497   2.830
  168    HA   VAL  21           HA       VAL  21   2.623 -20.260   2.204
  169    HB   VAL  21           HB       VAL  21  -0.277 -20.742   1.534
  170   1HG1  VAL  21          1HG1      VAL  21   1.444 -22.412   0.778
  171   2HG1  VAL  21          2HG1      VAL  21   0.194 -23.048   1.849
  172   3HG1  VAL  21          3HG1      VAL  21   1.805 -22.699   2.480
  173   1HG2  VAL  21          1HG2      VAL  21  -0.235 -21.742   3.919
  174   2HG2  VAL  21          2HG2      VAL  21  -0.410 -19.996   3.724
  175   3HG2  VAL  21          3HG2      VAL  21   1.155 -20.683   4.161
  176    H    ASP  22           H        ASP  22   0.662 -18.435  -0.019
  177    HA   ASP  22           HA       ASP  22   2.368 -19.268  -2.201
  178   1HB   ASP  22          2HB       ASP  22   0.590 -20.056  -3.668
  179   2HB   ASP  22          1HB       ASP  22   0.657 -21.037  -2.208
  180    H    ALA  23           H        ALA  23   1.467 -18.220  -4.350
  181    HA   ALA  23           HA       ALA  23   1.577 -15.450  -3.978
  182   1HB   ALA  23          1HB       ALA  23   2.265 -15.878  -6.080
  183   2HB   ALA  23          2HB       ALA  23   0.564 -15.636  -6.474
  184   3HB   ALA  23          3HB       ALA  23   1.193 -17.268  -6.256
  185    H    ALA  24           H        ALA  24  -1.175 -17.577  -4.612
  186    HA   ALA  24           HA       ALA  24  -3.110 -15.547  -4.881
  187   1HB   ALA  24          1HB       ALA  24  -3.160 -18.465  -4.354
  188   2HB   ALA  24          2HB       ALA  24  -4.000 -17.523  -5.584
  189   3HB   ALA  24          3HB       ALA  24  -4.606 -17.552  -3.928
  190    H    THR  25           H        THR  25  -2.269 -17.560  -2.058
  191    HA   THR  25           HA       THR  25  -3.907 -16.351  -0.190
  192    HB   THR  25           HB       THR  25  -2.218 -17.116   1.480
  193    HG1  THR  25           1HG      THR  25  -0.704 -17.438  -0.848
  194   1HG2  THR  25          1HG2      THR  25  -2.119 -19.535   0.762
  195   2HG2  THR  25          2HG2      THR  25  -2.986 -19.030  -0.687
  196   3HG2  THR  25          3HG2      THR  25  -3.721 -18.812   0.901
  197    H    ALA  26           H        ALA  26  -0.628 -15.498  -1.222
  198    HA   ALA  26           HA       ALA  26  -0.271 -13.281   0.472
  199   1HB   ALA  26          1HB       ALA  26   1.685 -13.988  -0.572
  200   2HB   ALA  26          2HB       ALA  26   1.285 -12.522  -1.468
  201   3HB   ALA  26          3HB       ALA  26   0.916 -14.104  -2.155
  202    H    GLU  27           H        GLU  27  -1.324 -13.455  -2.940
  203    HA   GLU  27           HA       GLU  27  -1.937 -10.841  -3.412
  204   1HB   GLU  27          2HB       GLU  27  -2.033 -12.554  -5.127
  205   2HB   GLU  27          1HB       GLU  27  -3.392 -13.324  -4.326
  206   1HG   GLU  27          2HG       GLU  27  -3.536 -10.515  -5.365
  207   2HG   GLU  27          1HG       GLU  27  -3.886 -11.917  -6.375
  208    H    LYS  28           H        LYS  28  -4.063 -13.312  -1.987
  209    HA   LYS  28           HA       LYS  28  -6.277 -11.622  -1.578
  210   1HB   LYS  28          2HB       LYS  28  -5.443 -14.106  -0.070
  211   2HB   LYS  28          1HB       LYS  28  -7.019 -13.341   0.059
  212   1HG   LYS  28          2HG       LYS  28  -5.825 -14.627  -2.384
  213   2HG   LYS  28          1HG       LYS  28  -7.170 -15.226  -1.415
  214   1HD   LYS  28          2HD       LYS  28  -7.229 -12.578  -2.853
  215   2HD   LYS  28          1HD       LYS  28  -7.782 -14.084  -3.584
  216   1HE   LYS  28          2HE       LYS  28  -9.688 -12.954  -2.697
  217   2HE   LYS  28          1HE       LYS  28  -9.362 -14.351  -1.673
  218   1HZ   LYS  28          1HZ       LYS  28  -8.936 -13.057   0.080
  219   2HZ   LYS  28          2HZ       LYS  28  -9.757 -11.852  -0.776
  220   3HZ   LYS  28          3HZ       LYS  28  -8.067 -11.916  -0.820
  221    H    VAL  29           H        VAL  29  -3.542 -12.485   0.496
  222    HA   VAL  29           HA       VAL  29  -4.331 -11.165   2.817
  223    HB   VAL  29           HB       VAL  29  -1.538 -11.522   1.707
  224   1HG1  VAL  29          1HG1      VAL  29  -2.538 -10.396   4.270
  225   2HG1  VAL  29          2HG1      VAL  29  -1.143  -9.930   3.299
  226   3HG1  VAL  29          3HG1      VAL  29  -1.076 -11.380   4.297
  227   1HG2  VAL  29          1HG2      VAL  29  -3.308 -13.446   2.540
  228   2HG2  VAL  29          2HG2      VAL  29  -2.363 -13.138   3.995
  229   3HG2  VAL  29          3HG2      VAL  29  -1.553 -13.614   2.502
  230    H    VAL  30           H        VAL  30  -2.740  -9.985  -0.084
  231    HA   VAL  30           HA       VAL  30  -2.246  -7.355   0.844
  232    HB   VAL  30           HB       VAL  30  -2.651  -8.324  -1.992
  233   1HG1  VAL  30          1HG1      VAL  30  -2.064  -6.292  -2.759
  234   2HG1  VAL  30          2HG1      VAL  30  -0.906  -6.021  -1.457
  235   3HG1  VAL  30          3HG1      VAL  30  -2.624  -5.739  -1.181
  236   1HG2  VAL  30          1HG2      VAL  30   0.056  -7.748  -1.009
  237   2HG2  VAL  30          2HG2      VAL  30  -0.525  -9.054  -2.043
  238   3HG2  VAL  30          3HG2      VAL  30  -0.719  -9.162  -0.294
  239    H    LYS  31           H        LYS  31  -4.877  -8.782  -1.119
  240    HA   LYS  31           HA       LYS  31  -6.399  -6.507  -1.492
  241   1HB   LYS  31          2HB       LYS  31  -7.143  -9.391  -1.225
  242   2HB   LYS  31          1HB       LYS  31  -8.396  -8.165  -1.370
  243   1HG   LYS  31          2HG       LYS  31  -7.383  -7.414  -3.479
  244   2HG   LYS  31          1HG       LYS  31  -6.194  -8.711  -3.343
  245   1HD   LYS  31          2HD       LYS  31  -7.892 -10.380  -3.514
  246   2HD   LYS  31          1HD       LYS  31  -9.171  -9.172  -3.369
  247   1HE   LYS  31          2HE       LYS  31  -8.488  -8.194  -5.505
  248   2HE   LYS  31          1HE       LYS  31  -7.200  -9.386  -5.648
  249   1HZ   LYS  31          1HZ       LYS  31  -8.990 -11.114  -5.563
  250   2HZ   LYS  31          2HZ       LYS  31  -8.996 -10.147  -6.951
  251   3HZ   LYS  31          3HZ       LYS  31 -10.123  -9.867  -5.722
  252    H    GLN  32           H        GLN  32  -6.372  -8.724   1.262
  253    HA   GLN  32           HA       GLN  32  -8.463  -7.461   2.680
  254   1HB   GLN  32          2HB       GLN  32  -7.323  -9.759   3.106
  255   2HB   GLN  32          1HB       GLN  32  -6.150  -8.833   4.034
  256   1HG   GLN  32          2HG       GLN  32  -7.762  -9.638   5.563
  257   2HG   GLN  32          1HG       GLN  32  -8.069  -7.913   5.356
  258   1HE2  GLN  32          1HE2      GLN  32  -9.985  -7.247   4.541
  259   2HE2  GLN  32          2HE2      GLN  32 -11.269  -8.307   4.080
  260    H    PHE  33           H        PHE  33  -5.003  -7.001   2.517
  261    HA   PHE  33           HA       PHE  33  -4.544  -5.210   4.577
  262   1HB   PHE  33          2HB       PHE  33  -2.853  -6.316   3.057
  263   2HB   PHE  33          1HB       PHE  33  -3.267  -5.127   1.832
  264    HD1  PHE  33           1HD      PHE  33  -2.071  -5.387   5.338
  265    HD2  PHE  33           2HD      PHE  33  -2.054  -3.151   1.701
  266    HE1  PHE  33           1HE      PHE  33  -0.389  -3.856   6.275
  267    HE2  PHE  33           2HE      PHE  33  -0.373  -1.629   2.649
  268    HZ   PHE  33           HZ       PHE  33   0.460  -1.985   4.940
  269    H    PHE  34           H        PHE  34  -5.088  -4.395   1.179
  270    HA   PHE  34           HA       PHE  34  -5.543  -1.620   1.661
  271   1HB   PHE  34          2HB       PHE  34  -6.209  -3.291  -0.767
  272   2HB   PHE  34          1HB       PHE  34  -6.195  -1.526  -0.707
  273    HD1  PHE  34           1HD      PHE  34  -3.875  -0.843   0.771
  274    HD2  PHE  34           2HD      PHE  34  -4.404  -4.006  -2.019
  275    HE1  PHE  34           1HE      PHE  34  -1.456  -0.863   0.346
  276    HE2  PHE  34           2HE      PHE  34  -1.987  -4.025  -2.462
  277    HZ   PHE  34           HZ       PHE  34  -0.516  -2.458  -1.261
  278    H    ASN  35           H        ASN  35  -7.668  -4.383   1.218
  279    HA   ASN  35           HA       ASN  35 -10.130  -3.155   0.997
  280   1HB   ASN  35          2HB       ASN  35  -9.825  -5.582   0.869
  281   2HB   ASN  35          1HB       ASN  35  -9.401  -5.635   2.576
  282   1HD2  ASN  35          1HD2      ASN  35 -11.689  -6.515   0.636
  283   2HD2  ASN  35          2HD2      ASN  35 -13.102  -6.238   1.588
  284    H    ASP  36           H        ASP  36  -8.164  -3.744   3.817
  285    HA   ASP  36           HA       ASP  36 -10.112  -2.469   5.579
  286   1HB   ASP  36          2HB       ASP  36  -7.514  -3.879   6.193
  287   2HB   ASP  36          1HB       ASP  36  -8.586  -3.190   7.407
  288    H    ASN  37           H        ASN  37  -7.102  -1.708   4.001
  289    HA   ASN  37           HA       ASN  37  -6.475   0.468   5.800
  290   1HB   ASN  37          2HB       ASN  37  -5.347  -0.245   3.081
  291   2HB   ASN  37          1HB       ASN  37  -4.762   1.080   4.079
  292   1HD2  ASN  37          1HD2      ASN  37  -3.622  -1.557   3.069
  293   2HD2  ASN  37          2HD2      ASN  37  -2.923  -2.257   4.487
  294    H    GLY  38           H        GLY  38  -7.735   0.079   2.545
  295   1HA   GLY  38          2HA       GLY  38  -8.170   2.105   1.174
  296   2HA   GLY  38          1HA       GLY  38  -9.630   1.388   1.818
  297    H    VAL  39           H        VAL  39 -11.001   2.754   2.673
  298    HA   VAL  39           HA       VAL  39 -10.027   5.407   3.485
  299    HB   VAL  39           HB       VAL  39 -12.827   4.589   2.786
  300   1HG1  VAL  39          1HG1      VAL  39 -12.840   7.159   2.253
  301   2HG1  VAL  39          2HG1      VAL  39 -11.494   7.187   3.390
  302   3HG1  VAL  39          3HG1      VAL  39 -13.070   6.583   3.904
  303   1HG2  VAL  39          1HG2      VAL  39 -12.457   5.455   0.572
  304   2HG2  VAL  39          2HG2      VAL  39 -11.241   4.225   0.912
  305   3HG2  VAL  39          3HG2      VAL  39 -10.812   5.934   0.993
  306    H    ASP  40           H        ASP  40 -10.863   2.652   5.141
  307    HA   ASP  40           HA       ASP  40 -12.053   4.261   7.293
  308   1HB   ASP  40          2HB       ASP  40 -12.712   1.399   6.570
  309   2HB   ASP  40          1HB       ASP  40 -13.323   2.254   7.985
  310    H    GLY  41           H        GLY  41  -9.245   3.040   6.518
  311   1HA   GLY  41          2HA       GLY  41  -8.696   1.295   8.741
  312   2HA   GLY  41          1HA       GLY  41  -7.524   1.930   7.600
  313    H    GLU  42           H        GLU  42  -6.782   1.736  10.164
  314    HA   GLU  42           HA       GLU  42  -7.151   4.334  11.452
  315   1HB   GLU  42          2HB       GLU  42  -5.656   1.873  12.386
  316   2HB   GLU  42          1HB       GLU  42  -5.909   3.333  13.333
  317   1HG   GLU  42          2HG       GLU  42  -8.321   2.953  13.275
  318   2HG   GLU  42          1HG       GLU  42  -8.065   1.486  12.331
  319    H    TRP  43           H        TRP  43  -5.951   5.817  10.361
  320    HA   TRP  43           HA       TRP  43  -3.186   5.174   9.673
  321   1HB   TRP  43          2HB       TRP  43  -4.928   7.520   8.929
  322   2HB   TRP  43          1HB       TRP  43  -3.274   7.282   8.379
  323    HD1  TRP  43           HD       TRP  43  -5.709   4.319   8.458
  324    HE1  TRP  43           1HE      TRP  43  -6.183   3.607   6.028
  325    HE3  TRP  43           3HE      TRP  43  -3.367   8.144   6.022
  326    HZ2  TRP  43           2HZ      TRP  43  -5.633   4.543   3.429
  327    HZ3  TRP  43           3HZ      TRP  43  -3.388   8.166   3.567
  328    HH2  TRP  43           HH       TRP  43  -4.496   6.399   2.296
  329    H    THR  44           H        THR  44  -1.564   5.782  10.925
  330    HA   THR  44           HA       THR  44  -1.929   8.096  12.710
  331    HB   THR  44           HB       THR  44  -0.074   7.112  14.050
  332    HG1  THR  44           1HG      THR  44  -0.376   4.893  12.312
  333   1HG2  THR  44          1HG2      THR  44  -2.241   5.071  13.657
  334   2HG2  THR  44          2HG2      THR  44  -2.453   6.564  14.573
  335   3HG2  THR  44          3HG2      THR  44  -1.274   5.364  15.102
  336    H    TYR  45           H        TYR  45  -0.487   9.794  12.563
  337    HA   TYR  45           HA       TYR  45   1.509   9.579  10.404
  338   1HB   TYR  45          2HB       TYR  45  -0.361  11.165  10.001
  339   2HB   TYR  45          1HB       TYR  45   0.132  12.069  11.429
  340    HD1  TYR  45           1HD      TYR  45   2.477  10.575   8.988
  341    HD2  TYR  45           2HD      TYR  45   0.593  14.137  10.355
  342    HE1  TYR  45           1HE      TYR  45   4.006  11.908   7.601
  343    HE2  TYR  45           2HE      TYR  45   2.117  15.481   8.970
  344    HH   TYR  45           HH       TYR  45   4.160  15.377   7.838
  345    H    ASP  46           H        ASP  46   3.574  10.366  10.687
  346    HA   ASP  46           HA       ASP  46   4.297  11.195  13.419
  347   1HB   ASP  46          2HB       ASP  46   5.033   8.888  12.999
  348   2HB   ASP  46          1HB       ASP  46   5.896   9.418  11.559
  349    H    ASP  47           H        ASP  47   4.139  13.387  12.696
  350    HA   ASP  47           HA       ASP  47   5.274  14.585  10.522
  351   1HB   ASP  47          2HB       ASP  47   5.253  15.700  13.334
  352   2HB   ASP  47          1HB       ASP  47   5.422  16.641  11.856
  353    H    ALA  48           H        ALA  48   6.909  13.513  13.440
  354    HA   ALA  48           HA       ALA  48   9.321  14.796  13.270
  355   1HB   ALA  48          1HB       ALA  48   9.504  11.933  13.935
  356   2HB   ALA  48          2HB       ALA  48   8.334  12.874  14.863
  357   3HB   ALA  48          3HB       ALA  48  10.033  13.350  14.843
  358    H    THR  49           H        THR  49   8.198  12.135  11.273
  359    HA   THR  49           HA       THR  49  10.697  12.370   9.732
  360    HB   THR  49           HB       THR  49  10.562   9.958   9.232
  361    HG1  THR  49           1HG      THR  49   8.218   9.902   9.746
  362   1HG2  THR  49          1HG2      THR  49  11.619   9.250  11.101
  363   2HG2  THR  49          2HG2      THR  49  10.439   9.984  12.186
  364   3HG2  THR  49          3HG2      THR  49  11.664  10.986  11.408
  365    H    LYS  50           H        LYS  50   7.730  13.325   9.524
  366    HA   LYS  50           HA       LYS  50   6.145  13.608   7.885
  367   1HB   LYS  50          2HB       LYS  50   8.668  13.399   6.234
  368   2HB   LYS  50          1HB       LYS  50   7.117  13.896   5.577
  369   1HG   LYS  50          2HG       LYS  50   8.535  15.312   7.820
  370   2HG   LYS  50          1HG       LYS  50   8.638  15.774   6.120
  371   1HD   LYS  50          2HD       LYS  50   6.177  16.055   6.093
  372   2HD   LYS  50          1HD       LYS  50   6.147  15.701   7.822
  373   1HE   LYS  50          2HE       LYS  50   7.587  17.997   6.497
  374   2HE   LYS  50          1HE       LYS  50   6.086  18.105   7.415
  375   1HZ   LYS  50          1HZ       LYS  50   7.621  16.943   9.216
  376   2HZ   LYS  50          2HZ       LYS  50   7.533  18.624   9.053
  377   3HZ   LYS  50          3HZ       LYS  50   8.822  17.775   8.363
  378    H    THR  51           H        THR  51   6.467  10.914   8.780
  379    HA   THR  51           HA       THR  51   5.762   9.462   6.321
  380    HB   THR  51           HB       THR  51   7.206   8.418   8.763
  381    HG1  THR  51           1HG      THR  51   8.531   9.602   7.356
  382   1HG2  THR  51          1HG2      THR  51   7.381   6.635   6.581
  383   2HG2  THR  51          2HG2      THR  51   5.675   6.979   6.864
  384   3HG2  THR  51          3HG2      THR  51   6.679   6.362   8.176
  385    H    PHE  52           H        PHE  52   3.984   8.179   6.346
  386    HA   PHE  52           HA       PHE  52   2.301   8.318   8.759
  387   1HB   PHE  52          2HB       PHE  52   1.465   7.804   5.895
  388   2HB   PHE  52          1HB       PHE  52   0.389   7.992   7.275
  389    HD1  PHE  52           1HD      PHE  52  -0.443  10.082   7.835
  390    HD2  PHE  52           2HD      PHE  52   2.956   9.799   5.289
  391    HE1  PHE  52           1HE      PHE  52  -0.568  12.504   7.403
  392    HE2  PHE  52           2HE      PHE  52   2.839  12.218   4.856
  393    HZ   PHE  52           HZ       PHE  52   1.076  13.573   5.914
  394    H    THR  53           H        THR  53   1.402   6.454   9.606
  395    HA   THR  53           HA       THR  53   2.309   3.934   8.399
  396    HB   THR  53           HB       THR  53   2.020   3.067  10.837
  397    HG1  THR  53           1HG      THR  53   1.830   4.509  12.328
  398   1HG2  THR  53          1HG2      THR  53   4.308   4.582   9.714
  399   2HG2  THR  53          2HG2      THR  53   4.168   2.873  10.127
  400   3HG2  THR  53          3HG2      THR  53   4.362   4.078  11.403
  401    H    VAL  54           H        VAL  54   0.811   2.638   7.707
  402    HA   VAL  54           HA       VAL  54  -1.969   3.047   8.566
  403    HB   VAL  54           HB       VAL  54  -0.915   1.444   6.222
  404   1HG1  VAL  54          1HG1      VAL  54  -3.184   1.266   5.495
  405   2HG1  VAL  54          2HG1      VAL  54  -3.741   2.320   6.795
  406   3HG1  VAL  54          3HG1      VAL  54  -3.109   0.716   7.169
  407   1HG2  VAL  54          1HG2      VAL  54  -1.672   4.288   6.535
  408   2HG2  VAL  54          2HG2      VAL  54  -2.231   3.469   5.076
  409   3HG2  VAL  54          3HG2      VAL  54  -0.508   3.535   5.444
  410    H    THR  55           H        THR  55  -2.055   1.932  10.489
  411    HA   THR  55           HA       THR  55  -0.990  -0.753  10.639
  412    HB   THR  55           HB       THR  55  -2.614   0.666  12.743
  413    HG1  THR  55           1HG      THR  55  -0.783   1.915  12.120
  414   1HG2  THR  55          1HG2      THR  55  -2.357  -1.560  13.396
  415   2HG2  THR  55          2HG2      THR  55  -1.054  -0.703  14.219
  416   3HG2  THR  55          3HG2      THR  55  -0.710  -1.646  12.767
  417    H    GLU  56           H        GLU  56  -2.083  -2.324   9.694
  418    HA   GLU  56           HA       GLU  56  -4.726  -2.387   8.950
  419   1HB   GLU  56          2HB       GLU  56  -3.102  -4.014   8.161
  420   2HB   GLU  56          1HB       GLU  56  -2.953  -4.692   9.776
  421   1HG   GLU  56          2HG       GLU  56  -4.316  -6.109   8.370
  422   2HG   GLU  56          1HG       GLU  56  -5.275  -5.434   9.686
  423   1H    MET   1          1HT       MET   1   6.771  19.725  -2.033
  424   2H    MET   1          2HT       MET   1   5.575  18.984  -1.093
  425   3H    MET   1          3HT       MET   1   5.976  18.346  -2.607
  426    HA   MET   1           HA       MET   1   8.332  18.124  -1.619
  427   1HB   MET   1          2HB       MET   1   7.745  19.405   0.408
  428   2HB   MET   1          1HB       MET   1   6.567  18.177   0.842
  429   1HG   MET   1          2HG       MET   1   8.301  16.550   1.163
  430   2HG   MET   1          1HG       MET   1   9.521  17.673   0.566
  431   1HE   MET   1          1HE       MET   1   6.486  18.548   2.874
  432   2HE   MET   1          2HE       MET   1   7.181  18.361   4.484
  433   3HE   MET   1          3HE       MET   1   6.936  16.946   3.459
  434    H    GLN   2           H        GLN   2   8.851  15.935  -0.654
  435    HA   GLN   2           HA       GLN   2   6.866  13.997  -1.604
  436   1HB   GLN   2          2HB       GLN   2   9.065  13.866  -2.675
  437   2HB   GLN   2          1HB       GLN   2   9.834  13.678  -1.105
  438   1HG   GLN   2          2HG       GLN   2   8.662  11.557  -0.786
  439   2HG   GLN   2          1HG       GLN   2   7.903  11.745  -2.367
  440   1HE2  GLN   2          1HE2      GLN   2   8.819  10.573  -3.877
  441   2HE2  GLN   2          2HE2      GLN   2  10.494  10.164  -3.985
  442    H    TYR   3           H        TYR   3   6.119  12.363  -0.306
  443    HA   TYR   3           HA       TYR   3   7.026  12.389   2.494
  444   1HB   TYR   3          2HB       TYR   3   4.186  12.152   1.478
  445   2HB   TYR   3          1HB       TYR   3   4.670  11.898   3.153
  446    HD1  TYR   3           1HD      TYR   3   4.366  13.670   4.590
  447    HD2  TYR   3           2HD      TYR   3   5.120  14.482   0.481
  448    HE1  TYR   3           1HE      TYR   3   4.144  16.078   5.030
  449    HE2  TYR   3           2HE      TYR   3   4.898  16.895   0.912
  450    HH   TYR   3           HH       TYR   3   3.799  18.122   3.990
  451    H    LYS   4           H        LYS   4   7.086  10.412   3.561
  452    HA   LYS   4           HA       LYS   4   6.956   8.088   1.758
  453   1HB   LYS   4          2HB       LYS   4   9.134   8.800   2.948
  454   2HB   LYS   4          1HB       LYS   4   8.389   8.156   4.404
  455   1HG   LYS   4          2HG       LYS   4   8.222   5.966   3.389
  456   2HG   LYS   4          1HG       LYS   4   8.874   6.597   1.875
  457   1HD   LYS   4          2HD       LYS   4  10.913   7.299   3.237
  458   2HD   LYS   4          1HD       LYS   4  10.269   6.274   4.520
  459   1HE   LYS   4          2HE       LYS   4  11.023   5.414   1.730
  460   2HE   LYS   4          1HE       LYS   4  11.893   5.042   3.217
  461   1HZ   LYS   4          1HZ       LYS   4   9.468   3.862   2.140
  462   2HZ   LYS   4          2HZ       LYS   4   9.488   4.099   3.815
  463   3HZ   LYS   4          3HZ       LYS   4  10.689   3.162   3.079
  464    H    VAL   5           H        VAL   5   5.067   7.066   1.963
  465    HA   VAL   5           HA       VAL   5   3.759   6.960   4.568
  466    HB   VAL   5           HB       VAL   5   2.742   6.063   1.869
  467   1HG1  VAL   5          1HG1      VAL   5   1.825   5.381   4.420
  468   2HG1  VAL   5          2HG1      VAL   5   0.980   5.167   2.887
  469   3HG1  VAL   5          3HG1      VAL   5   0.721   6.628   3.840
  470   1HG2  VAL   5          1HG2      VAL   5   1.288   8.257   2.909
  471   2HG2  VAL   5          2HG2      VAL   5   2.285   8.193   1.456
  472   3HG2  VAL   5          3HG2      VAL   5   3.003   8.662   2.998
  473    H    ILE   6           H        ILE   6   4.120   5.353   5.840
  474    HA   ILE   6           HA       ILE   6   5.122   2.804   4.819
  475    HB   ILE   6           HB       ILE   6   4.968   3.927   7.618
  476   1HG1  ILE   6          2HG1      ILE   6   7.336   3.278   5.853
  477   2HG1  ILE   6          1HG1      ILE   6   6.675   4.891   6.096
  478   1HG2  ILE   6          1HG2      ILE   6   6.603   1.536   7.196
  479   2HG2  ILE   6          2HG2      ILE   6   4.866   1.264   7.063
  480   3HG2  ILE   6          3HG2      ILE   6   5.536   1.968   8.533
  481   1HD1  ILE   6          1HD1      ILE   6   8.172   3.156   8.009
  482   2HD1  ILE   6          2HD1      ILE   6   7.117   4.442   8.595
  483   3HD1  ILE   6          3HD1      ILE   6   8.476   4.828   7.541
  484    H    LEU   7           H        LEU   7   3.952   0.977   4.793
  485    HA   LEU   7           HA       LEU   7   1.256   1.061   5.975
  486   1HB   LEU   7          2HB       LEU   7   2.103  -0.794   3.769
  487   2HB   LEU   7          1HB       LEU   7   0.485  -0.265   4.195
  488    HG   LEU   7           HG       LEU   7   2.609   1.434   2.898
  489   1HD1  LEU   7          1HD1      LEU   7   1.548  -0.335   1.483
  490   2HD1  LEU   7          2HD1      LEU   7   1.288   1.316   0.923
  491   3HD1  LEU   7          3HD1      LEU   7  -0.003   0.455   1.766
  492   1HD2  LEU   7          1HD2      LEU   7   0.986   3.177   2.806
  493   2HD2  LEU   7          2HD2      LEU   7   1.086   2.633   4.480
  494   3HD2  LEU   7          3HD2      LEU   7  -0.267   2.126   3.468
  495    H    ASN   8           H        ASN   8   1.340   0.027   7.906
  496    HA   ASN   8           HA       ASN   8   2.818  -2.517   8.056
  497   1HB   ASN   8          2HB       ASN   8   1.974  -0.691  10.309
  498   2HB   ASN   8          1HB       ASN   8   2.918  -2.170  10.474
  499   1HD2  ASN   8          1HD2      ASN   8   5.001  -1.860  10.687
  500   2HD2  ASN   8          2HD2      ASN   8   5.906  -0.533  10.053
  501    H    GLY   9           H        GLY   9   1.492  -4.216   7.771
  502   1HA   GLY   9          2HA       GLY   9  -1.150  -4.104   9.091
  503   2HA   GLY   9          1HA       GLY   9  -0.836  -4.998   7.612
  504    H    LYS  10           H        LYS  10  -1.891  -6.700   8.971
  505    HA   LYS  10           HA       LYS  10  -0.378  -7.837  11.123
  506   1HB   LYS  10          2HB       LYS  10  -2.679  -8.990   9.534
  507   2HB   LYS  10          1HB       LYS  10  -2.037  -9.655  11.029
  508   1HG   LYS  10          2HG       LYS  10  -2.700  -7.632  12.220
  509   2HG   LYS  10          1HG       LYS  10  -3.335  -6.956  10.720
  510   1HD   LYS  10          2HD       LYS  10  -4.304  -9.478  12.065
  511   2HD   LYS  10          1HD       LYS  10  -5.115  -7.911  12.108
  512   1HE   LYS  10          2HE       LYS  10  -5.356  -7.982   9.667
  513   2HE   LYS  10          1HE       LYS  10  -4.566  -9.559   9.640
  514   1HZ   LYS  10          1HZ       LYS  10  -6.474 -10.117  11.331
  515   2HZ   LYS  10          2HZ       LYS  10  -6.735 -10.193   9.662
  516   3HZ   LYS  10          3HZ       LYS  10  -7.258  -8.844  10.539
  517    H    THR  11           H        THR  11  -1.183  -8.973   7.837
  518    HA   THR  11           HA       THR  11   1.121 -10.775   7.949
  519    HB   THR  11           HB       THR  11  -0.109 -11.766   5.905
  520    HG1  THR  11           1HG      THR  11  -2.288 -10.421   7.098
  521   1HG2  THR  11          1HG2      THR  11  -1.998 -12.338   7.967
  522   2HG2  THR  11          2HG2      THR  11  -0.367 -12.297   8.638
  523   3HG2  THR  11          3HG2      THR  11  -0.738 -13.368   7.287
  524    H    LEU  12           H        LEU  12   0.577  -7.761   6.983
  525    HA   LEU  12           HA       LEU  12   2.387  -8.043   4.708
  526   1HB   LEU  12          2HB       LEU  12   0.151  -7.864   3.771
  527   2HB   LEU  12          1HB       LEU  12  -0.138  -6.399   4.692
  528    HG   LEU  12           HG       LEU  12   1.507  -5.199   3.405
  529   1HD1  LEU  12          1HD1      LEU  12   2.219  -6.871   1.319
  530   2HD1  LEU  12          2HD1      LEU  12   2.369  -7.879   2.756
  531   3HD1  LEU  12          3HD1      LEU  12   3.249  -6.362   2.659
  532   1HD2  LEU  12          1HD2      LEU  12   0.038  -4.824   1.772
  533   2HD2  LEU  12          2HD2      LEU  12  -0.889  -6.189   2.395
  534   3HD2  LEU  12          3HD2      LEU  12   0.280  -6.435   1.096
  535    H    LYS  13           H        LYS  13   3.899  -6.514   4.520
  536    HA   LYS  13           HA       LYS  13   3.706  -4.055   6.070
  537   1HB   LYS  13          2HB       LYS  13   6.107  -5.873   6.327
  538   2HB   LYS  13          1HB       LYS  13   5.852  -4.340   7.146
  539   1HG   LYS  13          2HG       LYS  13   5.316  -5.799   8.813
  540   2HG   LYS  13          1HG       LYS  13   3.729  -5.549   8.083
  541   1HD   LYS  13          2HD       LYS  13   4.020  -7.601   6.772
  542   2HD   LYS  13          1HD       LYS  13   5.595  -7.852   7.520
  543   1HE   LYS  13          2HE       LYS  13   4.535  -8.022   9.711
  544   2HE   LYS  13          1HE       LYS  13   2.956  -7.745   8.976
  545   1HZ   LYS  13          1HZ       LYS  13   4.589 -10.143   9.011
  546   2HZ   LYS  13          2HZ       LYS  13   3.819  -9.814   7.542
  547   3HZ   LYS  13          3HZ       LYS  13   2.906  -9.978   8.956
  548    H    GLY  14           H        GLY  14   4.969  -2.369   5.245
  549   1HA   GLY  14          2HA       GLY  14   7.014  -2.673   3.343
  550   2HA   GLY  14          1HA       GLY  14   5.495  -2.463   2.488
  551    H    GLU  15           H        GLU  15   6.735  -0.563   1.687
  552    HA   GLU  15           HA       GLU  15   5.933   1.761   3.223
  553   1HB   GLU  15          2HB       GLU  15   8.802   1.426   2.328
  554   2HB   GLU  15          1HB       GLU  15   8.117   2.825   3.143
  555   1HG   GLU  15          2HG       GLU  15   7.660   1.446   5.113
  556   2HG   GLU  15          1HG       GLU  15   8.376   0.058   4.299
  557    H    THR  16           H        THR  16   5.627   3.593   1.979
  558    HA   THR  16           HA       THR  16   6.188   3.432  -0.878
  559    HB   THR  16           HB       THR  16   4.041   2.582  -1.004
  560    HG1  THR  16           1HG      THR  16   3.522   5.343  -0.957
  561   1HG2  THR  16          1HG2      THR  16   3.158   4.448   1.178
  562   2HG2  THR  16          2HG2      THR  16   3.415   2.712   1.333
  563   3HG2  THR  16          3HG2      THR  16   2.124   3.325   0.299
  564    H    THR  17           H        THR  17   5.541   5.593  -1.985
  565    HA   THR  17           HA       THR  17   5.835   7.851  -0.138
  566    HB   THR  17           HB       THR  17   7.609   8.814  -1.609
  567    HG1  THR  17           1HG      THR  17   8.668   7.374  -3.010
  568   1HG2  THR  17          1HG2      THR  17   9.439   7.246  -0.908
  569   2HG2  THR  17          2HG2      THR  17   8.183   6.216  -0.221
  570   3HG2  THR  17          3HG2      THR  17   8.410   7.855   0.390
  571    H    THR  18           H        THR  18   4.374   9.324  -0.564
  572    HA   THR  18           HA       THR  18   3.325   9.630  -3.312
  573    HB   THR  18           HB       THR  18   1.673   9.064  -1.532
  574    HG1  THR  18           1HG      THR  18   1.107  10.371  -3.357
  575   1HG2  THR  18          1HG2      THR  18   2.463  11.723  -0.372
  576   2HG2  THR  18          2HG2      THR  18   2.586  10.142   0.400
  577   3HG2  THR  18          3HG2      THR  18   1.001  10.831   0.052
  578    H    GLU  19           H        GLU  19   3.324  11.644  -4.276
  579    HA   GLU  19           HA       GLU  19   4.998  13.689  -2.984
  580   1HB   GLU  19          2HB       GLU  19   5.799  12.939  -5.154
  581   2HB   GLU  19          1HB       GLU  19   4.233  13.257  -5.882
  582   1HG   GLU  19          2HG       GLU  19   5.794  14.989  -6.479
  583   2HG   GLU  19          1HG       GLU  19   4.528  15.650  -5.448
  584    H    ALA  20           H        ALA  20   3.841  15.241  -1.942
  585    HA   ALA  20           HA       ALA  20   1.608  16.461  -3.362
  586   1HB   ALA  20          1HB       ALA  20   0.922  14.556  -1.683
  587   2HB   ALA  20          2HB       ALA  20  -0.013  16.046  -1.807
  588   3HB   ALA  20          3HB       ALA  20   1.144  15.839  -0.493
  589    H    VAL  21           H        VAL  21   1.106  18.529  -2.728
  590    HA   VAL  21           HA       VAL  21   3.147  20.242  -2.073
  591    HB   VAL  21           HB       VAL  21   0.249  20.796  -1.446
  592   1HG1  VAL  21          1HG1      VAL  21   1.999  22.423  -0.665
  593   2HG1  VAL  21          2HG1      VAL  21   0.782  23.088  -1.753
  594   3HG1  VAL  21          3HG1      VAL  21   2.390  22.701  -2.362
  595   1HG2  VAL  21          1HG2      VAL  21   0.349  21.792  -3.829
  596   2HG2  VAL  21          2HG2      VAL  21   0.129  20.052  -3.637
  597   3HG2  VAL  21          3HG2      VAL  21   1.717  20.701  -4.051
  598    H    ASP  22           H        ASP  22   1.110  18.464   0.120
  599    HA   ASP  22           HA       ASP  22   2.804  19.258   2.325
  600   1HB   ASP  22          2HB       ASP  22   1.027  20.090   3.768
  601   2HB   ASP  22          1HB       ASP  22   1.139  21.068   2.309
  602    H    ALA  23           H        ALA  23   1.848  18.233   4.464
  603    HA   ALA  23           HA       ALA  23   1.896  15.460   4.093
  604   1HB   ALA  23          1HB       ALA  23   2.563  15.872   6.203
  605   2HB   ALA  23          2HB       ALA  23   0.851  15.671   6.575
  606   3HB   ALA  23          3HB       ALA  23   1.525  17.289   6.366
  607    H    ALA  24           H        ALA  24  -0.811  17.655   4.688
  608    HA   ALA  24           HA       ALA  24  -2.800  15.671   4.929
  609   1HB   ALA  24          1HB       ALA  24  -2.771  18.591   4.401
  610   2HB   ALA  24          2HB       ALA  24  -3.651  17.669   5.619
  611   3HB   ALA  24          3HB       ALA  24  -4.233  17.712   3.955
  612    H    THR  25           H        THR  25  -1.873  17.664   2.118
  613    HA   THR  25           HA       THR  25  -3.512  16.492   0.227
  614    HB   THR  25           HB       THR  25  -1.781  17.215  -1.419
  615    HG1  THR  25           1HG      THR  25  -0.292  17.505   0.929
  616   1HG2  THR  25          1HG2      THR  25  -1.631  19.633  -0.700
  617   2HG2  THR  25          2HG2      THR  25  -2.531  19.149   0.737
  618   3HG2  THR  25          3HG2      THR  25  -3.250  18.950  -0.861
  619    H    ALA  26           H        ALA  26  -0.269  15.561   1.306
  620    HA   ALA  26           HA       ALA  26   0.058  13.335  -0.383
  621   1HB   ALA  26          1HB       ALA  26   2.016  13.995   0.687
  622   2HB   ALA  26          2HB       ALA  26   1.568  12.538   1.578
  623   3HB   ALA  26          3HB       ALA  26   1.229  14.129   2.260
  624    H    GLU  27           H        GLU  27  -1.039  13.536   3.012
  625    HA   GLU  27           HA       GLU  27  -1.722  10.937   3.476
  626   1HB   GLU  27          2HB       GLU  27  -1.799  12.653   5.190
  627   2HB   GLU  27          1HB       GLU  27  -3.128  13.456   4.369
  628   1HG   GLU  27          2HG       GLU  27  -3.355  10.651   5.405
  629   2HG   GLU  27          1HG       GLU  27  -3.685  12.061   6.411
  630    H    LYS  28           H        LYS  28  -3.766  13.460   2.022
  631    HA   LYS  28           HA       LYS  28  -6.015  11.823   1.580
  632   1HB   LYS  28          2HB       LYS  28  -5.100  14.286   0.085
  633   2HB   LYS  28          1HB       LYS  28  -6.690  13.561  -0.065
  634   1HG   LYS  28          2HG       LYS  28  -5.500  14.816   2.395
  635   2HG   LYS  28          1HG       LYS  28  -6.816  15.448   1.406
  636   1HD   LYS  28          2HD       LYS  28  -6.962  12.804   2.841
  637   2HD   LYS  28          1HD       LYS  28  -7.488  14.324   3.566
  638   1HE   LYS  28          2HE       LYS  28  -9.409  13.238   2.651
  639   2HE   LYS  28          1HE       LYS  28  -9.036  14.627   1.633
  640   1HZ   LYS  28          1HZ       LYS  28  -8.615  13.322  -0.115
  641   2HZ   LYS  28          2HZ       LYS  28  -9.476  12.137   0.728
  642   3HZ   LYS  28          3HZ       LYS  28  -7.787  12.162   0.797
  643    H    VAL  29           H        VAL  29  -3.231  12.621  -0.456
  644    HA   VAL  29           HA       VAL  29  -4.019  11.318  -2.788
  645    HB   VAL  29           HB       VAL  29  -1.234  11.608  -1.638
  646   1HG1  VAL  29          1HG1      VAL  29  -2.225  10.504  -4.213
  647   2HG1  VAL  29          2HG1      VAL  29  -0.855  10.005  -3.222
  648   3HG1  VAL  29          3HG1      VAL  29  -0.739  11.453  -4.222
  649   1HG2  VAL  29          1HG2      VAL  29  -2.944  13.576  -2.495
  650   2HG2  VAL  29          2HG2      VAL  29  -1.986  13.242  -3.937
  651   3HG2  VAL  29          3HG2      VAL  29  -1.186  13.699  -2.432
  652    H    VAL  30           H        VAL  30  -2.498  10.101   0.136
  653    HA   VAL  30           HA       VAL  30  -2.055   7.460  -0.785
  654    HB   VAL  30           HB       VAL  30  -2.478   8.439   2.044
  655   1HG1  VAL  30          1HG1      VAL  30  -1.951   6.393   2.820
  656   2HG1  VAL  30          2HG1      VAL  30  -0.781   6.095   1.535
  657   3HG1  VAL  30          3HG1      VAL  30  -2.501   5.854   1.234
  658   1HG2  VAL  30          1HG2      VAL  30   0.229   7.797   1.100
  659   2HG2  VAL  30          2HG2      VAL  30  -0.335   9.117   2.126
  660   3HG2  VAL  30          3HG2      VAL  30  -0.500   9.230   0.374
  661    H    LYS  31           H        LYS  31  -4.678   8.950   1.143
  662    HA   LYS  31           HA       LYS  31  -6.260   6.713   1.492
  663   1HB   LYS  31          2HB       LYS  31  -6.929   9.614   1.217
  664   2HB   LYS  31          1HB       LYS  31  -8.214   8.420   1.344
  665   1HG   LYS  31          2HG       LYS  31  -7.248   7.645   3.466
  666   2HG   LYS  31          1HG       LYS  31  -6.027   8.913   3.347
  667   1HD   LYS  31          2HD       LYS  31  -7.685  10.623   3.494
  668   2HD   LYS  31          1HD       LYS  31  -8.992   9.446   3.330
  669   1HE   LYS  31          2HE       LYS  31  -8.364   8.451   5.476
  670   2HE   LYS  31          1HE       LYS  31  -7.049   9.613   5.639
  671   1HZ   LYS  31          1HZ       LYS  31  -8.796  11.383   5.526
  672   2HZ   LYS  31          2HZ       LYS  31  -8.845  10.419   6.914
  673   3HZ   LYS  31          3HZ       LYS  31  -9.960  10.165   5.668
  674    H    GLN  32           H        GLN  32  -6.141   8.929  -1.262
  675    HA   GLN  32           HA       GLN  32  -8.240   7.716  -2.709
  676   1HB   GLN  32          2HB       GLN  32  -7.040   9.986  -3.119
  677   2HB   GLN  32          1HB       GLN  32  -5.877   9.030  -4.031
  678   1HG   GLN  32          2HG       GLN  32  -7.447   9.877  -5.580
  679   2HG   GLN  32          1HG       GLN  32  -7.797   8.159  -5.381
  680   1HE2  GLN  32          1HE2      GLN  32  -9.741   7.539  -4.592
  681   2HE2  GLN  32          2HE2      GLN  32 -11.006   8.630  -4.148
  682    H    PHE  33           H        PHE  33  -4.794   7.172  -2.496
  683    HA   PHE  33           HA       PHE  33  -4.351   5.371  -4.551
  684   1HB   PHE  33          2HB       PHE  33  -2.655   6.435  -3.007
  685   2HB   PHE  33          1HB       PHE  33  -3.116   5.256  -1.788
  686    HD1  PHE  33           1HD      PHE  33  -1.865   5.487  -5.277
  687    HD2  PHE  33           2HD      PHE  33  -1.955   3.251  -1.640
  688    HE1  PHE  33           1HE      PHE  33  -0.205   3.915  -6.190
  689    HE2  PHE  33           2HE      PHE  33  -0.297   1.688  -2.565
  690    HZ   PHE  33           HZ       PHE  33   0.578   2.025  -4.844
  691    H    PHE  34           H        PHE  34  -4.964   4.570  -1.162
  692    HA   PHE  34           HA       PHE  34  -5.477   1.805  -1.649
  693   1HB   PHE  34          2HB       PHE  34  -6.137   3.494   0.768
  694   2HB   PHE  34          1HB       PHE  34  -6.165   1.729   0.709
  695    HD1  PHE  34           1HD      PHE  34  -3.842   0.990  -0.737
  696    HD2  PHE  34           2HD      PHE  34  -4.333   4.165   2.046
  697    HE1  PHE  34           1HE      PHE  34  -1.430   0.950  -0.276
  698    HE2  PHE  34           2HE      PHE  34  -1.923   4.124   2.523
  699    HZ   PHE  34           HZ       PHE  34  -0.474   2.523   1.344
  700    H    ASN  35           H        ASN  35  -7.540   4.620  -1.238
  701    HA   ASN  35           HA       ASN  35 -10.036   3.452  -1.050
  702   1HB   ASN  35          2HB       ASN  35  -9.672   5.870  -0.917
  703   2HB   ASN  35          1HB       ASN  35  -9.223   5.912  -2.618
  704   1HD2  ASN  35          1HD2      ASN  35 -11.516   6.847  -0.707
  705   2HD2  ASN  35          2HD2      ASN  35 -12.922   6.607  -1.682
  706    H    ASP  36           H        ASP  36  -8.015   3.994  -3.842
  707    HA   ASP  36           HA       ASP  36  -9.969   2.768  -5.632
  708   1HB   ASP  36          2HB       ASP  36  -7.329   4.112  -6.210
  709   2HB   ASP  36          1HB       ASP  36  -8.401   3.449  -7.439
  710    H    ASN  37           H        ASN  37  -7.000   1.932  -4.011
  711    HA   ASN  37           HA       ASN  37  -6.402  -0.261  -5.800
  712   1HB   ASN  37          2HB       ASN  37  -5.297   0.428  -3.067
  713   2HB   ASN  37          1HB       ASN  37  -4.730  -0.914  -4.054
  714   1HD2  ASN  37          1HD2      ASN  37  -3.540   1.695  -3.029
  715   2HD2  ASN  37          2HD2      ASN  37  -2.805   2.379  -4.436
  716    H    GLY  38           H        GLY  38  -7.697   0.161  -2.563
  717   1HA   GLY  38          2HA       GLY  38  -8.201  -1.855  -1.200
  718   2HA   GLY  38          1HA       GLY  38  -9.635  -1.101  -1.862
  719    H    VAL  39           H        VAL  39 -11.027  -2.432  -2.740
  720    HA   VAL  39           HA       VAL  39 -10.104  -5.109  -3.538
  721    HB   VAL  39           HB       VAL  39 -12.893  -4.222  -2.877
  722   1HG1  VAL  39          1HG1      VAL  39 -12.976  -6.788  -2.340
  723   2HG1  VAL  39          2HG1      VAL  39 -11.616  -6.854  -3.462
  724   3HG1  VAL  39          3HG1      VAL  39 -13.171  -6.212  -3.996
  725   1HG2  VAL  39          1HG2      VAL  39 -12.573  -5.098  -0.661
  726   2HG2  VAL  39          2HG2      VAL  39 -11.323  -3.897  -0.984
  727   3HG2  VAL  39          3HG2      VAL  39 -10.936  -5.616  -1.060
  728    H    ASP  40           H        ASP  40 -10.856  -2.335  -5.207
  729    HA   ASP  40           HA       ASP  40 -12.050  -3.916  -7.375
  730   1HB   ASP  40          2HB       ASP  40 -12.645  -1.040  -6.660
  731   2HB   ASP  40          1HB       ASP  40 -13.260  -1.876  -8.084
  732    H    GLY  41           H        GLY  41  -9.225  -2.764  -6.561
  733   1HA   GLY  41          2HA       GLY  41  -8.600  -1.033  -8.775
  734   2HA   GLY  41          1HA       GLY  41  -7.461  -1.696  -7.617
  735    H    GLU  42           H        GLU  42  -6.680  -1.520 -10.169
  736    HA   GLU  42           HA       GLU  42  -7.092  -4.109 -11.463
  737   1HB   GLU  42          2HB       GLU  42  -5.525  -1.684 -12.374
  738   2HB   GLU  42          1HB       GLU  42  -5.799  -3.136 -13.326
  739   1HG   GLU  42          2HG       GLU  42  -8.203  -2.699 -13.301
  740   2HG   GLU  42          1HG       GLU  42  -7.923  -1.239 -12.354
  741    H    TRP  43           H        TRP  43  -5.942  -5.619 -10.355
  742    HA   TRP  43           HA       TRP  43  -3.172  -5.042  -9.628
  743   1HB   TRP  43          2HB       TRP  43  -4.985  -7.346  -8.910
  744   2HB   TRP  43          1HB       TRP  43  -3.333  -7.151  -8.338
  745    HD1  TRP  43           HD       TRP  43  -5.693  -4.128  -8.449
  746    HE1  TRP  43           1HE      TRP  43  -6.183  -3.405  -6.024
  747    HE3  TRP  43           3HE      TRP  43  -3.479  -8.008  -5.978
  748    HZ2  TRP  43           2HZ      TRP  43  -5.694  -4.353  -3.420
  749    HZ3  TRP  43           3HZ      TRP  43  -3.537  -8.030  -3.524
  750    HH2  TRP  43           HH       TRP  43  -4.619  -6.237  -2.270
  751    H    THR  44           H        THR  44  -1.549  -5.693 -10.857
  752    HA   THR  44           HA       THR  44  -1.946  -7.996 -12.649
  753    HB   THR  44           HB       THR  44  -0.048  -7.059 -13.961
  754    HG1  THR  44           1HG      THR  44  -0.321  -4.833 -12.227
  755   1HG2  THR  44          1HG2      THR  44  -2.170  -4.966 -13.600
  756   2HG2  THR  44          2HG2      THR  44  -2.405  -6.452 -14.519
  757   3HG2  THR  44          3HG2      THR  44  -1.190  -5.282 -15.031
  758    H    TYR  45           H        TYR  45  -0.545  -9.728 -12.482
  759    HA   TYR  45           HA       TYR  45   1.423  -9.562 -10.295
  760   1HB   TYR  45          2HB       TYR  45  -0.491 -11.102  -9.918
  761   2HB   TYR  45          1HB       TYR  45   0.001 -12.018 -11.337
  762    HD1  TYR  45           1HD      TYR  45   2.346 -10.580  -8.864
  763    HD2  TYR  45           2HD      TYR  45   0.395 -14.096 -10.257
  764    HE1  TYR  45           1HE      TYR  45   3.822 -11.952  -7.455
  765    HE2  TYR  45           2HE      TYR  45   1.868 -15.476  -8.852
  766    HH   TYR  45           HH       TYR  45   3.894 -15.423  -7.692
  767    H    ASP  46           H        ASP  46   3.473 -10.400 -10.547
  768    HA   ASP  46           HA       ASP  46   4.213 -11.244 -13.270
  769   1HB   ASP  46          2HB       ASP  46   5.000  -8.956 -12.838
  770   2HB   ASP  46          1HB       ASP  46   5.829  -9.509 -11.386
  771    H    ASP  47           H        ASP  47   3.989 -13.433 -12.550
  772    HA   ASP  47           HA       ASP  47   5.066 -14.657 -10.360
  773   1HB   ASP  47          2HB       ASP  47   5.057 -15.775 -13.172
  774   2HB   ASP  47          1HB       ASP  47   5.183 -16.716 -11.690
  775    H    ALA  48           H        ALA  48   6.769 -13.626 -13.253
  776    HA   ALA  48           HA       ALA  48   9.145 -14.967 -13.049
  777   1HB   ALA  48          1HB       ALA  48   9.407 -12.110 -13.713
  778   2HB   ALA  48          2HB       ALA  48   8.229 -13.023 -14.655
  779   3HB   ALA  48          3HB       ALA  48   9.914 -13.540 -14.612
  780    H    THR  49           H        THR  49   8.060 -12.281 -11.066
  781    HA   THR  49           HA       THR  49  10.529 -12.576  -9.491
  782    HB   THR  49           HB       THR  49  10.446 -10.160  -8.993
  783    HG1  THR  49           1HG      THR  49   8.112 -10.049  -9.540
  784   1HG2  THR  49          1HG2      THR  49  11.546  -9.478 -10.847
  785   2HG2  THR  49          2HG2      THR  49  10.364 -10.185 -11.949
  786   3HG2  THR  49          3HG2      THR  49  11.552 -11.215 -11.154
  787    H    LYS  50           H        LYS  50   7.537 -13.457  -9.327
  788    HA   LYS  50           HA       LYS  50   5.924 -13.703  -7.710
  789   1HB   LYS  50          2HB       LYS  50   8.427 -13.553  -6.026
  790   2HB   LYS  50          1HB       LYS  50   6.853 -14.012  -5.390
  791   1HG   LYS  50          2HG       LYS  50   8.271 -15.463  -7.612
  792   2HG   LYS  50          1HG       LYS  50   8.337 -15.926  -5.910
  793   1HD   LYS  50          2HD       LYS  50   5.870 -16.148  -5.919
  794   2HD   LYS  50          1HD       LYS  50   5.874 -15.795  -7.648
  795   1HE   LYS  50          2HE       LYS  50   7.240 -18.124  -6.303
  796   2HE   LYS  50          1HE       LYS  50   5.749 -18.196  -7.242
  797   1HZ   LYS  50          1HZ       LYS  50   7.338 -17.072  -9.020
  798   2HZ   LYS  50          2HZ       LYS  50   7.205 -18.751  -8.860
  799   3HZ   LYS  50          3HZ       LYS  50   8.506 -17.933  -8.150
  800    H    THR  51           H        THR  51   6.322 -11.017  -8.599
  801    HA   THR  51           HA       THR  51   5.619  -9.547  -6.150
  802    HB   THR  51           HB       THR  51   7.123  -8.539  -8.571
  803    HG1  THR  51           1HG      THR  51   8.398  -9.756  -7.146
  804   1HG2  THR  51          1HG2      THR  51   7.309  -6.761  -6.388
  805   2HG2  THR  51          2HG2      THR  51   5.600  -7.064  -6.694
  806   3HG2  THR  51          3HG2      THR  51   6.637  -6.471  -7.993
  807    H    PHE  52           H        PHE  52   3.873  -8.222  -6.201
  808    HA   PHE  52           HA       PHE  52   2.223  -8.321  -8.638
  809   1HB   PHE  52          2HB       PHE  52   1.358  -7.787  -5.786
  810   2HB   PHE  52          1HB       PHE  52   0.297  -7.948  -7.180
  811    HD1  PHE  52           1HD      PHE  52  -0.577 -10.018  -7.752
  812    HD2  PHE  52           2HD      PHE  52   2.792  -9.816  -5.159
  813    HE1  PHE  52           1HE      PHE  52  -0.765 -12.434  -7.322
  814    HE2  PHE  52           2HE      PHE  52   2.610 -12.232  -4.727
  815    HZ   PHE  52           HZ       PHE  52   0.830 -13.544  -5.810
  816    H    THR  53           H        THR  53   1.381  -6.436  -9.498
  817    HA   THR  53           HA       THR  53   2.332  -3.939  -8.277
  818    HB   THR  53           HB       THR  53   2.098  -3.064 -10.718
  819    HG1  THR  53           1HG      THR  53   1.895  -4.503 -12.212
  820   1HG2  THR  53          1HG2      THR  53   4.332  -4.635  -9.564
  821   2HG2  THR  53          2HG2      THR  53   4.240  -2.923  -9.980
  822   3HG2  THR  53          3HG2      THR  53   4.421  -4.133 -11.252
  823    H    VAL  54           H        VAL  54   0.855  -2.605  -7.606
  824    HA   VAL  54           HA       VAL  54  -1.919  -2.947  -8.503
  825    HB   VAL  54           HB       VAL  54  -0.863  -1.370  -6.145
  826   1HG1  VAL  54          1HG1      VAL  54  -3.137  -1.137  -5.451
  827   2HG1  VAL  54          2HG1      VAL  54  -3.699  -2.177  -6.758
  828   3HG1  VAL  54          3HG1      VAL  54  -3.025  -0.590  -7.123
  829   1HG2  VAL  54          1HG2      VAL  54  -1.683  -4.195  -6.469
  830   2HG2  VAL  54          2HG2      VAL  54  -2.243  -3.363  -5.019
  831   3HG2  VAL  54          3HG2      VAL  54  -0.518  -3.471  -5.362
  832    H    THR  55           H        THR  55  -1.951  -1.831 -10.427
  833    HA   THR  55           HA       THR  55  -0.821   0.828 -10.562
  834    HB   THR  55           HB       THR  55  -2.448  -0.553 -12.688
  835    HG1  THR  55           1HG      THR  55  -0.658  -1.847 -12.041
  836   1HG2  THR  55          1HG2      THR  55  -2.127   1.667 -13.338
  837   2HG2  THR  55          2HG2      THR  55  -0.836   0.776 -14.144
  838   3HG2  THR  55          3HG2      THR  55  -0.488   1.712 -12.688
  839    H    GLU  56           H        GLU  56  -1.889   2.425  -9.632
  840    HA   GLU  56           HA       GLU  56  -4.540   2.552  -8.925
  841   1HB   GLU  56          2HB       GLU  56  -2.889   4.140  -8.114
  842   2HB   GLU  56          1HB       GLU  56  -2.701   4.814  -9.726
  843   1HG   GLU  56          2HG       GLU  56  -4.050   6.264  -8.338
  844   2HG   GLU  56          1HG       GLU  56  -5.005   5.610  -9.670
  Start of MODEL    5
    1   1H    MET   1          1HT       MET   1   7.073 -18.504   3.667
    2   2H    MET   1          2HT       MET   1   6.278 -19.752   2.847
    3   3H    MET   1          3HT       MET   1   5.439 -18.344   3.262
    4    HA   MET   1           HA       MET   1   7.801 -18.223   1.510
    5   1HB   MET   1          2HB       MET   1   5.988 -19.907   0.761
    6   2HB   MET   1          1HB       MET   1   4.978 -18.497   0.494
    7   1HG   MET   1          2HG       MET   1   6.430 -17.663  -1.181
    8   2HG   MET   1          1HG       MET   1   7.675 -18.846  -0.779
    9   1HE   MET   1          1HE       MET   1   6.485 -19.940  -4.362
   10   2HE   MET   1          2HE       MET   1   7.907 -19.685  -3.349
   11   3HE   MET   1          3HE       MET   1   6.814 -18.345  -3.689
   12    H    GLN   2           H        GLN   2   8.181 -16.165   0.890
   13    HA   GLN   2           HA       GLN   2   6.159 -14.152   1.618
   14   1HB   GLN   2          2HB       GLN   2   8.228 -13.967   2.910
   15   2HB   GLN   2          1HB       GLN   2   9.161 -13.861   1.424
   16   1HG   GLN   2          2HG       GLN   2   8.043 -11.763   0.867
   17   2HG   GLN   2          1HG       GLN   2   7.105 -11.869   2.353
   18   1HE2  GLN   2          1HE2      GLN   2  10.079 -13.087   3.085
   19   2HE2  GLN   2          2HE2      GLN   2  10.837 -11.651   3.667
   20    H    TYR   3           H        TYR   3   5.759 -12.419   0.235
   21    HA   TYR   3           HA       TYR   3   6.850 -12.650  -2.484
   22   1HB   TYR   3          2HB       TYR   3   3.949 -12.204  -1.751
   23   2HB   TYR   3          1HB       TYR   3   4.603 -12.099  -3.381
   24    HD1  TYR   3           1HD      TYR   3   4.379 -13.947  -4.735
   25    HD2  TYR   3           2HD      TYR   3   4.541 -14.510  -0.520
   26    HE1  TYR   3           1HE      TYR   3   3.996 -16.353  -5.048
   27    HE2  TYR   3           2HE      TYR   3   4.163 -16.924  -0.822
   28    HH   TYR   3           HH       TYR   3   3.381 -18.282  -3.957
   29    H    LYS   4           H        LYS   4   6.984 -10.711  -3.657
   30    HA   LYS   4           HA       LYS   4   7.039  -8.323  -1.963
   31   1HB   LYS   4          2HB       LYS   4   9.114  -8.887  -3.124
   32   2HB   LYS   4          1HB       LYS   4   8.277  -8.865  -4.669
   33   1HG   LYS   4          2HG       LYS   4   9.503  -6.835  -4.449
   34   2HG   LYS   4          1HG       LYS   4   7.787  -6.456  -4.303
   35   1HD   LYS   4          2HD       LYS   4   9.046  -5.230  -2.639
   36   2HD   LYS   4          1HD       LYS   4   8.031  -6.437  -1.849
   37   1HE   LYS   4          2HE       LYS   4   9.932  -7.916  -1.595
   38   2HE   LYS   4          1HE       LYS   4  10.958  -6.789  -2.481
   39   1HZ   LYS   4          1HZ       LYS   4   9.644  -5.575  -0.239
   40   2HZ   LYS   4          2HZ       LYS   4  11.281  -5.570  -0.662
   41   3HZ   LYS   4          3HZ       LYS   4  10.641  -6.865   0.216
   42    H    VAL   5           H        VAL   5   5.183  -7.203  -2.006
   43    HA   VAL   5           HA       VAL   5   3.662  -7.057  -4.501
   44    HB   VAL   5           HB       VAL   5   2.891  -6.082  -1.745
   45   1HG1  VAL   5          1HG1      VAL   5   1.644  -4.812  -3.268
   46   2HG1  VAL   5          2HG1      VAL   5   0.570  -6.141  -2.827
   47   3HG1  VAL   5          3HG1      VAL   5   1.430  -6.176  -4.366
   48   1HG2  VAL   5          1HG2      VAL   5   3.091  -8.692  -2.577
   49   2HG2  VAL   5          2HG2      VAL   5   1.395  -8.314  -2.875
   50   3HG2  VAL   5          3HG2      VAL   5   2.075  -8.107  -1.262
   51    H    ILE   6           H        ILE   6   3.674  -5.309  -5.748
   52    HA   ILE   6           HA       ILE   6   5.003  -2.885  -4.746
   53    HB   ILE   6           HB       ILE   6   4.686  -3.942  -7.556
   54   1HG1  ILE   6          2HG1      ILE   6   7.133  -3.465  -5.842
   55   2HG1  ILE   6          1HG1      ILE   6   6.420  -5.034  -6.198
   56   1HG2  ILE   6          1HG2      ILE   6   4.657  -1.760  -8.112
   57   2HG2  ILE   6          2HG2      ILE   6   6.395  -1.891  -7.848
   58   3HG2  ILE   6          3HG2      ILE   6   5.357  -1.244  -6.578
   59   1HD1  ILE   6          1HD1      ILE   6   8.095  -3.283  -7.879
   60   2HD1  ILE   6          2HD1      ILE   6   6.811  -4.179  -8.691
   61   3HD1  ILE   6          3HD1      ILE   6   8.039  -5.041  -7.767
   62    H    LEU   7           H        LEU   7   3.865  -1.064  -4.533
   63    HA   LEU   7           HA       LEU   7   1.160  -0.978  -5.686
   64   1HB   LEU   7          2HB       LEU   7   2.153   0.823  -3.493
   65   2HB   LEU   7          1HB       LEU   7   0.501   0.370  -3.879
   66    HG   LEU   7           HG       LEU   7   2.581  -1.421  -2.638
   67   1HD1  LEU   7          1HD1      LEU   7   1.615   0.374  -1.193
   68   2HD1  LEU   7          2HD1      LEU   7   1.294  -1.269  -0.642
   69   3HD1  LEU   7          3HD1      LEU   7   0.028  -0.349  -1.457
   70   1HD2  LEU   7          1HD2      LEU   7   0.986  -2.550  -4.203
   71   2HD2  LEU   7          2HD2      LEU   7  -0.327  -2.007  -3.160
   72   3HD2  LEU   7          3HD2      LEU   7   0.903  -3.107  -2.533
   73    H    ASN   8           H        ASN   8   1.547  -0.110  -7.690
   74    HA   ASN   8           HA       ASN   8   3.030   2.420  -7.842
   75   1HB   ASN   8          2HB       ASN   8   2.229   0.432  -9.967
   76   2HB   ASN   8          1HB       ASN   8   2.937   1.999 -10.337
   77   1HD2  ASN   8          1HD2      ASN   8   4.331   1.136  -7.512
   78   2HD2  ASN   8          2HD2      ASN   8   5.733   0.336  -8.112
   79    H    GLY   9           H        GLY   9   1.753   4.159  -7.563
   80   1HA   GLY   9          2HA       GLY   9  -0.861   4.158  -8.947
   81   2HA   GLY   9          1HA       GLY   9  -0.532   5.059  -7.477
   82    H    LYS  10           H        LYS  10  -1.491   6.771  -8.918
   83    HA   LYS  10           HA       LYS  10   0.182   7.806 -11.012
   84   1HB   LYS  10          2HB       LYS  10  -2.197   9.047  -9.616
   85   2HB   LYS  10          1HB       LYS  10  -1.439   9.663 -11.077
   86   1HG   LYS  10          2HG       LYS  10  -2.057   7.615 -12.261
   87   2HG   LYS  10          1HG       LYS  10  -2.821   7.003 -10.792
   88   1HD   LYS  10          2HD       LYS  10  -4.377   8.898 -10.817
   89   2HD   LYS  10          1HD       LYS  10  -3.615   9.499 -12.292
   90   1HE   LYS  10          2HE       LYS  10  -5.023   6.850 -11.983
   91   2HE   LYS  10          1HE       LYS  10  -5.682   8.280 -12.776
   92   1HZ   LYS  10          1HZ       LYS  10  -3.394   7.994 -14.099
   93   2HZ   LYS  10          2HZ       LYS  10  -4.846   7.280 -14.593
   94   3HZ   LYS  10          3HZ       LYS  10  -3.710   6.372 -13.729
   95    H    THR  11           H        THR  11  -0.848   9.077  -7.843
   96    HA   THR  11           HA       THR  11   1.495  10.828  -7.819
   97    HB   THR  11           HB       THR  11   0.157  11.816  -5.823
   98    HG1  THR  11           1HG      THR  11  -2.108  11.464  -6.100
   99   1HG2  THR  11          1HG2      THR  11  -0.186  12.213  -8.683
  100   2HG2  THR  11          2HG2      THR  11   0.007  13.391  -7.385
  101   3HG2  THR  11          3HG2      THR  11  -1.583  12.709  -7.728
  102    H    LEU  12           H        LEU  12   0.790   7.829  -6.831
  103    HA   LEU  12           HA       LEU  12   2.541   8.070  -4.498
  104   1HB   LEU  12          2HB       LEU  12   0.269   7.951  -3.641
  105   2HB   LEU  12          1HB       LEU  12  -0.035   6.505  -4.583
  106    HG   LEU  12           HG       LEU  12   1.484   5.230  -3.236
  107   1HD1  LEU  12          1HD1      LEU  12   2.464   7.863  -2.541
  108   2HD1  LEU  12          2HD1      LEU  12   3.269   6.304  -2.459
  109   3HD1  LEU  12          3HD1      LEU  12   2.239   6.836  -1.129
  110   1HD2  LEU  12          1HD2      LEU  12  -0.029   4.941  -1.631
  111   2HD2  LEU  12          2HD2      LEU  12  -0.881   6.329  -2.308
  112   3HD2  LEU  12          3HD2      LEU  12   0.251   6.554  -0.975
  113    H    LYS  13           H        LYS  13   4.026   6.509  -4.289
  114    HA   LYS  13           HA       LYS  13   3.802   4.054  -5.850
  115   1HB   LYS  13          2HB       LYS  13   6.146   5.948  -6.105
  116   2HB   LYS  13          1HB       LYS  13   6.071   4.333  -6.794
  117   1HG   LYS  13          2HG       LYS  13   4.190   5.014  -8.195
  118   2HG   LYS  13          1HG       LYS  13   4.258   6.634  -7.498
  119   1HD   LYS  13          2HD       LYS  13   6.468   5.295  -9.058
  120   2HD   LYS  13          1HD       LYS  13   5.375   6.532  -9.681
  121   1HE   LYS  13          2HE       LYS  13   7.320   6.866  -7.401
  122   2HE   LYS  13          1HE       LYS  13   7.524   7.493  -9.036
  123   1HZ   LYS  13          1HZ       LYS  13   5.156   8.521  -8.407
  124   2HZ   LYS  13          2HZ       LYS  13   6.619   9.321  -8.123
  125   3HZ   LYS  13          3HZ       LYS  13   5.861   8.475  -6.869
  126    H    GLY  14           H        GLY  14   5.019   2.328  -5.011
  127   1HA   GLY  14          2HA       GLY  14   7.045   2.592  -3.078
  128   2HA   GLY  14          1HA       GLY  14   5.510   2.405  -2.246
  129    H    GLU  15           H        GLU  15   6.755   0.499  -1.438
  130    HA   GLU  15           HA       GLU  15   6.010  -1.823  -3.040
  131   1HB   GLU  15          2HB       GLU  15   8.767  -1.436  -1.858
  132   2HB   GLU  15          1HB       GLU  15   8.180  -2.917  -2.600
  133   1HG   GLU  15          2HG       GLU  15   7.926  -1.752  -4.732
  134   2HG   GLU  15          1HG       GLU  15   8.518  -0.266  -3.986
  135    H    THR  16           H        THR  16   5.760  -3.751  -1.814
  136    HA   THR  16           HA       THR  16   5.986  -3.602   1.066
  137    HB   THR  16           HB       THR  16   3.858  -2.694   1.056
  138    HG1  THR  16           1HG      THR  16   3.258  -5.435   0.901
  139   1HG2  THR  16          1HG2      THR  16   3.148  -2.573  -1.131
  140   2HG2  THR  16          2HG2      THR  16   2.011  -3.719  -0.420
  141   3HG2  THR  16          3HG2      THR  16   3.353  -4.301  -1.401
  142    H    THR  17           H        THR  17   5.226  -5.738   2.087
  143    HA   THR  17           HA       THR  17   5.500  -7.999   0.251
  144    HB   THR  17           HB       THR  17   7.208  -9.038   1.708
  145    HG1  THR  17           1HG      THR  17   7.349  -6.482   2.925
  146   1HG2  THR  17          1HG2      THR  17   8.172  -6.346   0.806
  147   2HG2  THR  17          2HG2      THR  17   7.853  -7.682  -0.298
  148   3HG2  THR  17          3HG2      THR  17   9.092  -7.844   0.947
  149    H    THR  18           H        THR  18   3.992  -9.435   0.654
  150    HA   THR  18           HA       THR  18   2.860  -9.664   3.376
  151    HB   THR  18           HB       THR  18   1.272  -9.045   1.555
  152    HG1  THR  18           1HG      THR  18   0.624 -10.308   3.390
  153   1HG2  THR  18          1HG2      THR  18   2.062 -11.713   0.429
  154   2HG2  THR  18          2HG2      THR  18   2.085 -10.141  -0.370
  155   3HG2  THR  18          3HG2      THR  18   0.546 -10.905   0.032
  156    H    GLU  19           H        GLU  19   2.753 -11.676   4.360
  157    HA   GLU  19           HA       GLU  19   4.371 -13.787   3.103
  158   1HB   GLU  19          2HB       GLU  19   5.152 -13.006   5.293
  159   2HB   GLU  19          1HB       GLU  19   3.586 -13.383   5.999
  160   1HG   GLU  19          2HG       GLU  19   5.163 -15.103   6.565
  161   2HG   GLU  19          1HG       GLU  19   3.946 -15.759   5.469
  162    H    ALA  20           H        ALA  20   3.237 -15.387   2.142
  163    HA   ALA  20           HA       ALA  20   0.942 -16.496   3.541
  164   1HB   ALA  20          1HB       ALA  20   0.568 -15.832   0.653
  165   2HB   ALA  20          2HB       ALA  20   0.249 -14.622   1.895
  166   3HB   ALA  20          3HB       ALA  20  -0.641 -16.144   1.899
  167    H    VAL  21           H        VAL  21   0.375 -18.564   2.910
  168    HA   VAL  21           HA       VAL  21   2.381 -20.343   2.331
  169    HB   VAL  21           HB       VAL  21  -0.520 -20.797   1.637
  170   1HG1  VAL  21          1HG1      VAL  21   1.146 -22.486   0.846
  171   2HG1  VAL  21          2HG1      VAL  21  -0.073 -23.117   1.953
  172   3HG1  VAL  21          3HG1      VAL  21   1.558 -22.783   2.534
  173   1HG2  VAL  21          1HG2      VAL  21  -0.514 -21.809   4.005
  174   2HG2  VAL  21          2HG2      VAL  21  -0.612 -20.054   3.840
  175   3HG2  VAL  21          3HG2      VAL  21   0.921 -20.815   4.262
  176    H    ASP  22           H        ASP  22   0.516 -18.486   0.073
  177    HA   ASP  22           HA       ASP  22   2.263 -19.296  -2.067
  178   1HB   ASP  22          2HB       ASP  22   0.566 -20.145  -3.593
  179   2HB   ASP  22          1HB       ASP  22   0.621 -21.127  -2.133
  180    H    ALA  23           H        ALA  23   1.427 -18.266  -4.235
  181    HA   ALA  23           HA       ALA  23   1.475 -15.511  -3.887
  182   1HB   ALA  23          1HB       ALA  23   0.278 -16.070  -6.401
  183   2HB   ALA  23          2HB       ALA  23   1.476 -17.321  -6.068
  184   3HB   ALA  23          3HB       ALA  23   1.949 -15.621  -6.051
  185    H    ALA  24           H        ALA  24  -1.286 -17.642  -4.489
  186    HA   ALA  24           HA       ALA  24  -3.206 -15.595  -4.765
  187   1HB   ALA  24          1HB       ALA  24  -3.262 -18.511  -4.291
  188   2HB   ALA  24          2HB       ALA  24  -4.167 -17.532  -5.445
  189   3HB   ALA  24          3HB       ALA  24  -4.687 -17.619  -3.763
  190    H    THR  25           H        THR  25  -2.421 -17.624  -1.926
  191    HA   THR  25           HA       THR  25  -4.033 -16.368  -0.071
  192    HB   THR  25           HB       THR  25  -2.343 -17.122   1.613
  193    HG1  THR  25           1HG      THR  25  -0.850 -17.508  -0.712
  194   1HG2  THR  25          1HG2      THR  25  -2.227 -19.582   0.739
  195   2HG2  THR  25          2HG2      THR  25  -3.366 -18.974  -0.462
  196   3HG2  THR  25          3HG2      THR  25  -3.756 -18.870   1.254
  197    H    ALA  26           H        ALA  26  -0.739 -15.565  -1.111
  198    HA   ALA  26           HA       ALA  26  -0.357 -13.341   0.567
  199   1HB   ALA  26          1HB       ALA  26   1.203 -12.612  -1.388
  200   2HB   ALA  26          2HB       ALA  26   0.818 -14.200  -2.053
  201   3HB   ALA  26          3HB       ALA  26   1.590 -14.070  -0.472
  202    H    GLU  27           H        GLU  27  -1.480 -13.543  -2.819
  203    HA   GLU  27           HA       GLU  27  -2.033 -10.888  -3.262
  204   1HB   GLU  27          2HB       GLU  27  -2.115 -12.604  -5.003
  205   2HB   GLU  27          1HB       GLU  27  -3.545 -13.305  -4.260
  206   1HG   GLU  27          2HG       GLU  27  -4.791 -11.256  -4.717
  207   2HG   GLU  27          1HG       GLU  27  -3.356 -10.551  -5.461
  208    H    LYS  28           H        LYS  28  -4.196 -13.385  -1.928
  209    HA   LYS  28           HA       LYS  28  -6.445 -11.754  -1.577
  210   1HB   LYS  28          2HB       LYS  28  -5.571 -14.175   0.013
  211   2HB   LYS  28          1HB       LYS  28  -7.176 -13.456   0.069
  212   1HG   LYS  28          2HG       LYS  28  -5.868 -14.748  -2.313
  213   2HG   LYS  28          1HG       LYS  28  -7.206 -15.390  -1.358
  214   1HD   LYS  28          2HD       LYS  28  -8.591 -13.487  -2.036
  215   2HD   LYS  28          1HD       LYS  28  -7.252 -12.857  -2.997
  216   1HE   LYS  28          2HE       LYS  28  -7.297 -14.878  -4.379
  217   2HE   LYS  28          1HE       LYS  28  -8.631 -15.509  -3.416
  218   1HZ   LYS  28          1HZ       LYS  28  -9.585 -13.119  -4.150
  219   2HZ   LYS  28          2HZ       LYS  28  -9.873 -14.552  -5.000
  220   3HZ   LYS  28          3HZ       LYS  28  -8.645 -13.504  -5.503
  221    H    VAL  29           H        VAL  29  -3.728 -12.468   0.566
  222    HA   VAL  29           HA       VAL  29  -4.629 -11.151   2.852
  223    HB   VAL  29           HB       VAL  29  -1.792 -11.423   1.832
  224   1HG1  VAL  29          1HG1      VAL  29  -1.622  -9.761   3.442
  225   2HG1  VAL  29          2HG1      VAL  29  -1.323 -11.233   4.365
  226   3HG1  VAL  29          3HG1      VAL  29  -2.903 -10.453   4.437
  227   1HG2  VAL  29          1HG2      VAL  29  -2.642 -13.076   4.084
  228   2HG2  VAL  29          2HG2      VAL  29  -1.761 -13.518   2.622
  229   3HG2  VAL  29          3HG2      VAL  29  -3.521 -13.412   2.593
  230    H    VAL  30           H        VAL  30  -3.012  -9.946  -0.023
  231    HA   VAL  30           HA       VAL  30  -2.587  -7.305   0.899
  232    HB   VAL  30           HB       VAL  30  -3.014  -8.198  -1.955
  233   1HG1  VAL  30          1HG1      VAL  30  -2.052  -6.214  -2.635
  234   2HG1  VAL  30          2HG1      VAL  30  -1.249  -5.952  -1.088
  235   3HG1  VAL  30          3HG1      VAL  30  -2.988  -5.697  -1.233
  236   1HG2  VAL  30          1HG2      VAL  30  -1.218  -9.494  -1.577
  237   2HG2  VAL  30          2HG2      VAL  30  -0.793  -8.642  -0.093
  238   3HG2  VAL  30          3HG2      VAL  30  -0.321  -7.976  -1.656
  239    H    LYS  31           H        LYS  31  -5.197  -8.790  -1.056
  240    HA   LYS  31           HA       LYS  31  -6.759  -6.562  -1.490
  241   1HB   LYS  31          2HB       LYS  31  -7.474  -9.446  -1.092
  242   2HB   LYS  31          1HB       LYS  31  -8.739  -8.241  -1.282
  243   1HG   LYS  31          2HG       LYS  31  -8.278  -9.268  -3.404
  244   2HG   LYS  31          1HG       LYS  31  -7.754  -7.585  -3.442
  245   1HD   LYS  31          2HD       LYS  31  -5.442  -8.359  -2.963
  246   2HD   LYS  31          1HD       LYS  31  -6.019 -10.021  -3.094
  247   1HE   LYS  31          2HE       LYS  31  -6.156  -7.939  -5.270
  248   2HE   LYS  31          1HE       LYS  31  -4.976  -9.244  -5.175
  249   1HZ   LYS  31          1HZ       LYS  31  -6.820  -9.761  -6.673
  250   2HZ   LYS  31          2HZ       LYS  31  -7.914  -9.620  -5.390
  251   3HZ   LYS  31          3HZ       LYS  31  -6.749 -10.847  -5.376
  252    H    GLN  32           H        GLN  32  -6.689  -8.666   1.353
  253    HA   GLN  32           HA       GLN  32  -8.738  -7.294   2.764
  254   1HB   GLN  32          2HB       GLN  32  -7.992  -9.590   3.337
  255   2HB   GLN  32          1HB       GLN  32  -6.445  -8.942   3.857
  256   1HG   GLN  32          2HG       GLN  32  -7.794  -9.365   5.779
  257   2HG   GLN  32          1HG       GLN  32  -7.606  -7.626   5.584
  258   1HE2  GLN  32          1HE2      GLN  32  -9.752  -8.839   3.284
  259   2HE2  GLN  32          2HE2      GLN  32 -11.224  -8.472   4.100
  260    H    PHE  33           H        PHE  33  -5.250  -7.003   2.582
  261    HA   PHE  33           HA       PHE  33  -4.727  -5.206   4.619
  262   1HB   PHE  33          2HB       PHE  33  -3.046  -6.377   3.180
  263   2HB   PHE  33          1HB       PHE  33  -3.437  -5.260   1.880
  264    HD1  PHE  33           1HD      PHE  33  -2.171  -5.396   5.357
  265    HD2  PHE  33           2HD      PHE  33  -2.292  -3.235   1.682
  266    HE1  PHE  33           1HE      PHE  33  -0.475  -3.829   6.210
  267    HE2  PHE  33           2HE      PHE  33  -0.596  -1.677   2.542
  268    HZ   PHE  33           HZ       PHE  33   0.312  -1.981   4.814
  269    H    PHE  34           H        PHE  34  -5.268  -4.424   1.217
  270    HA   PHE  34           HA       PHE  34  -5.582  -1.623   1.694
  271   1HB   PHE  34          2HB       PHE  34  -6.209  -3.269  -0.755
  272   2HB   PHE  34          1HB       PHE  34  -6.203  -1.503  -0.695
  273    HD1  PHE  34           1HD      PHE  34  -3.939  -0.796   0.844
  274    HD2  PHE  34           2HD      PHE  34  -4.349  -3.994  -1.930
  275    HE1  PHE  34           1HE      PHE  34  -1.507  -0.805   0.503
  276    HE2  PHE  34           2HE      PHE  34  -1.914  -3.997  -2.286
  277    HZ   PHE  34           HZ       PHE  34  -0.497  -2.411  -1.051
  278    H    ASN  35           H        ASN  35  -7.835  -4.284   1.213
  279    HA   ASN  35           HA       ASN  35 -10.233  -2.920   0.959
  280   1HB   ASN  35          2HB       ASN  35 -10.134  -5.339   0.818
  281   2HB   ASN  35          1HB       ASN  35  -9.611  -5.459   2.494
  282   1HD2  ASN  35          1HD2      ASN  35 -12.076  -6.167   0.696
  283   2HD2  ASN  35          2HD2      ASN  35 -13.402  -5.818   1.742
  284    H    ASP  36           H        ASP  36  -8.310  -3.612   3.797
  285    HA   ASP  36           HA       ASP  36 -10.203  -2.257   5.558
  286   1HB   ASP  36          2HB       ASP  36  -7.668  -3.778   6.186
  287   2HB   ASP  36          1HB       ASP  36  -8.736  -3.064   7.391
  288    H    ASN  37           H        ASN  37  -7.105  -1.634   4.056
  289    HA   ASN  37           HA       ASN  37  -6.445   0.513   5.875
  290   1HB   ASN  37          2HB       ASN  37  -5.268  -0.242   3.189
  291   2HB   ASN  37          1HB       ASN  37  -4.662   1.061   4.204
  292   1HD2  ASN  37          1HD2      ASN  37  -3.594  -1.616   3.235
  293   2HD2  ASN  37          2HD2      ASN  37  -2.969  -2.346   4.671
  294    H    GLY  38           H        GLY  38  -7.650   0.165   2.606
  295   1HA   GLY  38          2HA       GLY  38  -8.002   2.159   1.191
  296   2HA   GLY  38          1HA       GLY  38  -9.496   1.557   1.873
  297    H    VAL  39           H        VAL  39 -10.767   3.032   2.654
  298    HA   VAL  39           HA       VAL  39  -9.826   5.712   3.001
  299    HB   VAL  39           HB       VAL  39 -12.575   4.533   3.224
  300   1HG1  VAL  39          1HG1      VAL  39 -13.134   7.085   2.862
  301   2HG1  VAL  39          2HG1      VAL  39 -11.584   7.307   3.673
  302   3HG1  VAL  39          3HG1      VAL  39 -12.885   6.430   4.480
  303   1HG2  VAL  39          1HG2      VAL  39 -11.439   4.530   0.998
  304   2HG2  VAL  39          2HG2      VAL  39 -11.400   6.292   1.088
  305   3HG2  VAL  39          3HG2      VAL  39 -12.947   5.446   1.057
  306    H    ASP  40           H        ASP  40 -11.633   3.566   5.276
  307    HA   ASP  40           HA       ASP  40 -11.050   5.474   7.376
  308   1HB   ASP  40          2HB       ASP  40 -12.684   2.936   7.405
  309   2HB   ASP  40          1HB       ASP  40 -12.546   4.068   8.747
  310    H    GLY  41           H        GLY  41  -8.843   3.770   6.281
  311   1HA   GLY  41          2HA       GLY  41  -8.211   1.770   8.181
  312   2HA   GLY  41          1HA       GLY  41  -7.069   2.552   7.101
  313    H    GLU  42           H        GLU  42  -6.940   1.779  10.000
  314    HA   GLU  42           HA       GLU  42  -6.853   4.224  11.498
  315   1HB   GLU  42          2HB       GLU  42  -5.652   1.514  12.103
  316   2HB   GLU  42          1HB       GLU  42  -5.755   2.849  13.242
  317   1HG   GLU  42          2HG       GLU  42  -8.103   1.462  11.971
  318   2HG   GLU  42          1HG       GLU  42  -7.498   1.168  13.600
  319    H    TRP  43           H        TRP  43  -5.513   5.651  10.402
  320    HA   TRP  43           HA       TRP  43  -2.714   4.834  10.031
  321   1HB   TRP  43          2HB       TRP  43  -4.125   7.265   8.933
  322   2HB   TRP  43          1HB       TRP  43  -2.502   6.727   8.529
  323    HD1  TRP  43           HD       TRP  43  -4.852   3.825   8.588
  324    HE1  TRP  43           1HE      TRP  43  -5.511   3.189   6.182
  325    HE3  TRP  43           3HE      TRP  43  -3.025   7.915   6.155
  326    HZ2  TRP  43           2HZ      TRP  43  -5.281   4.284   3.596
  327    HZ3  TRP  43           3HZ      TRP  43  -3.274   8.047   3.720
  328    HH2  TRP  43           HH       TRP  43  -4.382   6.269   2.461
  329    H    THR  44           H        THR  44  -1.105   5.716  11.166
  330    HA   THR  44           HA       THR  44  -1.713   8.031  12.885
  331    HB   THR  44           HB       THR  44   0.136   7.223  14.340
  332    HG1  THR  44           1HG      THR  44   1.129   5.972  12.586
  333   1HG2  THR  44          1HG2      THR  44  -0.957   5.150  15.193
  334   2HG2  THR  44          2HG2      THR  44  -2.087   5.267  13.844
  335   3HG2  THR  44          3HG2      THR  44  -2.021   6.549  15.051
  336    H    TYR  45           H        TYR  45  -0.281   9.781  12.839
  337    HA   TYR  45           HA       TYR  45   1.698   9.667  10.660
  338   1HB   TYR  45          2HB       TYR  45  -0.216  11.239  10.360
  339   2HB   TYR  45          1HB       TYR  45   0.323  12.110  11.790
  340    HD1  TYR  45           1HD      TYR  45   2.635  10.695   9.285
  341    HD2  TYR  45           2HD      TYR  45   0.689  14.206  10.697
  342    HE1  TYR  45           1HE      TYR  45   4.110  12.070   7.879
  343    HE2  TYR  45           2HE      TYR  45   2.159  15.590   9.293
  344    HH   TYR  45           HH       TYR  45   4.289  15.483   8.191
  345    H    ASP  46           H        ASP  46   3.765  10.404  10.951
  346    HA   ASP  46           HA       ASP  46   4.512  11.196  13.688
  347   1HB   ASP  46          2HB       ASP  46   5.229   8.891  13.240
  348   2HB   ASP  46          1HB       ASP  46   6.078   9.429  11.793
  349    H    ASP  47           H        ASP  47   4.362  13.399  12.997
  350    HA   ASP  47           HA       ASP  47   5.520  14.605  10.827
  351   1HB   ASP  47          2HB       ASP  47   5.453  15.714  13.641
  352   2HB   ASP  47          1HB       ASP  47   5.640  16.657  12.165
  353    H    ALA  48           H        ALA  48   7.089  13.579  13.802
  354    HA   ALA  48           HA       ALA  48   9.522  14.837  13.631
  355   1HB   ALA  48          1HB       ALA  48   9.562  11.980  14.418
  356   2HB   ALA  48          2HB       ALA  48   8.509  13.066  15.325
  357   3HB   ALA  48          3HB       ALA  48  10.240  13.393  15.229
  358    H    THR  49           H        THR  49   8.387  12.103  11.743
  359    HA   THR  49           HA       THR  49  10.946  12.154  10.282
  360    HB   THR  49           HB       THR  49  10.598   9.760   9.782
  361    HG1  THR  49           1HG      THR  49   8.349  10.119  11.455
  362   1HG2  THR  49          1HG2      THR  49  11.979  10.298  11.700
  363   2HG2  THR  49          2HG2      THR  49  11.038   8.836  11.992
  364   3HG2  THR  49          3HG2      THR  49  10.548  10.362  12.728
  365    H    LYS  50           H        LYS  50   8.044  13.331   9.922
  366    HA   LYS  50           HA       LYS  50   6.604  13.745   8.170
  367   1HB   LYS  50          2HB       LYS  50   9.242  13.331   6.763
  368   2HB   LYS  50          1HB       LYS  50   7.794  13.852   5.915
  369   1HG   LYS  50          2HG       LYS  50   8.797  15.358   8.296
  370   2HG   LYS  50          1HG       LYS  50   9.496  15.615   6.697
  371   1HD   LYS  50          2HD       LYS  50   6.577  15.905   7.412
  372   2HD   LYS  50          1HD       LYS  50   7.717  17.232   7.180
  373   1HE   LYS  50          2HE       LYS  50   6.762  15.249   5.120
  374   2HE   LYS  50          1HE       LYS  50   6.455  16.984   5.166
  375   1HZ   LYS  50          1HZ       LYS  50   8.171  16.499   3.575
  376   2HZ   LYS  50          2HZ       LYS  50   9.088  15.679   4.735
  377   3HZ   LYS  50          3HZ       LYS  50   8.850  17.349   4.872
  378    H    THR  51           H        THR  51   6.686  11.001   9.087
  379    HA   THR  51           HA       THR  51   5.979   9.642   6.574
  380    HB   THR  51           HB       THR  51   7.307   8.450   9.012
  381    HG1  THR  51           1HG      THR  51   9.006   8.085   7.520
  382   1HG2  THR  51          1HG2      THR  51   6.747   6.423   8.348
  383   2HG2  THR  51          2HG2      THR  51   7.373   6.743   6.732
  384   3HG2  THR  51          3HG2      THR  51   5.700   7.135   7.123
  385    H    PHE  52           H        PHE  52   4.193   8.352   6.545
  386    HA   PHE  52           HA       PHE  52   2.414   8.533   8.890
  387   1HB   PHE  52          2HB       PHE  52   1.617   8.010   6.016
  388   2HB   PHE  52          1HB       PHE  52   0.545   8.349   7.369
  389    HD1  PHE  52           1HD      PHE  52  -0.349  10.453   7.471
  390    HD2  PHE  52           2HD      PHE  52   3.458   9.926   5.645
  391    HE1  PHE  52           1HE      PHE  52  -0.300  12.845   6.886
  392    HE2  PHE  52           2HE      PHE  52   3.516  12.315   5.066
  393    HZ   PHE  52           HZ       PHE  52   1.636  13.777   5.688
  394    H    THR  53           H        THR  53   1.390   6.632   9.618
  395    HA   THR  53           HA       THR  53   2.320   4.160   8.328
  396    HB   THR  53           HB       THR  53   2.055   3.188  10.730
  397    HG1  THR  53           1HG      THR  53   2.673   5.871  11.366
  398   1HG2  THR  53          1HG2      THR  53   4.414   4.125  11.304
  399   2HG2  THR  53          2HG2      THR  53   4.345   4.745   9.654
  400   3HG2  THR  53          3HG2      THR  53   4.189   3.010   9.954
  401    H    VAL  54           H        VAL  54   0.838   2.865   7.634
  402    HA   VAL  54           HA       VAL  54  -1.935   3.198   8.562
  403    HB   VAL  54           HB       VAL  54  -0.931   1.854   6.042
  404   1HG1  VAL  54          1HG1      VAL  54  -2.946   0.866   6.176
  405   2HG1  VAL  54          2HG1      VAL  54  -3.543   2.423   5.603
  406   3HG1  VAL  54          3HG1      VAL  54  -3.568   2.048   7.327
  407   1HG2  VAL  54          1HG2      VAL  54  -0.517   4.119   5.689
  408   2HG2  VAL  54          2HG2      VAL  54  -1.953   4.620   6.581
  409   3HG2  VAL  54          3HG2      VAL  54  -2.118   3.881   4.989
  410    H    THR  55           H        THR  55  -2.497   1.751  10.071
  411    HA   THR  55           HA       THR  55  -1.272  -0.912   9.938
  412    HB   THR  55           HB       THR  55  -2.658   0.201  12.360
  413    HG1  THR  55           1HG      THR  55  -0.982   1.643  11.743
  414   1HG2  THR  55          1HG2      THR  55  -1.208  -1.291  13.577
  415   2HG2  THR  55          2HG2      THR  55  -0.412  -1.784  12.081
  416   3HG2  THR  55          3HG2      THR  55  -2.106  -2.195  12.357
  417    H    GLU  56           H        GLU  56  -2.472  -2.513   9.237
  418    HA   GLU  56           HA       GLU  56  -5.175  -2.320   8.589
  419   1HB   GLU  56          2HB       GLU  56  -3.672  -3.974   7.592
  420   2HB   GLU  56          1HB       GLU  56  -3.528  -4.794   9.142
  421   1HG   GLU  56          2HG       GLU  56  -5.942  -5.286   9.073
  422   2HG   GLU  56          1HG       GLU  56  -6.025  -4.535   7.481
  423   1H    MET   1          1HT       MET   1   7.571  18.379  -3.473
  424   2H    MET   1          2HT       MET   1   6.796  19.646  -2.666
  425   3H    MET   1          3HT       MET   1   5.928  18.258  -3.093
  426    HA   MET   1           HA       MET   1   8.262  18.081  -1.306
  427   1HB   MET   1          2HB       MET   1   6.480  19.809  -0.583
  428   2HB   MET   1          1HB       MET   1   5.432  18.423  -0.330
  429   1HG   MET   1          2HG       MET   1   6.839  17.555   1.364
  430   2HG   MET   1          1HG       MET   1   8.118  18.706   0.981
  431   1HE   MET   1          1HE       MET   1   6.905  19.830   4.547
  432   2HE   MET   1          2HE       MET   1   8.335  19.541   3.554
  433   3HE   MET   1          3HE       MET   1   7.204  18.228   3.877
  434    H    GLN   2           H        GLN   2   8.583  16.014  -0.681
  435    HA   GLN   2           HA       GLN   2   6.522  14.050  -1.439
  436   1HB   GLN   2          2HB       GLN   2   8.605  13.814  -2.702
  437   2HB   GLN   2          1HB       GLN   2   9.515  13.687  -1.202
  438   1HG   GLN   2          2HG       GLN   2   8.337  11.618  -0.662
  439   2HG   GLN   2          1HG       GLN   2   7.423  11.745  -2.161
  440   1HE2  GLN   2          1HE2      GLN   2  10.437  12.891  -2.850
  441   2HE2  GLN   2          2HE2      GLN   2  11.167  11.437  -3.422
  442    H    TYR   3           H        TYR   3   6.061  12.329  -0.063
  443    HA   TYR   3           HA       TYR   3   7.119  12.533   2.672
  444   1HB   TYR   3          2HB       TYR   3   4.220  12.159   1.898
  445   2HB   TYR   3          1HB       TYR   3   4.848  12.035   3.539
  446    HD1  TYR   3           1HD      TYR   3   4.649  13.890   4.888
  447    HD2  TYR   3           2HD      TYR   3   4.883  14.447   0.676
  448    HE1  TYR   3           1HE      TYR   3   4.321  16.304   5.196
  449    HE2  TYR   3           2HE      TYR   3   4.562  16.870   0.974
  450    HH   TYR   3           HH       TYR   3   3.766  18.247   4.097
  451    H    LYS   4           H        LYS   4   7.190  10.593   3.846
  452    HA   LYS   4           HA       LYS   4   7.210   8.202   2.154
  453   1HB   LYS   4          2HB       LYS   4   9.283   8.717   3.344
  454   2HB   LYS   4          1HB       LYS   4   8.423   8.715   4.876
  455   1HG   LYS   4          2HG       LYS   4   9.603   6.654   4.674
  456   2HG   LYS   4          1HG       LYS   4   7.880   6.319   4.502
  457   1HD   LYS   4          2HD       LYS   4   9.132   5.061   2.856
  458   2HD   LYS   4          1HD       LYS   4   8.157   6.293   2.052
  459   1HE   LYS   4          2HE       LYS   4  10.098   7.725   1.826
  460   2HE   LYS   4          1HE       LYS   4  11.083   6.574   2.726
  461   1HZ   LYS   4          1HZ       LYS   4   9.774   5.391   0.466
  462   2HZ   LYS   4          2HZ       LYS   4  11.403   5.347   0.913
  463   3HZ   LYS   4          3HZ       LYS   4  10.807   6.656   0.026
  464    H    VAL   5           H        VAL   5   5.328   7.126   2.171
  465    HA   VAL   5           HA       VAL   5   3.768   7.020   4.644
  466    HB   VAL   5           HB       VAL   5   3.013   6.064   1.875
  467   1HG1  VAL   5          1HG1      VAL   5   1.713   4.824   3.381
  468   2HG1  VAL   5          2HG1      VAL   5   0.679   6.179   2.924
  469   3HG1  VAL   5          3HG1      VAL   5   1.518   6.193   4.476
  470   1HG2  VAL   5          1HG2      VAL   5   3.266   8.668   2.713
  471   2HG2  VAL   5          2HG2      VAL   5   1.556   8.331   2.986
  472   3HG2  VAL   5          3HG2      VAL   5   2.254   8.107   1.382
  473    H    ILE   6           H        ILE   6   3.719   5.272   5.889
  474    HA   ILE   6           HA       ILE   6   5.005   2.816   4.906
  475    HB   ILE   6           HB       ILE   6   4.674   3.881   7.712
  476   1HG1  ILE   6          2HG1      ILE   6   7.131   3.345   6.032
  477   2HG1  ILE   6          1HG1      ILE   6   6.452   4.931   6.380
  478   1HG2  ILE   6          1HG2      ILE   6   4.583   1.700   8.268
  479   2HG2  ILE   6          2HG2      ILE   6   6.328   1.789   8.028
  480   3HG2  ILE   6          3HG2      ILE   6   5.292   1.167   6.743
  481   1HD1  ILE   6          1HD1      ILE   6   8.060   3.138   8.083
  482   2HD1  ILE   6          2HD1      ILE   6   6.788   4.066   8.876
  483   3HD1  ILE   6          3HD1      ILE   6   8.050   4.897   7.969
  484    H    LEU   7           H        LEU   7   3.825   1.021   4.677
  485    HA   LEU   7           HA       LEU   7   1.103   1.002   5.790
  486   1HB   LEU   7          2HB       LEU   7   2.081  -0.823   3.612
  487   2HB   LEU   7          1HB       LEU   7   0.437  -0.329   3.974
  488    HG   LEU   7           HG       LEU   7   2.577   1.410   2.763
  489   1HD1  LEU   7          1HD1      LEU   7   1.586  -0.360   1.303
  490   2HD1  LEU   7          2HD1      LEU   7   1.315   1.291   0.749
  491   3HD1  LEU   7          3HD1      LEU   7   0.015   0.403   1.546
  492   1HD2  LEU   7          1HD2      LEU   7   0.989   2.578   4.306
  493   2HD2  LEU   7          2HD2      LEU   7  -0.323   2.068   3.244
  494   3HD2  LEU   7          3HD2      LEU   7   0.942   3.137   2.635
  495    H    ASN   8           H        ASN   8   1.442   0.127   7.800
  496    HA   ASN   8           HA       ASN   8   2.861  -2.440   7.974
  497   1HB   ASN   8          2HB       ASN   8   2.077  -0.433  10.087
  498   2HB   ASN   8          1HB       ASN   8   2.741  -2.016  10.467
  499   1HD2  ASN   8          1HD2      ASN   8   4.194  -1.188   7.662
  500   2HD2  ASN   8          2HD2      ASN   8   5.607  -0.421   8.282
  501    H    GLY   9           H        GLY   9   1.544  -4.146   7.676
  502   1HA   GLY   9          2HA       GLY   9  -1.087  -4.081   9.022
  503   2HA   GLY   9          1HA       GLY   9  -0.759  -4.991   7.557
  504    H    LYS  10           H        LYS  10  -1.781  -6.678   8.985
  505    HA   LYS  10           HA       LYS  10  -0.163  -7.753  11.101
  506   1HB   LYS  10          2HB       LYS  10  -2.551  -8.938   9.671
  507   2HB   LYS  10          1HB       LYS  10  -1.829  -9.570  11.143
  508   1HG   LYS  10          2HG       LYS  10  -2.416  -7.509  12.318
  509   2HG   LYS  10          1HG       LYS  10  -3.142  -6.878  10.840
  510   1HD   LYS  10          2HD       LYS  10  -4.744  -8.735  10.842
  511   2HD   LYS  10          1HD       LYS  10  -4.019  -9.354  12.326
  512   1HE   LYS  10          2HE       LYS  10  -5.357  -6.672  11.999
  513   2HE   LYS  10          1HE       LYS  10  -6.061  -8.085  12.782
  514   1HZ   LYS  10          1HZ       LYS  10  -3.786  -7.854  14.137
  515   2HZ   LYS  10          2HZ       LYS  10  -5.227  -7.105  14.612
  516   3HZ   LYS  10          3HZ       LYS  10  -4.058  -6.226  13.763
  517    H    THR  11           H        THR  11  -1.180  -8.999   7.918
  518    HA   THR  11           HA       THR  11   1.122 -10.806   7.927
  519    HB   THR  11           HB       THR  11  -0.212 -11.761   5.911
  520    HG1  THR  11           1HG      THR  11  -2.471 -11.355   6.157
  521   1HG2  THR  11          1HG2      THR  11  -0.605 -12.150   8.768
  522   2HG2  THR  11          2HG2      THR  11  -0.422 -13.334   7.472
  523   3HG2  THR  11          3HG2      THR  11  -1.999 -12.612   7.792
  524    H    LEU  12           H        LEU  12   0.503  -7.792   6.928
  525    HA   LEU  12           HA       LEU  12   2.280  -8.076   4.623
  526   1HB   LEU  12          2HB       LEU  12   0.026  -7.903   3.732
  527   2HB   LEU  12          1HB       LEU  12  -0.258  -6.450   4.669
  528    HG   LEU  12           HG       LEU  12   1.310  -5.210   3.345
  529   1HD1  LEU  12          1HD1      LEU  12   2.237  -7.868   2.663
  530   2HD1  LEU  12          2HD1      LEU  12   3.080  -6.328   2.594
  531   3HD1  LEU  12          3HD1      LEU  12   2.055  -6.836   1.249
  532   1HD2  LEU  12          1HD2      LEU  12  -0.174  -4.887   1.720
  533   2HD2  LEU  12          2HD2      LEU  12  -1.067  -6.253   2.385
  534   3HD2  LEU  12          3HD2      LEU  12   0.078  -6.505   1.068
  535    H    LYS  13           H        LYS  13   3.806  -6.552   4.434
  536    HA   LYS  13           HA       LYS  13   3.620  -4.090   5.991
  537   1HB   LYS  13          2HB       LYS  13   5.912  -6.044   6.278
  538   2HB   LYS  13          1HB       LYS  13   5.867  -4.426   6.968
  539   1HG   LYS  13          2HG       LYS  13   3.950  -5.060   8.343
  540   2HG   LYS  13          1HG       LYS  13   3.989  -6.682   7.647
  541   1HD   LYS  13          2HD       LYS  13   6.209  -5.396   9.237
  542   2HD   LYS  13          1HD       LYS  13   5.077  -6.607   9.845
  543   1HE   LYS  13          2HE       LYS  13   7.046  -6.989   7.591
  544   2HE   LYS  13          1HE       LYS  13   7.212  -7.620   9.229
  545   1HZ   LYS  13          1HZ       LYS  13   4.828  -8.590   8.566
  546   2HZ   LYS  13          2HZ       LYS  13   6.275  -9.426   8.303
  547   3HZ   LYS  13          3HZ       LYS  13   5.555  -8.561   7.039
  548    H    GLY  14           H        GLY  14   4.890  -2.396   5.170
  549   1HA   GLY  14          2HA       GLY  14   6.935  -2.709   3.267
  550   2HA   GLY  14          1HA       GLY  14   5.418  -2.487   2.413
  551    H    GLU  15           H        GLU  15   6.720  -0.611   1.624
  552    HA   GLU  15           HA       GLU  15   6.009   1.731   3.215
  553   1HB   GLU  15          2HB       GLU  15   8.773   1.276   2.072
  554   2HB   GLU  15          1HB       GLU  15   8.211   2.772   2.807
  555   1HG   GLU  15          2HG       GLU  15   7.898   1.611   4.932
  556   2HG   GLU  15          1HG       GLU  15   8.464   0.113   4.195
  557    H    THR  16           H        THR  16   5.823   3.663   1.986
  558    HA   THR  16           HA       THR  16   6.087   3.507  -0.891
  559    HB   THR  16           HB       THR  16   3.936   2.651  -0.912
  560    HG1  THR  16           1HG      THR  16   3.402   5.405  -0.764
  561   1HG2  THR  16          1HG2      THR  16   3.191   2.549   1.265
  562   2HG2  THR  16          2HG2      THR  16   2.095   3.722   0.538
  563   3HG2  THR  16          3HG2      THR  16   3.437   4.271   1.538
  564    H    THR  17           H        THR  17   5.392   5.661  -1.923
  565    HA   THR  17           HA       THR  17   5.696   7.915  -0.082
  566    HB   THR  17           HB       THR  17   7.450   8.912  -1.515
  567    HG1  THR  17           1HG      THR  17   7.545   6.353  -2.730
  568   1HG2  THR  17          1HG2      THR  17   8.335   6.198  -0.600
  569   2HG2  THR  17          2HG2      THR  17   8.033   7.541   0.500
  570   3HG2  THR  17          3HG2      THR  17   9.292   7.672  -0.728
  571    H    THR  18           H        THR  18   4.229   9.388  -0.506
  572    HA   THR  18           HA       THR  18   3.141   9.644  -3.245
  573    HB   THR  18           HB       THR  18   1.514   9.064  -1.446
  574    HG1  THR  18           1HG      THR  18   0.922  10.343  -3.289
  575   1HG2  THR  18          1HG2      THR  18   2.353  11.712  -0.309
  576   2HG2  THR  18          2HG2      THR  18   2.324  10.139   0.490
  577   3HG2  THR  18          3HG2      THR  18   0.811  10.941   0.066
  578    H    GLU  19           H        GLU  19   3.097  11.657  -4.230
  579    HA   GLU  19           HA       GLU  19   4.748  13.728  -2.948
  580   1HB   GLU  19          2HB       GLU  19   5.541  12.930  -5.128
  581   2HB   GLU  19          1HB       GLU  19   3.995  13.345  -5.855
  582   1HG   GLU  19          2HG       GLU  19   5.620  15.025  -6.397
  583   2HG   GLU  19          1HG       GLU  19   4.405  15.710  -5.320
  584    H    ALA  20           H        ALA  20   3.639  15.355  -2.005
  585    HA   ALA  20           HA       ALA  20   1.393  16.520  -3.435
  586   1HB   ALA  20          1HB       ALA  20   0.961  15.867  -0.552
  587   2HB   ALA  20          2HB       ALA  20   0.630  14.664  -1.798
  588   3HB   ALA  20          3HB       ALA  20  -0.222  16.208  -1.815
  589    H    VAL  21           H        VAL  21   0.867  18.602  -2.811
  590    HA   VAL  21           HA       VAL  21   2.908  20.331  -2.203
  591    HB   VAL  21           HB       VAL  21   0.009  20.856  -1.551
  592   1HG1  VAL  21          1HG1      VAL  21   1.703  22.505  -0.736
  593   2HG1  VAL  21          2HG1      VAL  21   0.516  23.163  -1.860
  594   3HG1  VAL  21          3HG1      VAL  21   2.146  22.791  -2.418
  595   1HG2  VAL  21          1HG2      VAL  21   0.072  21.867  -3.917
  596   2HG2  VAL  21          2HG2      VAL  21  -0.071  20.116  -3.755
  597   3HG2  VAL  21          3HG2      VAL  21   1.486  20.839  -4.156
  598    H    ASP  22           H        ASP  22   0.966  18.520   0.027
  599    HA   ASP  22           HA       ASP  22   2.702  19.290   2.191
  600   1HB   ASP  22          2HB       ASP  22   1.004  20.179   3.693
  601   2HB   ASP  22          1HB       ASP  22   1.104  21.158   2.234
  602    H    ALA  23           H        ALA  23   1.810  18.279   4.348
  603    HA   ALA  23           HA       ALA  23   1.796  15.524   4.000
  604   1HB   ALA  23          1HB       ALA  23   0.579  16.113   6.497
  605   2HB   ALA  23          2HB       ALA  23   1.810  17.333   6.180
  606   3HB   ALA  23          3HB       ALA  23   2.241  15.624   6.171
  607    H    ALA  24           H        ALA  24  -0.920  17.720   4.564
  608    HA   ALA  24           HA       ALA  24  -2.894  15.723   4.811
  609   1HB   ALA  24          1HB       ALA  24  -2.872  18.639   4.338
  610   2HB   ALA  24          2HB       ALA  24  -3.816  17.681   5.477
  611   3HB   ALA  24          3HB       ALA  24  -4.311  17.780   3.788
  612    H    THR  25           H        THR  25  -2.019  17.731   1.985
  613    HA   THR  25           HA       THR  25  -3.636  16.515   0.106
  614    HB   THR  25           HB       THR  25  -1.903  17.225  -1.552
  615    HG1  THR  25           1HG      THR  25  -0.435  17.575   0.794
  616   1HG2  THR  25          1HG2      THR  25  -1.740  19.683  -0.678
  617   2HG2  THR  25          2HG2      THR  25  -2.910  19.103   0.507
  618   3HG2  THR  25          3HG2      THR  25  -3.279  19.008  -1.214
  619    H    ALA  26           H        ALA  26  -0.377  15.630   1.192
  620    HA   ALA  26           HA       ALA  26  -0.024  13.399  -0.480
  621   1HB   ALA  26          1HB       ALA  26   1.489  12.632   1.496
  622   2HB   ALA  26          2HB       ALA  26   1.133  14.229   2.155
  623   3HB   ALA  26          3HB       ALA  26   1.924  14.079   0.586
  624    H    GLU  27           H        GLU  27  -1.191  13.628   2.889
  625    HA   GLU  27           HA       GLU  27  -1.814  10.987   3.325
  626   1HB   GLU  27          2HB       GLU  27  -1.879  12.705   5.066
  627   2HB   GLU  27          1HB       GLU  27  -3.280  13.439   4.301
  628   1HG   GLU  27          2HG       GLU  27  -4.581  11.422   4.739
  629   2HG   GLU  27          1HG       GLU  27  -3.176  10.683   5.505
  630    H    LYS  28           H        LYS  28  -3.896  13.536   1.961
  631    HA   LYS  28           HA       LYS  28  -6.178  11.960   1.578
  632   1HB   LYS  28          2HB       LYS  28  -5.224  14.358   0.001
  633   2HB   LYS  28          1HB       LYS  28  -6.845  13.680  -0.079
  634   1HG   LYS  28          2HG       LYS  28  -5.540  14.940   2.323
  635   2HG   LYS  28          1HG       LYS  28  -6.849  15.614   1.349
  636   1HD   LYS  28          2HD       LYS  28  -8.289  13.744   2.006
  637   2HD   LYS  28          1HD       LYS  28  -6.978  13.084   2.985
  638   1HE   LYS  28          2HE       LYS  28  -6.994  15.104   4.367
  639   2HE   LYS  28          1HE       LYS  28  -8.300  15.767   3.386
  640   1HZ   LYS  28          1HZ       LYS  28  -9.322  13.401   4.106
  641   2HZ   LYS  28          2HZ       LYS  28  -9.586  14.840   4.952
  642   3HZ   LYS  28          3HZ       LYS  28  -8.390  13.763   5.472
  643    H    VAL  29           H        VAL  29  -3.417  12.608  -0.528
  644    HA   VAL  29           HA       VAL  29  -4.316  11.311  -2.826
  645    HB   VAL  29           HB       VAL  29  -1.488  11.515  -1.767
  646   1HG1  VAL  29          1HG1      VAL  29  -1.334   9.850  -3.373
  647   2HG1  VAL  29          2HG1      VAL  29  -0.988  11.314  -4.293
  648   3HG1  VAL  29          3HG1      VAL  29  -2.586  10.573  -4.386
  649   1HG2  VAL  29          1HG2      VAL  29  -2.266  13.189  -4.030
  650   2HG2  VAL  29          2HG2      VAL  29  -1.396  13.608  -2.554
  651   3HG2  VAL  29          3HG2      VAL  29  -3.158  13.546  -2.552
  652    H    VAL  30           H        VAL  30  -2.769  10.068   0.071
  653    HA   VAL  30           HA       VAL  30  -2.395   7.418  -0.845
  654    HB   VAL  30           HB       VAL  30  -2.842   8.322   2.003
  655   1HG1  VAL  30          1HG1      VAL  30  -1.937   6.314   2.697
  656   2HG1  VAL  30          2HG1      VAL  30  -1.119   6.033   1.160
  657   3HG1  VAL  30          3HG1      VAL  30  -2.865   5.820   1.281
  658   1HG2  VAL  30          1HG2      VAL  30  -1.009   9.572   1.651
  659   2HG2  VAL  30          2HG2      VAL  30  -0.584   8.711   0.172
  660   3HG2  VAL  30          3HG2      VAL  30  -0.151   8.035   1.742
  661    H    LYS  31           H        LYS  31  -4.995   8.967   1.074
  662    HA   LYS  31           HA       LYS  31  -6.617   6.777   1.485
  663   1HB   LYS  31          2HB       LYS  31  -7.258   9.677   1.078
  664   2HB   LYS  31          1HB       LYS  31  -8.554   8.504   1.250
  665   1HG   LYS  31          2HG       LYS  31  -8.099   9.519   3.377
  666   2HG   LYS  31          1HG       LYS  31  -7.615   7.824   3.423
  667   1HD   LYS  31          2HD       LYS  31  -5.278   8.542   2.977
  668   2HD   LYS  31          1HD       LYS  31  -5.817  10.217   3.099
  669   1HE   LYS  31          2HE       LYS  31  -6.036   8.139   5.273
  670   2HE   LYS  31          1HE       LYS  31  -4.822   9.414   5.195
  671   1HZ   LYS  31          1HZ       LYS  31  -6.674   9.978   6.667
  672   2HZ   LYS  31          2HZ       LYS  31  -7.753   9.863   5.369
  673   3HZ   LYS  31          3HZ       LYS  31  -6.559  11.060   5.372
  674    H    GLN  32           H        GLN  32  -6.458   8.878  -1.355
  675    HA   GLN  32           HA       GLN  32  -8.518   7.556  -2.797
  676   1HB   GLN  32          2HB       GLN  32  -7.710   9.833  -3.359
  677   2HB   GLN  32          1HB       GLN  32  -6.170   9.149  -3.857
  678   1HG   GLN  32          2HG       GLN  32  -7.483   9.604  -5.798
  679   2HG   GLN  32          1HG       GLN  32  -7.339   7.859  -5.600
  680   1HE2  GLN  32          1HE2      GLN  32  -9.487   9.127  -3.329
  681   2HE2  GLN  32          2HE2      GLN  32 -10.956   8.793  -4.168
  682    H    PHE  33           H        PHE  33  -5.041   7.181  -2.566
  683    HA   PHE  33           HA       PHE  33  -4.534   5.371  -4.595
  684   1HB   PHE  33          2HB       PHE  33  -2.844   6.501  -3.132
  685   2HB   PHE  33          1HB       PHE  33  -3.281   5.394  -1.837
  686    HD1  PHE  33           1HD      PHE  33  -1.964   5.499  -5.298
  687    HD2  PHE  33           2HD      PHE  33  -2.190   3.342  -1.624
  688    HE1  PHE  33           1HE      PHE  33  -0.294   3.891  -6.126
  689    HE2  PHE  33           2HE      PHE  33  -0.519   1.743  -2.461
  690    HZ   PHE  33           HZ       PHE  33   0.428   2.025  -4.719
  691    H    PHE  34           H        PHE  34  -5.141   4.605  -1.201
  692    HA   PHE  34           HA       PHE  34  -5.517   1.810  -1.683
  693   1HB   PHE  34          2HB       PHE  34  -6.139   3.472   0.758
  694   2HB   PHE  34          1HB       PHE  34  -6.174   1.706   0.697
  695    HD1  PHE  34           1HD      PHE  34  -3.906   0.945  -0.810
  696    HD2  PHE  34           2HD      PHE  34  -4.277   4.150   1.960
  697    HE1  PHE  34           1HE      PHE  34  -1.480   0.893  -0.435
  698    HE2  PHE  34           2HE      PHE  34  -1.849   4.095   2.349
  699    HZ   PHE  34           HZ       PHE  34  -0.454   2.475   1.133
  700    H    ASN  35           H        ASN  35  -7.711   4.526  -1.232
  701    HA   ASN  35           HA       ASN  35 -10.144   3.221  -1.013
  702   1HB   ASN  35          2HB       ASN  35  -9.989   5.637  -0.870
  703   2HB   ASN  35          1HB       ASN  35  -9.438   5.744  -2.539
  704   1HD2  ASN  35          1HD2      ASN  35 -11.911   6.511  -0.776
  705   2HD2  ASN  35          2HD2      ASN  35 -13.232   6.194  -1.841
  706    H    ASP  36           H        ASP  36  -8.165   3.865  -3.826
  707    HA   ASP  36           HA       ASP  36 -10.066   2.557  -5.612
  708   1HB   ASP  36          2HB       ASP  36  -7.485   4.015  -6.205
  709   2HB   ASP  36          1HB       ASP  36  -8.554   3.326  -7.425
  710    H    ASN  37           H        ASN  37  -7.006   1.859  -4.067
  711    HA   ASN  37           HA       ASN  37  -6.373  -0.305  -5.875
  712   1HB   ASN  37          2HB       ASN  37  -5.215   0.423  -3.174
  713   2HB   ASN  37          1HB       ASN  37  -4.626  -0.895  -4.179
  714   1HD2  ASN  37          1HD2      ASN  37  -3.508   1.754  -3.195
  715   2HD2  ASN  37          2HD2      ASN  37  -2.845   2.470  -4.623
  716    H    GLY  38           H        GLY  38  -7.615   0.072  -2.625
  717   1HA   GLY  38          2HA       GLY  38  -8.034  -1.911  -1.216
  718   2HA   GLY  38          1HA       GLY  38  -9.503  -1.274  -1.917
  719    H    VAL  39           H        VAL  39 -10.798  -2.718  -2.717
  720    HA   VAL  39           HA       VAL  39  -9.918  -5.420  -3.051
  721    HB   VAL  39           HB       VAL  39 -12.635  -4.174  -3.313
  722   1HG1  VAL  39          1HG1      VAL  39 -13.260  -6.713  -2.959
  723   2HG1  VAL  39          2HG1      VAL  39 -11.705  -6.970  -3.749
  724   3HG1  VAL  39          3HG1      VAL  39 -12.973  -6.064  -4.574
  725   1HG2  VAL  39          1HG2      VAL  39 -11.531  -4.198  -1.071
  726   2HG2  VAL  39          2HG2      VAL  39 -11.533  -5.961  -1.161
  727   3HG2  VAL  39          3HG2      VAL  39 -13.058  -5.077  -1.151
  728    H    ASP  40           H        ASP  40 -11.639  -3.230  -5.352
  729    HA   ASP  40           HA       ASP  40 -11.074  -5.154  -7.442
  730   1HB   ASP  40          2HB       ASP  40 -12.645  -2.576  -7.495
  731   2HB   ASP  40          1HB       ASP  40 -12.516  -3.711  -8.835
  732    H    GLY  41           H        GLY  41  -8.843  -3.503  -6.316
  733   1HA   GLY  41          2HA       GLY  41  -8.136  -1.518  -8.206
  734   2HA   GLY  41          1HA       GLY  41  -7.029  -2.328  -7.110
  735    H    GLU  42           H        GLU  42  -6.839  -1.559 -10.008
  736    HA   GLU  42           HA       GLU  42  -6.791  -4.006 -11.504
  737   1HB   GLU  42          2HB       GLU  42  -5.515  -1.326 -12.093
  738   2HB   GLU  42          1HB       GLU  42  -5.635  -2.659 -13.233
  739   1HG   GLU  42          2HG       GLU  42  -7.967  -1.213 -11.994
  740   2HG   GLU  42          1HG       GLU  42  -7.331  -0.934 -13.615
  741    H    TRP  43           H        TRP  43  -5.501  -5.464 -10.389
  742    HA   TRP  43           HA       TRP  43  -2.689  -4.715  -9.979
  743   1HB   TRP  43          2HB       TRP  43  -4.173  -7.112  -8.902
  744   2HB   TRP  43          1HB       TRP  43  -2.545  -6.613  -8.475
  745    HD1  TRP  43           HD       TRP  43  -4.822  -3.655  -8.567
  746    HE1  TRP  43           1HE      TRP  43  -5.498  -3.003  -6.170
  747    HE3  TRP  43           3HE      TRP  43  -3.130  -7.788  -6.109
  748    HZ2  TRP  43           2HZ      TRP  43  -5.332  -4.103  -3.582
  749    HZ3  TRP  43           3HZ      TRP  43  -3.415  -7.913  -3.677
  750    HH2  TRP  43           HH       TRP  43  -4.498  -6.109  -2.435
  751    H    THR  44           H        THR  44  -1.084  -5.637 -11.093
  752    HA   THR  44           HA       THR  44  -1.725  -7.936 -12.819
  753    HB   THR  44           HB       THR  44   0.163  -7.174 -14.250
  754    HG1  THR  44           1HG      THR  44   1.161  -5.948 -12.481
  755   1HG2  THR  44          1HG2      THR  44  -0.867  -5.076 -15.117
  756   2HG2  THR  44          2HG2      THR  44  -2.018  -5.164 -13.783
  757   3HG2  THR  44          3HG2      THR  44  -1.967  -6.449 -14.991
  758    H    TYR  45           H        TYR  45  -0.338  -9.720 -12.754
  759    HA   TYR  45           HA       TYR  45   1.612  -9.656 -10.547
  760   1HB   TYR  45          2HB       TYR  45  -0.343 -11.179 -10.275
  761   2HB   TYR  45          1HB       TYR  45   0.194 -12.064 -11.697
  762    HD1  TYR  45           1HD      TYR  45   2.506 -10.704  -9.160
  763    HD2  TYR  45           2HD      TYR  45   0.495 -14.168 -10.600
  764    HE1  TYR  45           1HE      TYR  45   3.925 -12.115  -7.733
  765    HE2  TYR  45           2HE      TYR  45   1.910 -15.586  -9.175
  766    HH   TYR  45           HH       TYR  45   4.026 -15.531  -8.043
  767    H    ASP  46           H        ASP  46   3.665 -10.441 -10.809
  768    HA   ASP  46           HA       ASP  46   4.432 -11.253 -13.536
  769   1HB   ASP  46          2HB       ASP  46   5.198  -8.965 -13.076
  770   2HB   ASP  46          1HB       ASP  46   6.014  -9.524 -11.619
  771    H    ASP  47           H        ASP  47   4.219 -13.451 -12.848
  772    HA   ASP  47           HA       ASP  47   5.315 -14.684 -10.662
  773   1HB   ASP  47          2HB       ASP  47   5.263 -15.792 -13.477
  774   2HB   ASP  47          1HB       ASP  47   5.404 -16.738 -11.999
  775    H    ALA  48           H        ALA  48   6.952 -13.697 -13.612
  776    HA   ALA  48           HA       ALA  48   9.351 -15.013 -13.408
  777   1HB   ALA  48          1HB       ALA  48   9.471 -12.159 -14.195
  778   2HB   ALA  48          2HB       ALA  48   8.406 -13.219 -15.118
  779   3HB   ALA  48          3HB       ALA  48  10.126 -13.589 -14.996
  780    H    THR  49           H        THR  49   8.254 -12.252 -11.536
  781    HA   THR  49           HA       THR  49  10.791 -12.366 -10.039
  782    HB   THR  49           HB       THR  49  10.495  -9.963  -9.543
  783    HG1  THR  49           1HG      THR  49   8.263 -10.268 -11.249
  784   1HG2  THR  49          1HG2      THR  49  11.890 -10.536 -11.441
  785   2HG2  THR  49          2HG2      THR  49  10.989  -9.051 -11.747
  786   3HG2  THR  49          3HG2      THR  49  10.472 -10.565 -12.490
  787    H    LYS  50           H        LYS  50   7.857 -13.472  -9.721
  788    HA   LYS  50           HA       LYS  50   6.383 -13.851  -7.990
  789   1HB   LYS  50          2HB       LYS  50   9.010 -13.500  -6.546
  790   2HB   LYS  50          1HB       LYS  50   7.539 -13.985  -5.719
  791   1HG   LYS  50          2HG       LYS  50   8.536 -15.516  -8.086
  792   2HG   LYS  50          1HG       LYS  50   9.206 -15.790  -6.475
  793   1HD   LYS  50          2HD       LYS  50   6.292 -16.009  -7.232
  794   2HD   LYS  50          1HD       LYS  50   7.397 -17.363  -6.983
  795   1HE   LYS  50          2HE       LYS  50   6.462 -15.358  -4.937
  796   2HE   LYS  50          1HE       LYS  50   6.113 -17.083  -4.987
  797   1HZ   LYS  50          1HZ       LYS  50   7.819 -16.642  -3.372
  798   2HZ   LYS  50          2HZ       LYS  50   8.770 -15.843  -4.519
  799   3HZ   LYS  50          3HZ       LYS  50   8.495 -17.506  -4.661
  800    H    THR  51           H        THR  51   6.544 -11.110  -8.904
  801    HA   THR  51           HA       THR  51   5.835  -9.733  -6.400
  802    HB   THR  51           HB       THR  51   7.227  -8.573  -8.820
  803    HG1  THR  51           1HG      THR  51   8.912  -8.249  -7.305
  804   1HG2  THR  51          1HG2      THR  51   6.705  -6.534  -8.163
  805   2HG2  THR  51          2HG2      THR  51   7.301  -6.869  -6.539
  806   3HG2  THR  51          3HG2      THR  51   5.625  -7.220  -6.952
  807    H    PHE  52           H        PHE  52   4.081  -8.400  -6.397
  808    HA   PHE  52           HA       PHE  52   2.333  -8.538  -8.767
  809   1HB   PHE  52          2HB       PHE  52   1.505  -7.995  -5.906
  810   2HB   PHE  52          1HB       PHE  52   0.447  -8.309  -7.274
  811    HD1  PHE  52           1HD      PHE  52  -0.497 -10.391  -7.387
  812    HD2  PHE  52           2HD      PHE  52   3.297  -9.957  -5.508
  813    HE1  PHE  52           1HE      PHE  52  -0.515 -12.783  -6.803
  814    HE2  PHE  52           2HE      PHE  52   3.287 -12.345  -4.929
  815    HZ   PHE  52           HZ       PHE  52   1.381 -13.762  -5.577
  816    H    THR  53           H        THR  53   1.365  -6.613  -9.509
  817    HA   THR  53           HA       THR  53   2.336  -4.164  -8.206
  818    HB   THR  53           HB       THR  53   2.128  -3.185 -10.612
  819    HG1  THR  53           1HG      THR  53   2.690  -5.883 -11.238
  820   1HG2  THR  53          1HG2      THR  53   4.472  -4.180 -11.153
  821   2HG2  THR  53          2HG2      THR  53   4.363  -4.797  -9.504
  822   3HG2  THR  53          3HG2      THR  53   4.254  -3.061  -9.804
  823    H    VAL  54           H        VAL  54   0.876  -2.832  -7.533
  824    HA   VAL  54           HA       VAL  54  -1.891  -3.099  -8.500
  825    HB   VAL  54           HB       VAL  54  -0.891  -1.779  -5.965
  826   1HG1  VAL  54          1HG1      VAL  54  -2.878  -0.742  -6.128
  827   2HG1  VAL  54          2HG1      VAL  54  -3.521  -2.286  -5.564
  828   3HG1  VAL  54          3HG1      VAL  54  -3.511  -1.910  -7.288
  829   1HG2  VAL  54          1HG2      VAL  54  -0.536  -4.053  -5.607
  830   2HG2  VAL  54          2HG2      VAL  54  -1.972  -4.520  -6.519
  831   3HG2  VAL  54          3HG2      VAL  54  -2.140  -3.777  -4.929
  832    H    THR  55           H        THR  55  -2.396  -1.639 -10.015
  833    HA   THR  55           HA       THR  55  -1.109   0.993  -9.866
  834    HB   THR  55           HB       THR  55  -2.486  -0.086 -12.308
  835    HG1  THR  55           1HG      THR  55  -0.856  -1.567 -11.666
  836   1HG2  THR  55          1HG2      THR  55  -0.985   1.371 -13.504
  837   2HG2  THR  55          2HG2      THR  55  -0.198   1.844 -11.996
  838   3HG2  THR  55          3HG2      THR  55  -1.877   2.297 -12.296
  839    H    GLU  56           H        GLU  56  -2.279   2.624  -9.180
  840    HA   GLU  56           HA       GLU  56  -4.996   2.496  -8.571
  841   1HB   GLU  56          2HB       GLU  56  -3.466   4.114  -7.554
  842   2HB   GLU  56          1HB       GLU  56  -3.281   4.930  -9.101
  843   1HG   GLU  56          2HG       GLU  56  -5.684   5.481  -9.067
  844   2HG   GLU  56          1HG       GLU  56  -5.807   4.732  -7.475
  Start of MODEL    6
    1   1H    MET   1          1HT       MET   1   6.257 -18.289   2.873
    2   2H    MET   1          2HT       MET   1   6.711 -19.697   2.051
    3   3H    MET   1          3HT       MET   1   5.178 -19.026   1.799
    4    HA   MET   1           HA       MET   1   7.792 -18.135   0.814
    5   1HB   MET   1          2HB       MET   1   5.023 -18.513  -0.321
    6   2HB   MET   1          1HB       MET   1   6.307 -17.716  -1.219
    7   1HG   MET   1          2HG       MET   1   7.649 -19.714  -1.153
    8   2HG   MET   1          1HG       MET   1   6.447 -20.525  -0.148
    9   1HE   MET   1          1HE       MET   1   5.779 -19.300  -4.545
   10   2HE   MET   1          2HE       MET   1   7.252 -18.978  -3.631
   11   3HE   MET   1          3HE       MET   1   5.761 -18.128  -3.228
   12    H    GLN   2           H        GLN   2   8.306 -16.053   0.510
   13    HA   GLN   2           HA       GLN   2   6.438 -14.028   1.520
   14   1HB   GLN   2          2HB       GLN   2   8.635 -14.095   2.626
   15   2HB   GLN   2          1HB       GLN   2   9.429 -13.869   1.074
   16   1HG   GLN   2          2HG       GLN   2   8.391 -11.675   0.855
   17   2HG   GLN   2          1HG       GLN   2   7.580 -11.900   2.400
   18   1HE2  GLN   2          1HE2      GLN   2  10.523 -13.330   2.745
   19   2HE2  GLN   2          2HE2      GLN   2  11.411 -12.002   3.395
   20    H    TYR   3           H        TYR   3   5.812 -12.317   0.233
   21    HA   TYR   3           HA       TYR   3   6.767 -12.395  -2.553
   22   1HB   TYR   3          2HB       TYR   3   3.949 -11.871  -1.593
   23   2HB   TYR   3          1HB       TYR   3   4.489 -11.752  -3.265
   24    HD1  TYR   3           1HD      TYR   3   4.478 -13.639  -4.649
   25    HD2  TYR   3           2HD      TYR   3   4.159 -14.144  -0.438
   26    HE1  TYR   3           1HE      TYR   3   3.993 -16.027  -4.980
   27    HE2  TYR   3           2HE      TYR   3   3.676 -16.533  -0.755
   28    HH   TYR   3           HH       TYR   3   3.968 -18.274  -2.382
   29    H    LYS   4           H        LYS   4   6.977 -10.475  -3.646
   30    HA   LYS   4           HA       LYS   4   7.112  -8.091  -1.946
   31   1HB   LYS   4          2HB       LYS   4   9.171  -8.650  -3.122
   32   2HB   LYS   4          1HB       LYS   4   8.317  -8.687  -4.658
   33   1HG   LYS   4          2HG       LYS   4   9.554  -6.642  -4.488
   34   2HG   LYS   4          1HG       LYS   4   7.829  -6.280  -4.407
   35   1HD   LYS   4          2HD       LYS   4   9.063  -4.973  -2.766
   36   2HD   LYS   4          1HD       LYS   4   7.983  -6.116  -1.968
   37   1HE   LYS   4          2HE       LYS   4   9.839  -7.622  -1.555
   38   2HE   LYS   4          1HE       LYS   4  10.930  -6.555  -2.436
   39   1HZ   LYS   4          1HZ       LYS   4  11.162  -5.231  -0.674
   40   2HZ   LYS   4          2HZ       LYS   4  10.513  -6.503   0.232
   41   3HZ   LYS   4          3HZ       LYS   4   9.511  -5.248  -0.302
   42    H    VAL   5           H        VAL   5   5.189  -7.070  -1.953
   43    HA   VAL   5           HA       VAL   5   3.663  -6.933  -4.435
   44    HB   VAL   5           HB       VAL   5   2.908  -6.050  -1.645
   45   1HG1  VAL   5          1HG1      VAL   5   0.675  -5.742  -2.475
   46   2HG1  VAL   5          2HG1      VAL   5   1.142  -6.324  -4.073
   47   3HG1  VAL   5          3HG1      VAL   5   1.775  -4.792  -3.472
   48   1HG2  VAL   5          1HG2      VAL   5   2.754  -8.606  -3.062
   49   2HG2  VAL   5          2HG2      VAL   5   1.241  -8.096  -2.312
   50   3HG2  VAL   5          3HG2      VAL   5   2.700  -8.259  -1.334
   51    H    ILE   6           H        ILE   6   4.113  -5.362  -5.743
   52    HA   ILE   6           HA       ILE   6   5.160  -2.820  -4.758
   53    HB   ILE   6           HB       ILE   6   4.902  -3.893  -7.574
   54   1HG1  ILE   6          2HG1      ILE   6   7.322  -3.545  -5.793
   55   2HG1  ILE   6          1HG1      ILE   6   6.561  -5.078  -6.203
   56   1HG2  ILE   6          1HG2      ILE   6   5.691  -1.961  -8.422
   57   2HG2  ILE   6          2HG2      ILE   6   6.692  -1.623  -7.012
   58   3HG2  ILE   6          3HG2      ILE   6   4.966  -1.274  -6.971
   59   1HD1  ILE   6          1HD1      ILE   6   8.509  -4.811  -7.547
   60   2HD1  ILE   6          2HD1      ILE   6   7.996  -3.204  -8.063
   61   3HD1  ILE   6          3HD1      ILE   6   7.097  -4.628  -8.587
   62    H    LEU   7           H        LEU   7   3.966  -1.020  -4.658
   63    HA   LEU   7           HA       LEU   7   1.282  -1.071  -5.870
   64   1HB   LEU   7          2HB       LEU   7   2.164   0.762  -3.651
   65   2HB   LEU   7          1HB       LEU   7   0.531   0.318  -4.114
   66    HG   LEU   7           HG       LEU   7   2.530  -1.506  -2.790
   67   1HD1  LEU   7          1HD1      LEU   7  -0.048  -0.474  -1.650
   68   2HD1  LEU   7          2HD1      LEU   7   1.477   0.386  -1.444
   69   3HD1  LEU   7          3HD1      LEU   7   1.299  -1.252  -0.814
   70   1HD2  LEU   7          1HD2      LEU   7  -0.382  -2.040  -3.306
   71   2HD2  LEU   7          2HD2      LEU   7   0.866  -3.171  -2.784
   72   3HD2  LEU   7          3HD2      LEU   7   0.882  -2.535  -4.429
   73    H    ASN   8           H        ASN   8   1.413  -0.043  -7.814
   74    HA   ASN   8           HA       ASN   8   2.974   2.445  -7.948
   75   1HB   ASN   8          2HB       ASN   8   2.042   0.656 -10.198
   76   2HB   ASN   8          1HB       ASN   8   3.038   2.097 -10.373
   77   1HD2  ASN   8          1HD2      ASN   8   5.102   1.702 -10.614
   78   2HD2  ASN   8          2HD2      ASN   8   5.966   0.349  -9.976
   79    H    GLY   9           H        GLY   9   1.717   4.190  -7.625
   80   1HA   GLY   9          2HA       GLY   9  -0.916   4.227  -8.965
   81   2HA   GLY   9          1HA       GLY   9  -0.549   5.117  -7.496
   82    H    LYS  10           H        LYS  10  -1.520   6.824  -8.966
   83    HA   LYS  10           HA       LYS  10   0.165   7.832 -11.048
   84   1HB   LYS  10          2HB       LYS  10  -2.197   9.106  -9.653
   85   2HB   LYS  10          1HB       LYS  10  -1.421   9.727 -11.103
   86   1HG   LYS  10          2HG       LYS  10  -2.057   7.695 -12.310
   87   2HG   LYS  10          1HG       LYS  10  -2.852   7.090 -10.854
   88   1HD   LYS  10          2HD       LYS  10  -4.373   9.005 -10.888
   89   2HD   LYS  10          1HD       LYS  10  -3.572   9.620 -12.335
   90   1HE   LYS  10          2HE       LYS  10  -5.638   8.457 -12.905
   91   2HE   LYS  10          1HE       LYS  10  -4.234   7.615 -13.559
   92   1HZ   LYS  10          1HZ       LYS  10  -5.897   6.131 -12.526
   93   2HZ   LYS  10          2HZ       LYS  10  -5.597   6.865 -11.031
   94   3HZ   LYS  10          3HZ       LYS  10  -4.366   6.007 -11.813
   95    H    THR  11           H        THR  11  -0.763   8.989  -7.809
   96    HA   THR  11           HA       THR  11   1.553  10.779  -7.808
   97    HB   THR  11           HB       THR  11   0.251  11.743  -5.795
   98    HG1  THR  11           1HG      THR  11  -1.192   9.880  -5.767
   99   1HG2  THR  11          1HG2      THR  11  -1.600  12.558  -7.633
  100   2HG2  THR  11          2HG2      THR  11  -0.222  12.112  -8.638
  101   3HG2  THR  11          3HG2      THR  11  -0.027  13.304  -7.353
  102    H    LEU  12           H        LEU  12   0.910   7.748  -6.866
  103    HA   LEU  12           HA       LEU  12   2.664   7.994  -4.539
  104   1HB   LEU  12          2HB       LEU  12   0.394   7.825  -3.682
  105   2HB   LEU  12          1HB       LEU  12   0.125   6.371  -4.623
  106    HG   LEU  12           HG       LEU  12   1.686   5.136  -3.284
  107   1HD1  LEU  12          1HD1      LEU  12   3.436   6.223  -2.460
  108   2HD1  LEU  12          2HD1      LEU  12   2.375   6.801  -1.173
  109   3HD1  LEU  12          3HD1      LEU  12   2.626   7.778  -2.615
  110   1HD2  LEU  12          1HD2      LEU  12   0.160   4.794  -1.705
  111   2HD2  LEU  12          2HD2      LEU  12  -0.703   6.200  -2.331
  112   3HD2  LEU  12          3HD2      LEU  12   0.441   6.385  -1.000
  113    H    LYS  13           H        LYS  13   4.159   6.448  -4.310
  114    HA   LYS  13           HA       LYS  13   4.000   4.010  -5.907
  115   1HB   LYS  13          2HB       LYS  13   6.448   5.781  -5.994
  116   2HB   LYS  13          1HB       LYS  13   6.192   4.284  -6.876
  117   1HG   LYS  13          2HG       LYS  13   5.788   5.823  -8.515
  118   2HG   LYS  13          1HG       LYS  13   4.159   5.571  -7.889
  119   1HD   LYS  13          2HD       LYS  13   4.542   7.933  -8.179
  120   2HD   LYS  13          1HD       LYS  13   4.446   7.573  -6.457
  121   1HE   LYS  13          2HE       LYS  13   6.881   7.598  -6.306
  122   2HE   LYS  13          1HE       LYS  13   6.990   7.922  -8.035
  123   1HZ   LYS  13          1HZ       LYS  13   7.141   9.863  -6.362
  124   2HZ   LYS  13          2HZ       LYS  13   5.455   9.736  -6.299
  125   3HZ   LYS  13          3HZ       LYS  13   6.224  10.061  -7.770
  126    H    GLY  14           H        GLY  14   5.117   2.272  -4.990
  127   1HA   GLY  14          2HA       GLY  14   7.073   2.566  -2.965
  128   2HA   GLY  14          1HA       GLY  14   5.501   2.316  -2.227
  129    H    GLU  15           H        GLU  15   7.007   0.478  -1.454
  130    HA   GLU  15           HA       GLU  15   6.321  -1.880  -3.045
  131   1HB   GLU  15          2HB       GLU  15   9.058  -1.358  -1.864
  132   2HB   GLU  15          1HB       GLU  15   8.538  -2.886  -2.555
  133   1HG   GLU  15          2HG       GLU  15   9.865  -1.772  -4.171
  134   2HG   GLU  15          1HG       GLU  15   8.193  -1.709  -4.723
  135    H    THR  16           H        THR  16   5.646  -3.579  -1.847
  136    HA   THR  16           HA       THR  16   6.065  -3.508   1.047
  137    HB   THR  16           HB       THR  16   3.957  -2.579   1.065
  138    HG1  THR  16           1HG      THR  16   3.306  -5.307   0.895
  139   1HG2  THR  16          1HG2      THR  16   3.047  -4.353  -1.180
  140   2HG2  THR  16          2HG2      THR  16   3.536  -2.670  -1.356
  141   3HG2  THR  16          3HG2      THR  16   2.119  -3.082  -0.388
  142    H    THR  17           H        THR  17   5.331  -5.639   2.090
  143    HA   THR  17           HA       THR  17   5.568  -7.896   0.242
  144    HB   THR  17           HB       THR  17   7.323  -8.928   1.641
  145    HG1  THR  17           1HG      THR  17   6.861  -7.634   3.529
  146   1HG2  THR  17          1HG2      THR  17   8.628  -6.394   1.024
  147   2HG2  THR  17          2HG2      THR  17   7.703  -7.087  -0.307
  148   3HG2  THR  17          3HG2      THR  17   8.982  -8.027   0.462
  149    H    THR  18           H        THR  18   4.064  -9.317   0.663
  150    HA   THR  18           HA       THR  18   3.047  -9.629   3.423
  151    HB   THR  18           HB       THR  18   1.371  -8.968   1.707
  152    HG1  THR  18           1HG      THR  18   0.799 -10.308   3.498
  153   1HG2  THR  18          1HG2      THR  18   0.679 -11.101   0.279
  154   2HG2  THR  18          2HG2      THR  18   2.426 -11.338   0.300
  155   3HG2  THR  18          3HG2      THR  18   1.747  -9.841  -0.337
  156    H    GLU  19           H        GLU  19   2.922 -11.710   4.315
  157    HA   GLU  19           HA       GLU  19   4.530 -13.748   2.915
  158   1HB   GLU  19          2HB       GLU  19   5.414 -13.042   5.094
  159   2HB   GLU  19          1HB       GLU  19   3.889 -13.466   5.861
  160   1HG   GLU  19          2HG       GLU  19   4.234 -15.807   5.266
  161   2HG   GLU  19          1HG       GLU  19   5.760 -15.384   4.490
  162    H    ALA  20           H        ALA  20   3.381 -15.335   1.974
  163    HA   ALA  20           HA       ALA  20   1.142 -16.497   3.418
  164   1HB   ALA  20          1HB       ALA  20   0.421 -14.566   1.820
  165   2HB   ALA  20          2HB       ALA  20  -0.509 -16.063   1.885
  166   3HB   ALA  20          3HB       ALA  20   0.632 -15.791   0.568
  167    H    VAL  21           H        VAL  21   0.533 -18.539   2.717
  168    HA   VAL  21           HA       VAL  21   2.520 -20.307   2.035
  169    HB   VAL  21           HB       VAL  21  -0.387 -20.751   1.372
  170   1HG1  VAL  21          1HG1      VAL  21   1.999 -22.460   1.565
  171   2HG1  VAL  21          2HG1      VAL  21   0.522 -22.668   0.623
  172   3HG1  VAL  21          3HG1      VAL  21   0.544 -23.092   2.335
  173   1HG2  VAL  21          1HG2      VAL  21   1.034 -20.670   3.993
  174   2HG2  VAL  21          2HG2      VAL  21  -0.292 -21.809   3.760
  175   3HG2  VAL  21          3HG2      VAL  21  -0.571 -20.077   3.561
  176    H    ASP  22           H        ASP  22   0.286 -18.661  -0.141
  177    HA   ASP  22           HA       ASP  22   2.032 -19.377  -2.373
  178   1HB   ASP  22          2HB       ASP  22   0.005 -19.930  -3.790
  179   2HB   ASP  22          1HB       ASP  22   0.444 -21.125  -2.575
  180    H    ALA  23           H        ALA  23   1.302 -18.225  -4.441
  181    HA   ALA  23           HA       ALA  23   1.357 -15.476  -3.989
  182   1HB   ALA  23          1HB       ALA  23   0.852 -15.273  -6.418
  183   2HB   ALA  23          2HB       ALA  23   0.574 -17.013  -6.461
  184   3HB   ALA  23          3HB       ALA  23   2.171 -16.385  -6.056
  185    H    ALA  24           H        ALA  24  -1.358 -17.607  -4.750
  186    HA   ALA  24           HA       ALA  24  -3.294 -15.571  -5.019
  187   1HB   ALA  24          1HB       ALA  24  -3.277 -18.473  -4.860
  188   2HB   ALA  24          2HB       ALA  24  -4.369 -17.399  -5.734
  189   3HB   ALA  24          3HB       ALA  24  -4.669 -17.773  -4.035
  190    H    THR  25           H        THR  25  -2.574 -17.704  -2.232
  191    HA   THR  25           HA       THR  25  -4.270 -16.494  -0.405
  192    HB   THR  25           HB       THR  25  -2.603 -17.306   1.321
  193    HG1  THR  25           1HG      THR  25  -0.750 -17.113   0.008
  194   1HG2  THR  25          1HG2      THR  25  -4.337 -18.815   0.736
  195   2HG2  THR  25          2HG2      THR  25  -2.822 -19.719   0.756
  196   3HG2  THR  25          3HG2      THR  25  -3.537 -19.231  -0.780
  197    H    ALA  26           H        ALA  26  -0.948 -15.699  -1.324
  198    HA   ALA  26           HA       ALA  26  -0.574 -13.553   0.456
  199   1HB   ALA  26          1HB       ALA  26   1.072 -12.774  -1.372
  200   2HB   ALA  26          2HB       ALA  26   0.650 -14.279  -2.188
  201   3HB   ALA  26          3HB       ALA  26   1.374 -14.320  -0.580
  202    H    GLU  27           H        GLU  27  -1.622 -13.600  -2.965
  203    HA   GLU  27           HA       GLU  27  -2.103 -10.927  -3.343
  204   1HB   GLU  27          2HB       GLU  27  -2.266 -12.587  -5.132
  205   2HB   GLU  27          1HB       GLU  27  -3.712 -13.258  -4.392
  206   1HG   GLU  27          2HG       GLU  27  -4.884 -11.147  -4.772
  207   2HG   GLU  27          1HG       GLU  27  -3.433 -10.480  -5.517
  208    H    LYS  28           H        LYS  28  -4.302 -13.379  -2.020
  209    HA   LYS  28           HA       LYS  28  -6.488 -11.658  -1.582
  210   1HB   LYS  28          2HB       LYS  28  -5.715 -14.199  -0.132
  211   2HB   LYS  28          1HB       LYS  28  -7.283 -13.409  -0.021
  212   1HG   LYS  28          2HG       LYS  28  -6.057 -14.657  -2.468
  213   2HG   LYS  28          1HG       LYS  28  -7.439 -15.251  -1.545
  214   1HD   LYS  28          2HD       LYS  28  -8.687 -13.222  -2.132
  215   2HD   LYS  28          1HD       LYS  28  -7.308 -12.655  -3.075
  216   1HE   LYS  28          2HE       LYS  28  -7.506 -14.592  -4.545
  217   2HE   LYS  28          1HE       LYS  28  -8.862 -15.191  -3.589
  218   1HZ   LYS  28          1HZ       LYS  28  -9.971 -14.118  -5.242
  219   2HZ   LYS  28          2HZ       LYS  28  -8.763 -12.959  -5.480
  220   3HZ   LYS  28          3HZ       LYS  28  -9.812 -12.829  -4.159
  221    H    VAL  29           H        VAL  29  -3.824 -12.693   0.511
  222    HA   VAL  29           HA       VAL  29  -4.619 -11.353   2.833
  223    HB   VAL  29           HB       VAL  29  -1.812 -11.936   1.861
  224   1HG1  VAL  29          1HG1      VAL  29  -1.581 -11.962   4.521
  225   2HG1  VAL  29          2HG1      VAL  29  -2.863 -10.761   4.363
  226   3HG1  VAL  29          3HG1      VAL  29  -1.317 -10.513   3.552
  227   1HG2  VAL  29          1HG2      VAL  29  -2.955 -13.560   4.014
  228   2HG2  VAL  29          2HG2      VAL  29  -2.033 -14.045   2.590
  229   3HG2  VAL  29          3HG2      VAL  29  -3.764 -13.744   2.457
  230    H    VAL  30           H        VAL  30  -2.780 -10.284   0.031
  231    HA   VAL  30           HA       VAL  30  -2.133  -7.715   1.067
  232    HB   VAL  30           HB       VAL  30  -2.380  -8.549  -1.828
  233   1HG1  VAL  30          1HG1      VAL  30  -2.221  -6.044  -1.041
  234   2HG1  VAL  30          2HG1      VAL  30  -1.277  -6.620  -2.415
  235   3HG1  VAL  30          3HG1      VAL  30  -0.516  -6.446  -0.836
  236   1HG2  VAL  30          1HG2      VAL  30  -0.345  -9.517  -1.757
  237   2HG2  VAL  30          2HG2      VAL  30  -0.731  -9.721  -0.047
  238   3HG2  VAL  30          3HG2      VAL  30   0.274  -8.370  -0.569
  239    H    LYS  31           H        LYS  31  -4.676  -8.893  -1.176
  240    HA   LYS  31           HA       LYS  31  -5.983  -6.498  -1.613
  241   1HB   LYS  31          2HB       LYS  31  -7.115  -9.281  -1.360
  242   2HB   LYS  31          1HB       LYS  31  -8.079  -7.897  -1.854
  243   1HG   LYS  31          2HG       LYS  31  -6.504  -7.548  -3.738
  244   2HG   LYS  31          1HG       LYS  31  -5.698  -9.050  -3.282
  245   1HD   LYS  31          2HD       LYS  31  -7.232  -9.553  -5.042
  246   2HD   LYS  31          1HD       LYS  31  -7.902 -10.207  -3.545
  247   1HE   LYS  31          2HE       LYS  31  -9.638  -9.111  -4.839
  248   2HE   LYS  31          1HE       LYS  31  -9.341  -8.233  -3.338
  249   1HZ   LYS  31          1HZ       LYS  31  -8.116  -6.587  -4.510
  250   2HZ   LYS  31          2HZ       LYS  31  -9.572  -6.808  -5.342
  251   3HZ   LYS  31          3HZ       LYS  31  -8.144  -7.481  -5.945
  252    H    GLN  32           H        GLN  32  -6.313  -8.760   1.070
  253    HA   GLN  32           HA       GLN  32  -8.406  -7.455   2.422
  254   1HB   GLN  32          2HB       GLN  32  -7.585  -9.735   2.982
  255   2HB   GLN  32          1HB       GLN  32  -6.112  -9.024   3.623
  256   1HG   GLN  32          2HG       GLN  32  -7.590  -9.579   5.427
  257   2HG   GLN  32          1HG       GLN  32  -7.437  -7.830   5.307
  258   1HE2  GLN  32          1HE2      GLN  32  -9.378  -9.059   2.823
  259   2HE2  GLN  32          2HE2      GLN  32 -10.915  -8.739   3.537
  260    H    PHE  33           H        PHE  33  -4.951  -6.970   2.362
  261    HA   PHE  33           HA       PHE  33  -4.572  -5.222   4.477
  262   1HB   PHE  33          2HB       PHE  33  -2.820  -6.267   2.984
  263   2HB   PHE  33          1HB       PHE  33  -3.223  -5.058   1.771
  264    HD1  PHE  33           1HD      PHE  33  -2.139  -5.352   5.312
  265    HD2  PHE  33           2HD      PHE  33  -2.035  -3.084   1.705
  266    HE1  PHE  33           1HE      PHE  33  -0.520  -3.801   6.321
  267    HE2  PHE  33           2HE      PHE  33  -0.413  -1.540   2.723
  268    HZ   PHE  33           HZ       PHE  33   0.340  -1.910   5.042
  269    H    PHE  34           H        PHE  34  -4.972  -4.300   1.082
  270    HA   PHE  34           HA       PHE  34  -5.518  -1.558   1.625
  271   1HB   PHE  34          2HB       PHE  34  -6.113  -3.137  -0.880
  272   2HB   PHE  34          1HB       PHE  34  -6.022  -1.378  -0.748
  273    HD1  PHE  34           1HD      PHE  34  -3.746  -0.735   0.693
  274    HD2  PHE  34           2HD      PHE  34  -4.292  -4.010  -1.955
  275    HE1  PHE  34           1HE      PHE  34  -1.316  -0.853   0.349
  276    HE2  PHE  34           2HE      PHE  34  -1.864  -4.133  -2.317
  277    HZ   PHE  34           HZ       PHE  34  -0.380  -2.555  -1.147
  278    H    ASN  35           H        ASN  35  -7.549  -4.353   0.997
  279    HA   ASN  35           HA       ASN  35 -10.045  -3.208   0.703
  280   1HB   ASN  35          2HB       ASN  35  -9.517  -5.642   0.590
  281   2HB   ASN  35          1HB       ASN  35  -9.356  -5.663   2.342
  282   1HD2  ASN  35          1HD2      ASN  35 -11.256  -6.675   0.091
  283   2HD2  ASN  35          2HD2      ASN  35 -12.817  -6.465   0.804
  284    H    ASP  36           H        ASP  36  -8.157  -3.815   3.578
  285    HA   ASP  36           HA       ASP  36 -10.182  -2.637   5.323
  286   1HB   ASP  36          2HB       ASP  36  -7.572  -4.014   5.974
  287   2HB   ASP  36          1HB       ASP  36  -8.700  -3.389   7.173
  288    H    ASN  37           H        ASN  37  -7.126  -1.763   3.883
  289    HA   ASN  37           HA       ASN  37  -6.593   0.349   5.785
  290   1HB   ASN  37          2HB       ASN  37  -5.362  -0.243   3.084
  291   2HB   ASN  37          1HB       ASN  37  -4.830   1.049   4.151
  292   1HD2  ASN  37          1HD2      ASN  37  -3.639  -1.557   3.092
  293   2HD2  ASN  37          2HD2      ASN  37  -2.986  -2.295   4.513
  294    H    GLY  38           H        GLY  38  -7.833   0.062   2.527
  295   1HA   GLY  38          2HA       GLY  38  -8.214   2.134   1.199
  296   2HA   GLY  38          1HA       GLY  38  -9.690   1.421   1.809
  297    H    VAL  39           H        VAL  39 -11.048   2.751   2.733
  298    HA   VAL  39           HA       VAL  39 -10.237   5.454   3.240
  299    HB   VAL  39           HB       VAL  39 -12.929   4.141   3.290
  300   1HG1  VAL  39          1HG1      VAL  39 -13.614   5.875   4.539
  301   2HG1  VAL  39          2HG1      VAL  39 -13.370   6.851   3.091
  302   3HG1  VAL  39          3HG1      VAL  39 -12.098   6.747   4.307
  303   1HG2  VAL  39          1HG2      VAL  39 -11.981   6.244   1.394
  304   2HG2  VAL  39          2HG2      VAL  39 -13.262   5.048   1.185
  305   3HG2  VAL  39          3HG2      VAL  39 -11.569   4.549   1.134
  306    H    ASP  40           H        ASP  40 -11.969   3.087   5.372
  307    HA   ASP  40           HA       ASP  40 -11.594   4.920   7.558
  308   1HB   ASP  40          2HB       ASP  40 -12.921   2.216   7.418
  309   2HB   ASP  40          1HB       ASP  40 -12.899   3.246   8.845
  310    H    GLY  41           H        GLY  41  -9.180   3.476   6.433
  311   1HA   GLY  41          2HA       GLY  41  -8.389   1.584   8.430
  312   2HA   GLY  41          1HA       GLY  41  -7.326   2.361   7.262
  313    H    GLU  42           H        GLU  42  -6.457   1.946   9.875
  314    HA   GLU  42           HA       GLU  42  -6.841   4.436  11.327
  315   1HB   GLU  42          2HB       GLU  42  -5.121   2.031  11.968
  316   2HB   GLU  42          1HB       GLU  42  -5.417   3.391  13.043
  317   1HG   GLU  42          2HG       GLU  42  -7.785   2.834  13.114
  318   2HG   GLU  42          1HG       GLU  42  -7.506   1.484  12.014
  319    H    TRP  43           H        TRP  43  -5.836   6.025  10.083
  320    HA   TRP  43           HA       TRP  43  -3.061   5.636   9.301
  321   1HB   TRP  43          2HB       TRP  43  -4.966   7.920   8.781
  322   2HB   TRP  43          1HB       TRP  43  -3.336   7.794   8.128
  323    HD1  TRP  43           HD       TRP  43  -6.256   5.237   8.176
  324    HE1  TRP  43           1HE      TRP  43  -6.603   4.389   5.771
  325    HE3  TRP  43           3HE      TRP  43  -2.704   8.044   5.850
  326    HZ2  TRP  43           2HZ      TRP  43  -5.493   4.864   3.213
  327    HZ3  TRP  43           3HZ      TRP  43  -2.401   7.794   3.430
  328    HH2  TRP  43           HH       TRP  43  -3.766   6.239   2.133
  329    H    THR  44           H        THR  44  -1.502   6.125  10.682
  330    HA   THR  44           HA       THR  44  -1.876   8.417  12.495
  331    HB   THR  44           HB       THR  44  -0.044   7.392  13.848
  332    HG1  THR  44           1HG      THR  44  -0.392   5.162  12.135
  333   1HG2  THR  44          1HG2      THR  44  -1.352   5.245  14.474
  334   2HG2  THR  44          2HG2      THR  44  -2.577   5.890  13.380
  335   3HG2  THR  44          3HG2      THR  44  -2.064   6.829  14.783
  336    H    TYR  45           H        TYR  45  -0.406  10.093  12.416
  337    HA   TYR  45           HA       TYR  45   1.610   9.901  10.274
  338   1HB   TYR  45          2HB       TYR  45  -0.231  11.497   9.854
  339   2HB   TYR  45          1HB       TYR  45   0.201  12.364  11.321
  340    HD1  TYR  45           1HD      TYR  45   2.619  10.962   8.896
  341    HD2  TYR  45           2HD      TYR  45   0.704  14.468  10.357
  342    HE1  TYR  45           1HE      TYR  45   4.186  12.348   7.604
  343    HE2  TYR  45           2HE      TYR  45   2.264  15.864   9.069
  344    HH   TYR  45           HH       TYR  45   4.350  14.566   6.679
  345    H    ASP  46           H        ASP  46   3.679  10.661  10.595
  346    HA   ASP  46           HA       ASP  46   4.374  11.458  13.344
  347   1HB   ASP  46          2HB       ASP  46   5.100   9.149  12.915
  348   2HB   ASP  46          1HB       ASP  46   5.980   9.686  11.487
  349    H    ASP  47           H        ASP  47   4.248  13.653  12.655
  350    HA   ASP  47           HA       ASP  47   5.382  14.885  10.508
  351   1HB   ASP  47          2HB       ASP  47   5.420  15.940  13.344
  352   2HB   ASP  47          1HB       ASP  47   5.565  16.908  11.882
  353    H    ALA  48           H        ALA  48   7.044  13.733  13.380
  354    HA   ALA  48           HA       ALA  48   9.469  14.990  13.202
  355   1HB   ALA  48          1HB       ALA  48   8.630  12.317  14.188
  356   2HB   ALA  48          2HB       ALA  48   9.299  13.690  15.070
  357   3HB   ALA  48          3HB       ALA  48  10.354  12.680  14.082
  358    H    THR  49           H        THR  49   8.321  12.319  11.220
  359    HA   THR  49           HA       THR  49  10.778  12.587   9.616
  360    HB   THR  49           HB       THR  49  10.628  10.158   9.113
  361    HG1  THR  49           1HG      THR  49   8.375   9.981   9.696
  362   1HG2  THR  49          1HG2      THR  49  10.738   9.913  11.983
  363   2HG2  THR  49          2HG2      THR  49  11.651  11.309  11.411
  364   3HG2  THR  49          3HG2      THR  49  12.009   9.702  10.779
  365    H    LYS  50           H        LYS  50   7.770  13.466   9.474
  366    HA   LYS  50           HA       LYS  50   6.175  13.741   7.840
  367   1HB   LYS  50          2HB       LYS  50   8.627  13.376   6.099
  368   2HB   LYS  50          1HB       LYS  50   7.077  13.965   5.519
  369   1HG   LYS  50          2HG       LYS  50   8.487  15.364   7.753
  370   2HG   LYS  50          1HG       LYS  50   8.949  15.651   6.074
  371   1HD   LYS  50          2HD       LYS  50   6.686  16.347   5.540
  372   2HD   LYS  50          1HD       LYS  50   6.161  15.980   7.187
  373   1HE   LYS  50          2HE       LYS  50   6.535  18.377   6.876
  374   2HE   LYS  50          1HE       LYS  50   7.659  17.698   8.054
  375   1HZ   LYS  50          1HZ       LYS  50   9.424  18.033   6.701
  376   2HZ   LYS  50          2HZ       LYS  50   8.444  19.273   6.102
  377   3HZ   LYS  50          3HZ       LYS  50   8.544  17.801   5.275
  378    H    THR  51           H        THR  51   6.694  11.033   8.825
  379    HA   THR  51           HA       THR  51   5.963   9.452   6.455
  380    HB   THR  51           HB       THR  51   7.236   8.578   9.052
  381    HG1  THR  51           1HG      THR  51   8.819   9.432   7.867
  382   1HG2  THR  51          1HG2      THR  51   6.626   6.508   8.606
  383   2HG2  THR  51          2HG2      THR  51   7.561   6.594   7.115
  384   3HG2  THR  51          3HG2      THR  51   5.848   7.007   7.107
  385    H    PHE  52           H        PHE  52   4.296   7.959   6.566
  386    HA   PHE  52           HA       PHE  52   2.432   8.289   8.830
  387   1HB   PHE  52          2HB       PHE  52   1.689   7.720   5.953
  388   2HB   PHE  52          1HB       PHE  52   0.580   8.011   7.286
  389    HD1  PHE  52           1HD      PHE  52  -0.367  10.089   7.420
  390    HD2  PHE  52           2HD      PHE  52   3.463   9.691   5.607
  391    HE1  PHE  52           1HE      PHE  52  -0.382  12.487   6.870
  392    HE2  PHE  52           2HE      PHE  52   3.456  12.088   5.058
  393    HZ   PHE  52           HZ       PHE  52   1.531  13.490   5.690
  394    H    THR  53           H        THR  53   1.564   6.438   9.710
  395    HA   THR  53           HA       THR  53   2.441   3.901   8.512
  396    HB   THR  53           HB       THR  53   2.093   3.042  10.945
  397    HG1  THR  53           1HG      THR  53   2.508   5.810  11.368
  398   1HG2  THR  53          1HG2      THR  53   4.435   4.080  11.548
  399   2HG2  THR  53          2HG2      THR  53   4.414   4.506   9.836
  400   3HG2  THR  53          3HG2      THR  53   4.256   2.818  10.327
  401    H    VAL  54           H        VAL  54   0.920   2.618   7.789
  402    HA   VAL  54           HA       VAL  54  -1.847   3.067   8.681
  403    HB   VAL  54           HB       VAL  54  -0.867   1.707   6.157
  404   1HG1  VAL  54          1HG1      VAL  54  -3.673   2.469   6.964
  405   2HG1  VAL  54          2HG1      VAL  54  -3.017   0.833   7.012
  406   3HG1  VAL  54          3HG1      VAL  54  -3.184   1.671   5.469
  407   1HG2  VAL  54          1HG2      VAL  54  -0.673   4.302   6.528
  408   2HG2  VAL  54          2HG2      VAL  54  -2.401   4.260   6.182
  409   3HG2  VAL  54          3HG2      VAL  54  -1.251   3.647   4.996
  410    H    THR  55           H        THR  55  -2.330   1.730  10.295
  411    HA   THR  55           HA       THR  55  -1.333  -1.023  10.226
  412    HB   THR  55           HB       THR  55  -2.686   0.447  12.490
  413    HG1  THR  55           1HG      THR  55  -0.556   0.560  13.329
  414   1HG2  THR  55          1HG2      THR  55  -1.814  -1.293  13.918
  415   2HG2  THR  55          2HG2      THR  55  -1.104  -2.112  12.525
  416   3HG2  THR  55          3HG2      THR  55  -2.859  -1.989  12.679
  417    H    GLU  56           H        GLU  56  -2.631  -2.529   9.378
  418    HA   GLU  56           HA       GLU  56  -5.374  -2.004   8.853
  419   1HB   GLU  56          2HB       GLU  56  -5.491  -4.174   7.906
  420   2HB   GLU  56          1HB       GLU  56  -3.881  -3.568   7.540
  421   1HG   GLU  56          2HG       GLU  56  -2.899  -4.945   9.214
  422   2HG   GLU  56          1HG       GLU  56  -4.479  -5.402   9.848
  423   1H    MET   1          1HT       MET   1   6.740  18.186  -2.687
  424   2H    MET   1          2HT       MET   1   7.215  19.582  -1.860
  425   3H    MET   1          3HT       MET   1   5.664  18.948  -1.629
  426    HA   MET   1           HA       MET   1   8.242  17.994  -0.608
  427   1HB   MET   1          2HB       MET   1   5.467  18.438   0.489
  428   2HB   MET   1          1HB       MET   1   6.718  17.611   1.403
  429   1HG   MET   1          2HG       MET   1   8.108  19.576   1.356
  430   2HG   MET   1          1HG       MET   1   6.939  20.415   0.336
  431   1HE   MET   1          1HE       MET   1   6.182  19.205   4.723
  432   2HE   MET   1          2HE       MET   1   7.659  18.849   3.828
  433   3HE   MET   1          3HE       MET   1   6.154  18.035   3.405
  434    H    GLN   2           H        GLN   2   8.701  15.901  -0.297
  435    HA   GLN   2           HA       GLN   2   6.798  13.920  -1.335
  436   1HB   GLN   2          2HB       GLN   2   9.011  13.933  -2.409
  437   2HB   GLN   2          1HB       GLN   2   9.778  13.689  -0.845
  438   1HG   GLN   2          2HG       GLN   2   8.682  11.520  -0.640
  439   2HG   GLN   2          1HG       GLN   2   7.900  11.765  -2.199
  440   1HE2  GLN   2          1HE2      GLN   2  10.882  13.122  -2.500
  441   2HE2  GLN   2          2HE2      GLN   2  11.747  11.774  -3.138
  442    H    TYR   3           H        TYR   3   6.114  12.226  -0.057
  443    HA   TYR   3           HA       TYR   3   7.031  12.279   2.743
  444   1HB   TYR   3          2HB       TYR   3   4.214  11.824   1.742
  445   2HB   TYR   3          1HB       TYR   3   4.726  11.691   3.421
  446    HD1  TYR   3           1HD      TYR   3   4.741  13.577   4.806
  447    HD2  TYR   3           2HD      TYR   3   4.495  14.092   0.592
  448    HE1  TYR   3           1HE      TYR   3   4.312  15.975   5.131
  449    HE2  TYR   3           2HE      TYR   3   4.064  16.491   0.904
  450    HH   TYR   3           HH       TYR   3   4.376  18.223   2.535
  451    H    LYS   4           H        LYS   4   7.178  10.355   3.838
  452    HA   LYS   4           HA       LYS   4   7.279   7.968   2.138
  453   1HB   LYS   4          2HB       LYS   4   9.334   8.476   3.343
  454   2HB   LYS   4          1HB       LYS   4   8.458   8.535   4.866
  455   1HG   LYS   4          2HG       LYS   4   9.648   6.459   4.713
  456   2HG   LYS   4          1HG       LYS   4   7.917   6.141   4.609
  457   1HD   LYS   4          2HD       LYS   4   9.141   4.802   2.985
  458   2HD   LYS   4          1HD       LYS   4   8.102   5.972   2.173
  459   1HE   LYS   4          2HE       LYS   4   9.998   7.433   1.787
  460   2HE   LYS   4          1HE       LYS   4  11.050   6.339   2.681
  461   1HZ   LYS   4          1HZ       LYS   4  11.274   5.008   0.922
  462   2HZ   LYS   4          2HZ       LYS   4  10.669   6.296   0.008
  463   3HZ   LYS   4          3HZ       LYS   4   9.630   5.067   0.528
  464    H    VAL   5           H        VAL   5   5.331   6.994   2.118
  465    HA   VAL   5           HA       VAL   5   3.767   6.894   4.576
  466    HB   VAL   5           HB       VAL   5   3.031   6.029   1.776
  467   1HG1  VAL   5          1HG1      VAL   5   0.781   5.775   2.575
  468   2HG1  VAL   5          2HG1      VAL   5   1.238   6.346   4.180
  469   3HG1  VAL   5          3HG1      VAL   5   1.843   4.798   3.588
  470   1HG2  VAL   5          1HG2      VAL   5   2.917   8.588   3.194
  471   2HG2  VAL   5          2HG2      VAL   5   1.404   8.115   2.421
  472   3HG2  VAL   5          3HG2      VAL   5   2.880   8.244   1.464
  473    H    ILE   6           H        ILE   6   4.160   5.313   5.891
  474    HA   ILE   6           HA       ILE   6   5.160   2.746   4.922
  475    HB   ILE   6           HB       ILE   6   4.887   3.825   7.734
  476   1HG1  ILE   6          2HG1      ILE   6   7.323   3.417   5.987
  477   2HG1  ILE   6          1HG1      ILE   6   6.594   4.969   6.385
  478   1HG2  ILE   6          1HG2      ILE   6   5.617   1.876   8.593
  479   2HG2  ILE   6          2HG2      ILE   6   6.629   1.511   7.195
  480   3HG2  ILE   6          3HG2      ILE   6   4.894   1.207   7.131
  481   1HD1  ILE   6          1HD1      ILE   6   8.517   4.654   7.759
  482   2HD1  ILE   6          2HD1      ILE   6   7.955   3.061   8.268
  483   3HD1  ILE   6          3HD1      ILE   6   7.084   4.508   8.778
  484    H    LEU   7           H        LEU   7   3.924   0.976   4.803
  485    HA   LEU   7           HA       LEU   7   1.224   1.091   5.977
  486   1HB   LEU   7          2HB       LEU   7   2.092  -0.761   3.770
  487   2HB   LEU   7          1HB       LEU   7   0.464  -0.279   4.210
  488    HG   LEU   7           HG       LEU   7   2.526   1.496   2.916
  489   1HD1  LEU   7          1HD1      LEU   7  -0.059   0.527   1.737
  490   2HD1  LEU   7          2HD1      LEU   7   1.447  -0.370   1.554
  491   3HD1  LEU   7          3HD1      LEU   7   1.317   1.271   0.922
  492   1HD2  LEU   7          1HD2      LEU   7  -0.381   2.101   3.390
  493   2HD2  LEU   7          2HD2      LEU   7   0.903   3.201   2.886
  494   3HD2  LEU   7          3HD2      LEU   7   0.881   2.565   4.530
  495    H    ASN   8           H        ASN   8   1.304   0.062   7.923
  496    HA   ASN   8           HA       ASN   8   2.801  -2.463   8.078
  497   1HB   ASN   8          2HB       ASN   8   1.881  -0.652  10.314
  498   2HB   ASN   8          1HB       ASN   8   2.837  -2.118  10.503
  499   1HD2  ASN   8          1HD2      ASN   8   4.907  -1.775  10.774
  500   2HD2  ASN   8          2HD2      ASN   8   5.813  -0.443  10.150
  501    H    GLY   9           H        GLY   9   1.506  -4.177   7.737
  502   1HA   GLY   9          2HA       GLY   9  -1.145  -4.150   9.039
  503   2HA   GLY   9          1HA       GLY   9  -0.780  -5.049   7.575
  504    H    LYS  10           H        LYS  10  -1.812  -6.732   9.030
  505    HA   LYS  10           HA       LYS  10  -0.181  -7.781  11.135
  506   1HB   LYS  10          2HB       LYS  10  -2.554  -8.998   9.706
  507   2HB   LYS  10          1HB       LYS  10  -1.813  -9.637  11.166
  508   1HG   LYS  10          2HG       LYS  10  -2.419  -7.591  12.364
  509   2HG   LYS  10          1HG       LYS  10  -3.177  -6.967  10.898
  510   1HD   LYS  10          2HD       LYS  10  -4.745  -8.845  10.909
  511   2HD   LYS  10          1HD       LYS  10  -3.979  -9.479  12.367
  512   1HE   LYS  10          2HE       LYS  10  -6.024  -8.268  12.907
  513   2HE   LYS  10          1HE       LYS  10  -4.613  -7.460  13.582
  514   1HZ   LYS  10          1HZ       LYS  10  -6.223  -5.937  12.527
  515   2HZ   LYS  10          2HZ       LYS  10  -5.920  -6.676  11.036
  516   3HZ   LYS  10          3HZ       LYS  10  -4.681  -5.849  11.836
  517    H    THR  11           H        THR  11  -1.093  -8.917   7.884
  518    HA   THR  11           HA       THR  11   1.180 -10.762   7.914
  519    HB   THR  11           HB       THR  11  -0.118 -11.692   5.882
  520    HG1  THR  11           1HG      THR  11  -1.517  -9.798   5.833
  521   1HG2  THR  11          1HG2      THR  11  -2.012 -12.466   7.693
  522   2HG2  THR  11          2HG2      THR  11  -0.638 -12.053   8.719
  523   3HG2  THR  11          3HG2      THR  11  -0.453 -13.246   7.434
  524    H    LEU  12           H        LEU  12   0.622  -7.715   6.964
  525    HA   LEU  12           HA       LEU  12   2.404  -8.004   4.662
  526   1HB   LEU  12          2HB       LEU  12   0.149  -7.780   3.773
  527   2HB   LEU  12          1HB       LEU  12  -0.096  -6.319   4.712
  528    HG   LEU  12           HG       LEU  12   1.514  -5.123   3.394
  529   1HD1  LEU  12          1HD1      LEU  12   3.249  -6.253   2.596
  530   2HD1  LEU  12          2HD1      LEU  12   2.192  -6.805   1.295
  531   3HD1  LEU  12          3HD1      LEU  12   2.400  -7.787   2.741
  532   1HD2  LEU  12          1HD2      LEU  12   0.019  -4.743   1.793
  533   2HD2  LEU  12          2HD2      LEU  12  -0.886  -6.129   2.406
  534   3HD2  LEU  12          3HD2      LEU  12   0.272  -6.342   1.093
  535    H    LYS  13           H        LYS  13   3.937  -6.494   4.455
  536    HA   LYS  13           HA       LYS  13   3.817  -4.054   6.052
  537   1HB   LYS  13          2HB       LYS  13   6.220  -5.884   6.173
  538   2HB   LYS  13          1HB       LYS  13   5.988  -4.381   7.051
  539   1HG   LYS  13          2HG       LYS  13   5.524  -5.911   8.683
  540   2HG   LYS  13          1HG       LYS  13   3.910  -5.618   8.035
  541   1HD   LYS  13          2HD       LYS  13   4.230  -7.990   8.328
  542   2HD   LYS  13          1HD       LYS  13   4.167  -7.627   6.605
  543   1HE   LYS  13          2HE       LYS  13   6.602  -7.712   6.488
  544   2HE   LYS  13          1HE       LYS  13   6.681  -8.038   8.218
  545   1HZ   LYS  13          1HZ       LYS  13   6.806  -9.983   6.547
  546   2HZ   LYS  13          2HZ       LYS  13   5.126  -9.814   6.460
  547   3HZ   LYS  13          3HZ       LYS  13   5.865 -10.158   7.943
  548    H    GLY  14           H        GLY  14   4.988  -2.343   5.151
  549   1HA   GLY  14          2HA       GLY  14   6.965  -2.687   3.153
  550   2HA   GLY  14          1HA       GLY  14   5.411  -2.397   2.394
  551    H    GLU  15           H        GLU  15   6.971  -0.597   1.642
  552    HA   GLU  15           HA       GLU  15   6.320   1.777   3.224
  553   1HB   GLU  15          2HB       GLU  15   9.060   1.189   2.081
  554   2HB   GLU  15          1HB       GLU  15   8.568   2.729   2.767
  555   1HG   GLU  15          2HG       GLU  15   9.845   1.584   4.400
  556   2HG   GLU  15          1HG       GLU  15   8.164   1.561   4.927
  557    H    THR  16           H        THR  16   5.704   3.493   2.016
  558    HA   THR  16           HA       THR  16   6.161   3.412  -0.870
  559    HB   THR  16           HB       THR  16   4.031   2.534  -0.919
  560    HG1  THR  16           1HG      THR  16   3.446   5.277  -0.758
  561   1HG2  THR  16          1HG2      THR  16   3.135   4.330   1.313
  562   2HG2  THR  16          2HG2      THR  16   3.581   2.636   1.497
  563   3HG2  THR  16          3HG2      THR  16   2.188   3.082   0.510
  564    H    THR  17           H        THR  17   5.494   5.560  -1.924
  565    HA   THR  17           HA       THR  17   5.761   7.810  -0.071
  566    HB   THR  17           HB       THR  17   7.561   8.800  -1.446
  567    HG1  THR  17           1HG      THR  17   7.094   7.516  -3.339
  568   1HG2  THR  17          1HG2      THR  17   8.795   6.234  -0.811
  569   2HG2  THR  17          2HG2      THR  17   7.867   6.950   0.507
  570   3HG2  THR  17          3HG2      THR  17   9.180   7.859  -0.243
  571    H    THR  18           H        THR  18   4.299   9.269  -0.513
  572    HA   THR  18           HA       THR  18   3.328   9.604  -3.288
  573    HB   THR  18           HB       THR  18   1.614   8.984  -1.596
  574    HG1  THR  18           1HG      THR  18   1.098  10.337  -3.393
  575   1HG2  THR  18          1HG2      THR  18   0.953  11.135  -0.176
  576   2HG2  THR  18          2HG2      THR  18   2.706  11.326  -0.172
  577   3HG2  THR  18          3HG2      THR  18   1.980   9.847   0.454
  578    H    GLU  19           H        GLU  19   3.267  11.689  -4.179
  579    HA   GLU  19           HA       GLU  19   4.904  13.686  -2.755
  580   1HB   GLU  19          2HB       GLU  19   5.800  12.961  -4.922
  581   2HB   GLU  19          1HB       GLU  19   4.297  13.421  -5.710
  582   1HG   GLU  19          2HG       GLU  19   4.692  15.753  -5.109
  583   2HG   GLU  19          1HG       GLU  19   6.195  15.292  -4.312
  584    H    ALA  20           H        ALA  20   3.779  15.302  -1.830
  585    HA   ALA  20           HA       ALA  20   1.589  16.517  -3.305
  586   1HB   ALA  20          1HB       ALA  20   0.800  14.603  -1.717
  587   2HB   ALA  20          2HB       ALA  20  -0.093  16.122  -1.796
  588   3HB   ALA  20          3HB       ALA  20   1.023  15.822  -0.463
  589    H    VAL  21           H        VAL  21   1.021  18.573  -2.614
  590    HA   VAL  21           HA       VAL  21   3.040  20.293  -1.904
  591    HB   VAL  21           HB       VAL  21   0.136  20.807  -1.282
  592   1HG1  VAL  21          1HG1      VAL  21   2.564  22.458  -1.438
  593   2HG1  VAL  21          2HG1      VAL  21   1.078  22.700  -0.518
  594   3HG1  VAL  21          3HG1      VAL  21   1.136  23.125  -2.229
  595   1HG2  VAL  21          1HG2      VAL  21   1.591  20.692  -3.881
  596   2HG2  VAL  21          2HG2      VAL  21   0.289  21.864  -3.668
  597   3HG2  VAL  21          3HG2      VAL  21  -0.034  20.139  -3.474
  598    H    ASP  22           H        ASP  22   0.736  18.702   0.240
  599    HA   ASP  22           HA       ASP  22   2.467  19.376   2.497
  600   1HB   ASP  22          2HB       ASP  22   0.434  19.976   3.886
  601   2HB   ASP  22          1HB       ASP  22   0.921  21.161   2.677
  602    H    ALA  23           H        ALA  23   1.679  18.241   4.553
  603    HA   ALA  23           HA       ALA  23   1.674  15.492   4.103
  604   1HB   ALA  23          1HB       ALA  23   1.131  15.300   6.523
  605   2HB   ALA  23          2HB       ALA  23   0.894  17.048   6.563
  606   3HB   ALA  23          3HB       ALA  23   2.482  16.380   6.180
  607    H    ALA  24           H        ALA  24  -0.999  17.688   4.824
  608    HA   ALA  24           HA       ALA  24  -2.987  15.700   5.066
  609   1HB   ALA  24          1HB       ALA  24  -2.896  18.601   4.909
  610   2HB   ALA  24          2HB       ALA  24  -4.027  17.554   5.766
  611   3HB   ALA  24          3HB       ALA  24  -4.294  17.935   4.065
  612    H    THR  25           H        THR  25  -2.175  17.814   2.290
  613    HA   THR  25           HA       THR  25  -3.874  16.645   0.439
  614    HB   THR  25           HB       THR  25  -2.164  17.418  -1.262
  615    HG1  THR  25           1HG      THR  25  -0.335  17.179   0.077
  616   1HG2  THR  25          1HG2      THR  25  -3.869  18.970  -0.701
  617   2HG2  THR  25          2HG2      THR  25  -2.332  19.835  -0.700
  618   3HG2  THR  25          3HG2      THR  25  -3.082  19.365   0.826
  619    H    ALA  26           H        ALA  26  -0.585  15.771   1.403
  620    HA   ALA  26           HA       ALA  26  -0.239  13.618  -0.370
  621   1HB   ALA  26          1HB       ALA  26   1.362  12.797   1.480
  622   2HB   ALA  26          2HB       ALA  26   0.965  14.313   2.290
  623   3HB   ALA  26          3HB       ALA  26   1.714  14.336   0.693
  624    H    GLU  27           H        GLU  27  -1.335  13.689   3.034
  625    HA   GLU  27           HA       GLU  27  -1.883  11.028   3.405
  626   1HB   GLU  27          2HB       GLU  27  -2.033  12.692   5.192
  627   2HB   GLU  27          1HB       GLU  27  -3.453  13.396   4.433
  628   1HG   GLU  27          2HG       GLU  27  -4.680  11.315   4.795
  629   2HG   GLU  27          1HG       GLU  27  -3.255  10.612   5.559
  630    H    LYS  28           H        LYS  28  -4.005  13.530   2.053
  631    HA   LYS  28           HA       LYS  28  -6.223  11.863   1.583
  632   1HB   LYS  28          2HB       LYS  28  -5.371  14.385   0.145
  633   2HB   LYS  28          1HB       LYS  28  -6.956  13.633   0.012
  634   1HG   LYS  28          2HG       LYS  28  -5.734  14.850   2.477
  635   2HG   LYS  28          1HG       LYS  28  -7.088  15.478   1.534
  636   1HD   LYS  28          2HD       LYS  28  -8.394  13.480   2.103
  637   2HD   LYS  28          1HD       LYS  28  -7.042  12.880   3.067
  638   1HE   LYS  28          2HE       LYS  28  -7.214  14.822   4.533
  639   2HE   LYS  28          1HE       LYS  28  -8.541  15.453   3.558
  640   1HZ   LYS  28          1HZ       LYS  28  -9.698  14.409   5.196
  641   2HZ   LYS  28          2HZ       LYS  28  -8.522  13.220   5.451
  642   3HZ   LYS  28          3HZ       LYS  28  -9.556  13.114   4.116
  643    H    VAL  29           H        VAL  29  -3.508  12.834  -0.473
  644    HA   VAL  29           HA       VAL  29  -4.301  11.513  -2.805
  645    HB   VAL  29           HB       VAL  29  -1.496  12.028  -1.793
  646   1HG1  VAL  29          1HG1      VAL  29  -1.224  12.051  -4.449
  647   2HG1  VAL  29          2HG1      VAL  29  -2.537  10.882  -4.311
  648   3HG1  VAL  29          3HG1      VAL  29  -1.010  10.595  -3.477
  649   1HG2  VAL  29          1HG2      VAL  29  -2.569  13.681  -3.959
  650   2HG2  VAL  29          2HG2      VAL  29  -1.655  14.142  -2.523
  651   3HG2  VAL  29          3HG2      VAL  29  -3.395  13.883  -2.414
  652    H    VAL  30           H        VAL  30  -2.529  10.400   0.022
  653    HA   VAL  30           HA       VAL  30  -1.931   7.817  -1.006
  654    HB   VAL  30           HB       VAL  30  -2.198   8.657   1.885
  655   1HG1  VAL  30          1HG1      VAL  30  -2.086   6.148   1.102
  656   2HG1  VAL  30          2HG1      VAL  30  -1.150   6.701   2.490
  657   3HG1  VAL  30          3HG1      VAL  30  -0.371   6.509   0.921
  658   1HG2  VAL  30          1HG2      VAL  30  -0.140   9.574   1.842
  659   2HG2  VAL  30          2HG2      VAL  30  -0.495   9.789   0.128
  660   3HG2  VAL  30          3HG2      VAL  30   0.469   8.413   0.663
  661    H    LYS  31           H        LYS  31  -4.475   9.055   1.202
  662    HA   LYS  31           HA       LYS  31  -5.847   6.693   1.620
  663   1HB   LYS  31          2HB       LYS  31  -6.905   9.504   1.352
  664   2HB   LYS  31          1HB       LYS  31  -7.911   8.143   1.830
  665   1HG   LYS  31          2HG       LYS  31  -6.371   7.756   3.736
  666   2HG   LYS  31          1HG       LYS  31  -5.522   9.237   3.295
  667   1HD   LYS  31          2HD       LYS  31  -7.070   9.778   5.032
  668   2HD   LYS  31          1HD       LYS  31  -7.701  10.449   3.526
  669   1HE   LYS  31          2HE       LYS  31  -9.483   9.394   4.794
  670   2HE   LYS  31          1HE       LYS  31  -9.186   8.510   3.298
  671   1HZ   LYS  31          1HZ       LYS  31  -8.018   6.834   4.485
  672   2HZ   LYS  31          2HZ       LYS  31  -9.480   7.090   5.297
  673   3HZ   LYS  31          3HZ       LYS  31  -8.044   7.728   5.922
  674    H    GLN  32           H        GLN  32  -6.082   8.962  -1.069
  675    HA   GLN  32           HA       GLN  32  -8.188   7.708  -2.450
  676   1HB   GLN  32          2HB       GLN  32  -7.304   9.968  -2.996
  677   2HB   GLN  32          1HB       GLN  32  -5.840   9.223  -3.617
  678   1HG   GLN  32          2HG       GLN  32  -7.278   9.814  -5.441
  679   2HG   GLN  32          1HG       GLN  32  -7.170   8.061  -5.320
  680   1HE2  GLN  32          1HE2      GLN  32  -9.115   9.337  -2.863
  681   2HE2  GLN  32          2HE2      GLN  32 -10.648   9.054  -3.598
  682    H    PHE  33           H        PHE  33  -4.746   7.140  -2.342
  683    HA   PHE  33           HA       PHE  33  -4.380   5.381  -4.451
  684   1HB   PHE  33          2HB       PHE  33  -2.626   6.386  -2.934
  685   2HB   PHE  33          1HB       PHE  33  -3.074   5.187  -1.726
  686    HD1  PHE  33           1HD      PHE  33  -1.934   5.454  -5.252
  687    HD2  PHE  33           2HD      PHE  33  -1.936   3.186  -1.644
  688    HE1  PHE  33           1HE      PHE  33  -0.336   3.864  -6.236
  689    HE2  PHE  33           2HE      PHE  33  -0.337   1.602  -2.638
  690    HZ   PHE  33           HZ       PHE  33   0.459   1.952  -4.947
  691    H    PHE  34           H        PHE  34  -4.850   4.472  -1.063
  692    HA   PHE  34           HA       PHE  34  -5.456   1.744  -1.614
  693   1HB   PHE  34          2HB       PHE  34  -6.047   3.337   0.884
  694   2HB   PHE  34          1HB       PHE  34  -5.998   1.576   0.752
  695    HD1  PHE  34           1HD      PHE  34  -3.718   0.878  -0.656
  696    HD2  PHE  34           2HD      PHE  34  -4.219   4.166   1.984
  697    HE1  PHE  34           1HE      PHE  34  -1.289   0.936  -0.279
  698    HE2  PHE  34           2HE      PHE  34  -1.796   4.228   2.380
  699    HZ   PHE  34           HZ       PHE  34  -0.334   2.614   1.231
  700    H    ASN  35           H        ASN  35  -7.427   4.588  -1.014
  701    HA   ASN  35           HA       ASN  35  -9.952   3.502  -0.756
  702   1HB   ASN  35          2HB       ASN  35  -9.369   5.921  -0.633
  703   2HB   ASN  35          1HB       ASN  35  -9.182   5.941  -2.383
  704   1HD2  ASN  35          1HD2      ASN  35 -11.086   7.008  -0.166
  705   2HD2  ASN  35          2HD2      ASN  35 -12.642   6.834  -0.901
  706    H    ASP  36           H        ASP  36  -8.010   4.064  -3.602
  707    HA   ASP  36           HA       ASP  36 -10.038   2.937  -5.378
  708   1HB   ASP  36          2HB       ASP  36  -7.387   4.251  -5.994
  709   2HB   ASP  36          1HB       ASP  36  -8.515   3.652  -7.207
  710    H    ASN  37           H        ASN  37  -7.026   1.988  -3.895
  711    HA   ASN  37           HA       ASN  37  -6.520  -0.135  -5.790
  712   1HB   ASN  37          2HB       ASN  37  -5.312   0.427  -3.071
  713   2HB   ASN  37          1HB       ASN  37  -4.798  -0.879  -4.131
  714   1HD2  ASN  37          1HD2      ASN  37  -3.557   1.695  -3.053
  715   2HD2  ASN  37          2HD2      ASN  37  -2.866   2.418  -4.464
  716    H    GLY  38           H        GLY  38  -7.794   0.181  -2.548
  717   1HA   GLY  38          2HA       GLY  38  -8.243  -1.880  -1.225
  718   2HA   GLY  38          1HA       GLY  38  -9.693  -1.130  -1.854
  719    H    VAL  39           H        VAL  39 -11.069  -2.428  -2.798
  720    HA   VAL  39           HA       VAL  39 -10.318  -5.151  -3.295
  721    HB   VAL  39           HB       VAL  39 -12.977  -3.772  -3.388
  722   1HG1  VAL  39          1HG1      VAL  39 -13.677  -5.488  -4.653
  723   2HG1  VAL  39          2HG1      VAL  39 -13.487  -6.470  -3.201
  724   3HG1  VAL  39          3HG1      VAL  39 -12.189  -6.398  -4.393
  725   1HG2  VAL  39          1HG2      VAL  39 -12.111  -5.900  -1.480
  726   2HG2  VAL  39          2HG2      VAL  39 -13.369  -4.679  -1.291
  727   3HG2  VAL  39          3HG2      VAL  39 -11.669  -4.214  -1.209
  728    H    ASP  40           H        ASP  40 -11.963  -2.742  -5.451
  729    HA   ASP  40           HA       ASP  40 -11.599  -4.585  -7.633
  730   1HB   ASP  40          2HB       ASP  40 -12.866  -1.850  -7.513
  731   2HB   ASP  40          1HB       ASP  40 -12.852  -2.886  -8.937
  732    H    GLY  41           H        GLY  41  -9.170  -3.198  -6.474
  733   1HA   GLY  41          2HA       GLY  41  -8.304  -1.326  -8.458
  734   2HA   GLY  41          1HA       GLY  41  -7.277  -2.130  -7.276
  735    H    GLU  42           H        GLU  42  -6.362  -1.737  -9.874
  736    HA   GLU  42           HA       GLU  42  -6.786  -4.216 -11.334
  737   1HB   GLU  42          2HB       GLU  42  -4.998  -1.856 -11.950
  738   2HB   GLU  42          1HB       GLU  42  -5.312  -3.207 -13.030
  739   1HG   GLU  42          2HG       GLU  42  -7.664  -2.591 -13.136
  740   2HG   GLU  42          1HG       GLU  42  -7.368  -1.250 -12.031
  741    H    TRP  43           H        TRP  43  -5.838  -5.831 -10.078
  742    HA   TRP  43           HA       TRP  43  -3.065  -5.509  -9.255
  743   1HB   TRP  43          2HB       TRP  43  -5.032  -7.745  -8.762
  744   2HB   TRP  43          1HB       TRP  43  -3.409  -7.659  -8.089
  745    HD1  TRP  43           HD       TRP  43  -6.265  -5.033  -8.176
  746    HE1  TRP  43           1HE      TRP  43  -6.625  -4.177  -5.777
  747    HE3  TRP  43           3HE      TRP  43  -2.815  -7.926  -5.802
  748    HZ2  TRP  43           2HZ      TRP  43  -5.563  -4.681  -3.201
  749    HZ3  TRP  43           3HZ      TRP  43  -2.540  -7.683  -3.378
  750    HH2  TRP  43           HH       TRP  43  -3.885  -6.096  -2.098
  751    H    THR  44           H        THR  44  -1.500  -6.037 -10.615
  752    HA   THR  44           HA       THR  44  -1.903  -8.317 -12.435
  753    HB   THR  44           HB       THR  44  -0.029  -7.337 -13.762
  754    HG1  THR  44           1HG      THR  44  -0.345  -5.099 -12.053
  755   1HG2  THR  44          1HG2      THR  44  -1.274  -5.158 -14.404
  756   2HG2  THR  44          2HG2      THR  44  -2.529  -5.774 -13.329
  757   3HG2  THR  44          3HG2      THR  44  -2.019  -6.724 -14.725
  758    H    TYR  45           H        TYR  45  -0.476 -10.027 -12.334
  759    HA   TYR  45           HA       TYR  45   1.514  -9.886 -10.163
  760   1HB   TYR  45          2HB       TYR  45  -0.372 -11.436  -9.769
  761   2HB   TYR  45          1HB       TYR  45   0.058 -12.314 -11.232
  762    HD1  TYR  45           1HD      TYR  45   2.476 -10.971  -8.772
  763    HD2  TYR  45           2HD      TYR  45   0.498 -14.428 -10.263
  764    HE1  TYR  45           1HE      TYR  45   3.990 -12.395  -7.460
  765    HE2  TYR  45           2HE      TYR  45   2.006 -15.863  -8.954
  766    HH   TYR  45           HH       TYR  45   4.090 -14.616  -6.536
  767    H    ASP  46           H        ASP  46   3.568 -10.696 -10.456
  768    HA   ASP  46           HA       ASP  46   4.281 -11.512 -13.195
  769   1HB   ASP  46          2HB       ASP  46   5.058  -9.220 -12.754
  770   2HB   ASP  46          1HB       ASP  46   5.905  -9.779 -11.317
  771    H    ASP  47           H        ASP  47   4.092 -13.702 -12.510
  772    HA   ASP  47           HA       ASP  47   5.165 -14.963 -10.346
  773   1HB   ASP  47          2HB       ASP  47   5.219 -16.015 -13.183
  774   2HB   ASP  47          1HB       ASP  47   5.317 -16.988 -11.718
  775    H    ALA  48           H        ALA  48   6.895 -13.851 -13.193
  776    HA   ALA  48           HA       ALA  48   9.286 -15.167 -12.982
  777   1HB   ALA  48          1HB       ALA  48   8.528 -12.472 -13.980
  778   2HB   ALA  48          2HB       ALA  48   9.174 -13.862 -14.852
  779   3HB   ALA  48          3HB       ALA  48  10.238 -12.877 -13.848
  780    H    THR  49           H        THR  49   8.176 -12.467 -11.017
  781    HA   THR  49           HA       THR  49  10.604 -12.794  -9.379
  782    HB   THR  49           HB       THR  49  10.505 -10.361  -8.879
  783    HG1  THR  49           1HG      THR  49   8.266 -10.130  -9.494
  784   1HG2  THR  49          1HG2      THR  49  10.662 -10.121 -11.747
  785   2HG2  THR  49          2HG2      THR  49  11.532 -11.538 -11.162
  786   3HG2  THR  49          3HG2      THR  49  11.920  -9.941 -10.525
  787    H    LYS  50           H        LYS  50   7.574 -13.599  -9.280
  788    HA   LYS  50           HA       LYS  50   5.951 -13.836  -7.669
  789   1HB   LYS  50          2HB       LYS  50   8.386 -13.529  -5.894
  790   2HB   LYS  50          1HB       LYS  50   6.813 -14.081  -5.334
  791   1HG   LYS  50          2HG       LYS  50   8.218 -15.516  -7.549
  792   2HG   LYS  50          1HG       LYS  50   8.652 -15.812  -5.864
  793   1HD   LYS  50          2HD       LYS  50   6.367 -16.453  -5.359
  794   2HD   LYS  50          1HD       LYS  50   5.870 -16.075  -7.011
  795   1HE   LYS  50          2HE       LYS  50   6.183 -18.479  -6.697
  796   2HE   LYS  50          1HE       LYS  50   7.336 -17.828  -7.860
  797   1HZ   LYS  50          1HZ       LYS  50   9.078 -18.204  -6.486
  798   2HZ   LYS  50          2HZ       LYS  50   8.061 -19.422  -5.901
  799   3HZ   LYS  50          3HZ       LYS  50   8.183 -17.953  -5.071
  800    H    THR  51           H        THR  51   6.548 -11.141  -8.645
  801    HA   THR  51           HA       THR  51   5.822  -9.543  -6.286
  802    HB   THR  51           HB       THR  51   7.153  -8.699  -8.864
  803    HG1  THR  51           1HG      THR  51   8.699  -9.592  -7.658
  804   1HG2  THR  51          1HG2      THR  51   6.584  -6.616  -8.426
  805   2HG2  THR  51          2HG2      THR  51   7.499  -6.724  -6.922
  806   3HG2  THR  51          3HG2      THR  51   5.778  -7.096  -6.935
  807    H    PHE  52           H        PHE  52   4.193  -8.010  -6.418
  808    HA   PHE  52           HA       PHE  52   2.355  -8.293  -8.709
  809   1HB   PHE  52          2HB       PHE  52   1.586  -7.707  -5.843
  810   2HB   PHE  52          1HB       PHE  52   0.489  -7.971  -7.192
  811    HD1  PHE  52           1HD      PHE  52  -0.508 -10.025  -7.338
  812    HD2  PHE  52           2HD      PHE  52   3.306  -9.720  -5.474
  813    HE1  PHE  52           1HE      PHE  52  -0.590 -12.421  -6.789
  814    HE2  PHE  52           2HE      PHE  52   3.232 -12.117  -4.926
  815    HZ   PHE  52           HZ       PHE  52   1.283 -13.471  -5.584
  816    H    THR  53           H        THR  53   1.546  -6.423  -9.599
  817    HA   THR  53           HA       THR  53   2.467  -3.907  -8.389
  818    HB   THR  53           HB       THR  53   2.175  -3.042 -10.827
  819    HG1  THR  53           1HG      THR  53   2.527  -5.818 -11.245
  820   1HG2  THR  53          1HG2      THR  53   4.499  -4.135 -11.397
  821   2HG2  THR  53          2HG2      THR  53   4.443  -4.561  -9.686
  822   3HG2  THR  53          3HG2      THR  53   4.334  -2.869 -10.179
  823    H    VAL  54           H        VAL  54   0.967  -2.589  -7.688
  824    HA   VAL  54           HA       VAL  54  -1.797  -2.969  -8.618
  825    HB   VAL  54           HB       VAL  54  -0.822  -1.633  -6.080
  826   1HG1  VAL  54          1HG1      VAL  54  -3.633  -2.326  -6.928
  827   2HG1  VAL  54          2HG1      VAL  54  -2.937  -0.706  -6.965
  828   3HG1  VAL  54          3HG1      VAL  54  -3.146  -1.541  -5.426
  829   1HG2  VAL  54          1HG2      VAL  54  -0.685  -4.233  -6.448
  830   2HG2  VAL  54          2HG2      VAL  54  -2.418  -4.148  -6.127
  831   3HG2  VAL  54          3HG2      VAL  54  -1.267  -3.563  -4.925
  832    H    THR  55           H        THR  55  -2.225  -1.622 -10.239
  833    HA   THR  55           HA       THR  55  -1.163   1.106 -10.152
  834    HB   THR  55           HB       THR  55  -2.519  -0.330 -12.437
  835    HG1  THR  55           1HG      THR  55  -0.380  -0.492 -13.247
  836   1HG2  THR  55          1HG2      THR  55  -1.586   1.390 -13.851
  837   2HG2  THR  55          2HG2      THR  55  -0.877   2.191 -12.448
  838   3HG2  THR  55          3HG2      THR  55  -2.631   2.110 -12.626
  839    H    GLU  56           H        GLU  56  -2.436   2.643  -9.323
  840    HA   GLU  56           HA       GLU  56  -5.197   2.187  -8.838
  841   1HB   GLU  56          2HB       GLU  56  -5.276   4.358  -7.892
  842   2HB   GLU  56          1HB       GLU  56  -3.685   3.713  -7.503
  843   1HG   GLU  56          2HG       GLU  56  -2.647   5.066  -9.162
  844   2HG   GLU  56          1HG       GLU  56  -4.207   5.561  -9.818
  Start of MODEL    7
    1   1H    MET   1          1HT       MET   1   6.497 -18.684   2.874
    2   2H    MET   1          2HT       MET   1   5.863 -19.729   1.704
    3   3H    MET   1          3HT       MET   1   4.980 -18.371   2.190
    4    HA   MET   1           HA       MET   1   7.650 -18.099   0.973
    5   1HB   MET   1          2HB       MET   1   6.282 -19.448  -0.547
    6   2HB   MET   1          1HB       MET   1   4.983 -18.271  -0.446
    7   1HG   MET   1          2HG       MET   1   6.321 -16.621  -1.570
    8   2HG   MET   1          1HG       MET   1   7.723 -17.689  -1.551
    9   1HE   MET   1          1HE       MET   1   7.186 -20.237  -4.180
   10   2HE   MET   1          2HE       MET   1   6.334 -20.663  -2.696
   11   3HE   MET   1          3HE       MET   1   7.890 -19.839  -2.613
   12    H    GLN   2           H        GLN   2   8.188 -16.012   0.592
   13    HA   GLN   2           HA       GLN   2   6.332 -13.972   1.582
   14   1HB   GLN   2          2HB       GLN   2   8.539 -14.060   2.670
   15   2HB   GLN   2          1HB       GLN   2   9.319 -13.825   1.110
   16   1HG   GLN   2          2HG       GLN   2   8.292 -11.624   0.917
   17   2HG   GLN   2          1HG       GLN   2   7.491 -11.858   2.470
   18   1HE2  GLN   2          1HE2      GLN   2   9.993 -10.371   1.038
   19   2HE2  GLN   2          2HE2      GLN   2  11.086 -10.248   2.371
   20    H    TYR   3           H        TYR   3   5.687 -12.284   0.311
   21    HA   TYR   3           HA       TYR   3   6.594 -12.353  -2.490
   22   1HB   TYR   3          2HB       TYR   3   3.828 -11.871  -1.386
   23   2HB   TYR   3          1HB       TYR   3   4.279 -11.480  -3.043
   24    HD1  TYR   3           1HD      TYR   3   4.098 -13.090  -4.694
   25    HD2  TYR   3           2HD      TYR   3   4.231 -14.323  -0.627
   26    HE1  TYR   3           1HE      TYR   3   3.644 -15.400  -5.392
   27    HE2  TYR   3           2HE      TYR   3   3.770 -16.643  -1.308
   28    HH   TYR   3           HH       TYR   3   3.124 -17.474  -4.688
   29    H    LYS   4           H        LYS   4   6.977 -10.456  -3.531
   30    HA   LYS   4           HA       LYS   4   7.181  -8.085  -1.824
   31   1HB   LYS   4          2HB       LYS   4   9.210  -8.910  -3.040
   32   2HB   LYS   4          1HB       LYS   4   8.382  -8.583  -4.557
   33   1HG   LYS   4          2HG       LYS   4   9.928  -6.800  -4.000
   34   2HG   LYS   4          1HG       LYS   4   8.260  -6.217  -3.988
   35   1HD   LYS   4          2HD       LYS   4   8.211  -6.423  -1.549
   36   2HD   LYS   4          1HD       LYS   4   9.878  -7.003  -1.562
   37   1HE   LYS   4          2HE       LYS   4   8.930  -4.313  -2.522
   38   2HE   LYS   4          1HE       LYS   4   9.749  -4.627  -0.993
   39   1HZ   LYS   4          1HZ       LYS   4  11.502  -4.000  -2.279
   40   2HZ   LYS   4          2HZ       LYS   4  10.830  -4.594  -3.714
   41   3HZ   LYS   4          3HZ       LYS   4  11.524  -5.662  -2.600
   42    H    VAL   5           H        VAL   5   5.276  -6.987  -1.902
   43    HA   VAL   5           HA       VAL   5   3.880  -6.803  -4.454
   44    HB   VAL   5           HB       VAL   5   3.010  -5.932  -1.699
   45   1HG1  VAL   5          1HG1      VAL   5   1.868  -4.535  -3.215
   46   2HG1  VAL   5          2HG1      VAL   5   0.739  -5.835  -2.836
   47   3HG1  VAL   5          3HG1      VAL   5   1.621  -5.850  -4.364
   48   1HG2  VAL   5          1HG2      VAL   5   3.245  -8.467  -2.564
   49   2HG2  VAL   5          2HG2      VAL   5   1.620  -8.092  -3.141
   50   3HG2  VAL   5          3HG2      VAL   5   2.007  -7.932  -1.427
   51    H    ILE   6           H        ILE   6   4.031  -5.138  -5.718
   52    HA   ILE   6           HA       ILE   6   5.200  -2.650  -4.706
   53    HB   ILE   6           HB       ILE   6   4.971  -3.737  -7.513
   54   1HG1  ILE   6          2HG1      ILE   6   7.252  -3.289  -5.598
   55   2HG1  ILE   6          1HG1      ILE   6   6.736  -4.800  -6.328
   56   1HG2  ILE   6          1HG2      ILE   6   4.635  -1.370  -7.657
   57   2HG2  ILE   6          2HG2      ILE   6   6.277  -1.733  -8.191
   58   3HG2  ILE   6          3HG2      ILE   6   5.999  -1.062  -6.584
   59   1HD1  ILE   6          1HD1      ILE   6   8.296  -4.500  -7.863
   60   2HD1  ILE   6          2HD1      ILE   6   8.639  -2.874  -7.267
   61   3HD1  ILE   6          3HD1      ILE   6   7.368  -3.126  -8.467
   62    H    LEU   7           H        LEU   7   3.966  -0.932  -4.457
   63    HA   LEU   7           HA       LEU   7   1.271  -0.948  -5.623
   64   1HB   LEU   7          2HB       LEU   7   2.210   0.949  -3.491
   65   2HB   LEU   7          1HB       LEU   7   0.578   0.424  -3.852
   66    HG   LEU   7           HG       LEU   7   2.729  -1.217  -2.531
   67   1HD1  LEU   7          1HD1      LEU   7   1.388  -1.096  -0.577
   68   2HD1  LEU   7          2HD1      LEU   7   0.071  -0.312  -1.452
   69   3HD1  LEU   7          3HD1      LEU   7   1.584   0.550  -1.176
   70   1HD2  LEU   7          1HD2      LEU   7   1.400  -2.619  -4.000
   71   2HD2  LEU   7          2HD2      LEU   7  -0.085  -1.975  -3.302
   72   3HD2  LEU   7          3HD2      LEU   7   1.005  -2.947  -2.313
   73    H    ASN   8           H        ASN   8   1.977  -0.260  -7.704
   74    HA   ASN   8           HA       ASN   8   3.318   2.301  -7.932
   75   1HB   ASN   8          2HB       ASN   8   3.915   0.319  -9.339
   76   2HB   ASN   8          1HB       ASN   8   2.330   0.436 -10.096
   77   1HD2  ASN   8          1HD2      ASN   8   5.344   0.924 -10.766
   78   2HD2  ASN   8          2HD2      ASN   8   5.274   2.354 -11.736
   79    H    GLY   9           H        GLY   9   2.034   4.046  -7.660
   80   1HA   GLY   9          2HA       GLY   9  -0.563   4.042  -9.072
   81   2HA   GLY   9          1HA       GLY   9  -0.274   4.902  -7.571
   82    H    LYS  10           H        LYS  10  -1.210   6.658  -8.911
   83    HA   LYS  10           HA       LYS  10   0.504   7.795 -10.932
   84   1HB   LYS  10          2HB       LYS  10  -1.984   8.913  -9.620
   85   2HB   LYS  10          1HB       LYS  10  -1.188   9.587 -11.034
   86   1HG   LYS  10          2HG       LYS  10  -2.144   6.764 -11.093
   87   2HG   LYS  10          1HG       LYS  10  -3.298   8.081 -11.283
   88   1HD   LYS  10          2HD       LYS  10  -2.546   7.282 -13.452
   89   2HD   LYS  10          1HD       LYS  10  -2.001   8.936 -13.181
   90   1HE   LYS  10          2HE       LYS  10  -0.190   6.688 -12.447
   91   2HE   LYS  10          1HE       LYS  10  -0.384   7.098 -14.150
   92   1HZ   LYS  10          1HZ       LYS  10   0.121   9.325 -12.351
   93   2HZ   LYS  10          2HZ       LYS  10   0.725   9.029 -13.901
   94   3HZ   LYS  10          3HZ       LYS  10   1.407   8.248 -12.566
   95    H    THR  11           H        THR  11  -0.765   8.924  -7.809
   96    HA   THR  11           HA       THR  11   1.454  10.799  -7.574
   97    HB   THR  11           HB       THR  11  -0.019  11.514  -5.544
   98    HG1  THR  11           1HG      THR  11  -1.399   9.717  -5.626
   99   1HG2  THR  11          1HG2      THR  11  -1.161  13.084  -6.802
  100   2HG2  THR  11          2HG2      THR  11  -1.353  11.991  -8.173
  101   3HG2  THR  11          3HG2      THR  11   0.225  12.694  -7.821
  102    H    LEU  12           H        LEU  12   0.841   7.685  -6.747
  103    HA   LEU  12           HA       LEU  12   2.630   7.876  -4.447
  104   1HB   LEU  12          2HB       LEU  12   0.372   7.740  -3.541
  105   2HB   LEU  12          1HB       LEU  12   0.060   6.298  -4.487
  106    HG   LEU  12           HG       LEU  12   1.542   5.002  -3.174
  107   1HD1  LEU  12          1HD1      LEU  12   3.424   5.963  -2.496
  108   2HD1  LEU  12          2HD1      LEU  12   2.498   6.612  -1.140
  109   3HD1  LEU  12          3HD1      LEU  12   2.723   7.574  -2.597
  110   1HD2  LEU  12          1HD2      LEU  12  -0.138   4.839  -1.732
  111   2HD2  LEU  12          2HD2      LEU  12  -0.573   6.534  -1.952
  112   3HD2  LEU  12          3HD2      LEU  12   0.656   6.085  -0.769
  113    H    LYS  13           H        LYS  13   4.095   6.309  -4.269
  114    HA   LYS  13           HA       LYS  13   3.874   3.869  -5.848
  115   1HB   LYS  13          2HB       LYS  13   6.243   5.742  -6.084
  116   2HB   LYS  13          1HB       LYS  13   6.111   4.155  -6.829
  117   1HG   LYS  13          2HG       LYS  13   4.258   4.931  -8.199
  118   2HG   LYS  13          1HG       LYS  13   4.338   6.516  -7.425
  119   1HD   LYS  13          2HD       LYS  13   5.453   6.542  -9.595
  120   2HD   LYS  13          1HD       LYS  13   6.603   6.829  -8.287
  121   1HE   LYS  13          2HE       LYS  13   7.524   5.293  -9.939
  122   2HE   LYS  13          1HE       LYS  13   7.303   4.491  -8.384
  123   1HZ   LYS  13          1HZ       LYS  13   5.719   3.138  -9.207
  124   2HZ   LYS  13          2HZ       LYS  13   6.490   3.453 -10.678
  125   3HZ   LYS  13          3HZ       LYS  13   5.087   4.303 -10.261
  126    H    GLY  14           H        GLY  14   5.164   2.146  -4.982
  127   1HA   GLY  14          2HA       GLY  14   7.079   2.613  -2.934
  128   2HA   GLY  14          1HA       GLY  14   5.527   2.205  -2.229
  129    H    GLU  15           H        GLU  15   7.081   0.549  -1.379
  130    HA   GLU  15           HA       GLU  15   6.824  -1.893  -2.978
  131   1HB   GLU  15          2HB       GLU  15   9.325  -1.015  -1.512
  132   2HB   GLU  15          1HB       GLU  15   9.099  -2.577  -2.278
  133   1HG   GLU  15          2HG       GLU  15   9.030   0.049  -3.739
  134   2HG   GLU  15          1HG       GLU  15  10.451  -0.982  -3.604
  135    H    THR  16           H        THR  16   5.886  -3.467  -1.817
  136    HA   THR  16           HA       THR  16   6.196  -3.444   1.098
  137    HB   THR  16           HB       THR  16   4.089  -2.508   1.016
  138    HG1  THR  16           1HG      THR  16   3.462  -5.231   0.787
  139   1HG2  THR  16          1HG2      THR  16   3.786  -2.555  -1.415
  140   2HG2  THR  16          2HG2      THR  16   2.328  -3.013  -0.538
  141   3HG2  THR  16          3HG2      THR  16   3.320  -4.250  -1.304
  142    H    THR  17           H        THR  17   5.410  -5.560   2.097
  143    HA   THR  17           HA       THR  17   5.696  -7.824   0.269
  144    HB   THR  17           HB       THR  17   7.355  -8.875   1.799
  145    HG1  THR  17           1HG      THR  17   7.682  -7.931   3.624
  146   1HG2  THR  17          1HG2      THR  17   8.275  -7.909  -0.157
  147   2HG2  THR  17          2HG2      THR  17   9.292  -7.419   1.198
  148   3HG2  THR  17          3HG2      THR  17   8.136  -6.280   0.506
  149    H    THR  18           H        THR  18   4.126  -9.196   0.625
  150    HA   THR  18           HA       THR  18   2.999  -9.490   3.349
  151    HB   THR  18           HB       THR  18   1.409  -8.735   1.604
  152    HG1  THR  18           1HG      THR  18   0.710 -10.096   3.332
  153   1HG2  THR  18          1HG2      THR  18   0.639 -10.563  -0.008
  154   2HG2  THR  18          2HG2      THR  18   2.238 -11.264   0.244
  155   3HG2  THR  18          3HG2      THR  18   2.082  -9.638  -0.422
  156    H    GLU  19           H        GLU  19   2.784 -11.556   4.220
  157    HA   GLU  19           HA       GLU  19   4.359 -13.661   2.885
  158   1HB   GLU  19          2HB       GLU  19   5.176 -13.058   5.084
  159   2HB   GLU  19          1HB       GLU  19   3.577 -13.264   5.782
  160   1HG   GLU  19          2HG       GLU  19   5.010 -15.129   6.342
  161   2HG   GLU  19          1HG       GLU  19   3.676 -15.656   5.318
  162    H    ALA  20           H        ALA  20   3.179 -15.174   1.832
  163    HA   ALA  20           HA       ALA  20   0.829 -16.277   3.148
  164   1HB   ALA  20          1HB       ALA  20   0.400 -15.703   0.291
  165   2HB   ALA  20          2HB       ALA  20   0.389 -14.312   1.374
  166   3HB   ALA  20          3HB       ALA  20  -0.728 -15.650   1.645
  167    H    VAL  21           H        VAL  21   0.276 -18.327   2.497
  168    HA   VAL  21           HA       VAL  21   2.267 -20.105   1.856
  169    HB   VAL  21           HB       VAL  21  -0.647 -20.536   1.193
  170   1HG1  VAL  21          1HG1      VAL  21  -0.225 -22.839   1.374
  171   2HG1  VAL  21          2HG1      VAL  21   1.355 -22.577   2.113
  172   3HG1  VAL  21          3HG1      VAL  21   1.106 -22.204   0.407
  173   1HG2  VAL  21          1HG2      VAL  21  -0.535 -21.616   3.568
  174   2HG2  VAL  21          2HG2      VAL  21  -0.794 -19.880   3.393
  175   3HG2  VAL  21          3HG2      VAL  21   0.808 -20.496   3.797
  176    H    ASP  22           H        ASP  22   0.303 -18.253  -0.350
  177    HA   ASP  22           HA       ASP  22   2.021 -19.056  -2.535
  178   1HB   ASP  22          2HB       ASP  22   0.264 -19.831  -4.021
  179   2HB   ASP  22          1HB       ASP  22   0.292 -20.817  -2.563
  180    H    ALA  23           H        ALA  23   1.178 -17.949  -4.662
  181    HA   ALA  23           HA       ALA  23   1.283 -15.194  -4.218
  182   1HB   ALA  23          1HB       ALA  23   0.190 -15.528  -6.768
  183   2HB   ALA  23          2HB       ALA  23   1.184 -16.956  -6.492
  184   3HB   ALA  23          3HB       ALA  23   1.894 -15.348  -6.351
  185    H    ALA  24           H        ALA  24  -1.469 -17.289  -4.952
  186    HA   ALA  24           HA       ALA  24  -3.375 -15.218  -5.185
  187   1HB   ALA  24          1HB       ALA  24  -4.874 -16.876  -5.499
  188   2HB   ALA  24          2HB       ALA  24  -4.344 -17.767  -4.074
  189   3HB   ALA  24          3HB       ALA  24  -3.444 -17.903  -5.585
  190    H    THR  25           H        THR  25  -2.632 -17.373  -2.426
  191    HA   THR  25           HA       THR  25  -4.294 -16.220  -0.554
  192    HB   THR  25           HB       THR  25  -2.621 -17.022   1.126
  193    HG1  THR  25           1HG      THR  25  -1.067 -17.174  -1.149
  194   1HG2  THR  25          1HG2      THR  25  -2.538 -19.449   0.238
  195   2HG2  THR  25          2HG2      THR  25  -3.577 -18.821  -1.043
  196   3HG2  THR  25          3HG2      THR  25  -4.090 -18.716   0.640
  197    H    ALA  26           H        ALA  26  -0.995 -15.330  -1.500
  198    HA   ALA  26           HA       ALA  26  -0.668 -13.184   0.285
  199   1HB   ALA  26          1HB       ALA  26   1.119 -14.280  -1.140
  200   2HB   ALA  26          2HB       ALA  26   1.170 -12.519  -1.060
  201   3HB   ALA  26          3HB       ALA  26   0.509 -13.317  -2.486
  202    H    GLU  27           H        GLU  27  -1.751 -13.244  -3.121
  203    HA   GLU  27           HA       GLU  27  -2.306 -10.564  -3.440
  204   1HB   GLU  27          2HB       GLU  27  -2.363 -12.187  -5.272
  205   2HB   GLU  27          1HB       GLU  27  -3.806 -12.919  -4.584
  206   1HG   GLU  27          2HG       GLU  27  -5.037 -10.840  -4.942
  207   2HG   GLU  27          1HG       GLU  27  -3.589 -10.103  -5.626
  208    H    LYS  28           H        LYS  28  -4.382 -13.136  -2.170
  209    HA   LYS  28           HA       LYS  28  -6.657 -11.513  -1.743
  210   1HB   LYS  28          2HB       LYS  28  -5.838 -14.073  -0.355
  211   2HB   LYS  28          1HB       LYS  28  -7.438 -13.348  -0.289
  212   1HG   LYS  28          2HG       LYS  28  -6.065 -14.483  -2.711
  213   2HG   LYS  28          1HG       LYS  28  -7.462 -15.148  -1.864
  214   1HD   LYS  28          2HD       LYS  28  -8.773 -13.182  -2.478
  215   2HD   LYS  28          1HD       LYS  28  -7.372 -12.501  -3.308
  216   1HE   LYS  28          2HE       LYS  28  -7.359 -14.403  -4.845
  217   2HE   LYS  28          1HE       LYS  28  -8.755 -15.089  -4.013
  218   1HZ   LYS  28          1HZ       LYS  28 -10.157 -13.637  -4.981
  219   2HZ   LYS  28          2HZ       LYS  28  -8.954 -13.560  -6.166
  220   3HZ   LYS  28          3HZ       LYS  28  -9.046 -12.361  -4.977
  221    H    VAL  29           H        VAL  29  -4.038 -12.574   0.410
  222    HA   VAL  29           HA       VAL  29  -4.938 -11.343   2.746
  223    HB   VAL  29           HB       VAL  29  -2.078 -11.775   1.856
  224   1HG1  VAL  29          1HG1      VAL  29  -1.426 -10.775   3.725
  225   2HG1  VAL  29          2HG1      VAL  29  -2.384 -11.910   4.675
  226   3HG1  VAL  29          3HG1      VAL  29  -3.104 -10.400   4.118
  227   1HG2  VAL  29          1HG2      VAL  29  -2.241 -13.924   2.480
  228   2HG2  VAL  29          2HG2      VAL  29  -3.979 -13.683   2.293
  229   3HG2  VAL  29          3HG2      VAL  29  -3.234 -13.541   3.886
  230    H    VAL  30           H        VAL  30  -3.005 -10.091   0.074
  231    HA   VAL  30           HA       VAL  30  -2.476  -7.549   1.213
  232    HB   VAL  30           HB       VAL  30  -2.725  -8.218  -1.726
  233   1HG1  VAL  30          1HG1      VAL  30  -1.461  -6.276  -2.153
  234   2HG1  VAL  30          2HG1      VAL  30  -1.005  -6.103  -0.461
  235   3HG1  VAL  30          3HG1      VAL  30  -2.663  -5.784  -0.960
  236   1HG2  VAL  30          1HG2      VAL  30  -0.744  -9.257  -1.695
  237   2HG2  VAL  30          2HG2      VAL  30  -0.999  -9.406   0.044
  238   3HG2  VAL  30          3HG2      VAL  30  -0.040  -8.071  -0.594
  239    H    LYS  31           H        LYS  31  -5.030  -8.740  -0.992
  240    HA   LYS  31           HA       LYS  31  -6.416  -6.402  -1.430
  241   1HB   LYS  31          2HB       LYS  31  -7.424  -9.219  -1.067
  242   2HB   LYS  31          1HB       LYS  31  -8.484  -7.886  -1.502
  243   1HG   LYS  31          2HG       LYS  31  -7.310  -7.521  -3.542
  244   2HG   LYS  31          1HG       LYS  31  -6.057  -8.675  -3.089
  245   1HD   LYS  31          2HD       LYS  31  -7.532  -9.723  -4.668
  246   2HD   LYS  31          1HD       LYS  31  -7.789 -10.462  -3.088
  247   1HE   LYS  31          2HE       LYS  31  -9.499  -8.241  -4.190
  248   2HE   LYS  31          1HE       LYS  31  -9.873  -9.951  -4.398
  249   1HZ   LYS  31          1HZ       LYS  31 -10.955  -9.766  -2.481
  250   2HZ   LYS  31          2HZ       LYS  31 -10.264  -8.267  -2.118
  251   3HZ   LYS  31          3HZ       LYS  31  -9.445  -9.693  -1.722
  252    H    GLN  32           H        GLN  32  -6.652  -8.611   1.308
  253    HA   GLN  32           HA       GLN  32  -8.697  -7.277   2.705
  254   1HB   GLN  32          2HB       GLN  32  -7.881  -9.551   3.279
  255   2HB   GLN  32          1HB       GLN  32  -6.375  -8.849   3.852
  256   1HG   GLN  32          2HG       GLN  32  -7.777  -9.347   5.725
  257   2HG   GLN  32          1HG       GLN  32  -7.632  -7.602   5.558
  258   1HE2  GLN  32          1HE2      GLN  32  -9.669  -8.865   3.178
  259   2HE2  GLN  32          2HE2      GLN  32 -11.175  -8.538   3.950
  260    H    PHE  33           H        PHE  33  -5.238  -6.813   2.530
  261    HA   PHE  33           HA       PHE  33  -4.795  -5.028   4.606
  262   1HB   PHE  33          2HB       PHE  33  -3.088  -6.112   3.064
  263   2HB   PHE  33          1HB       PHE  33  -3.498  -4.882   1.876
  264    HD1  PHE  33           1HD      PHE  33  -2.533  -5.094   5.471
  265    HD2  PHE  33           2HD      PHE  33  -2.130  -3.058   1.748
  266    HE1  PHE  33           1HE      PHE  33  -0.906  -3.546   6.481
  267    HE2  PHE  33           2HE      PHE  33  -0.497  -1.524   2.761
  268    HZ   PHE  33           HZ       PHE  33   0.114  -1.773   5.138
  269    H    PHE  34           H        PHE  34  -5.294  -4.186   1.202
  270    HA   PHE  34           HA       PHE  34  -5.784  -1.428   1.708
  271   1HB   PHE  34          2HB       PHE  34  -6.455  -3.067  -0.740
  272   2HB   PHE  34          1HB       PHE  34  -6.414  -1.304  -0.656
  273    HD1  PHE  34           1HD      PHE  34  -4.049  -0.781   0.913
  274    HD2  PHE  34           2HD      PHE  34  -4.702  -3.689  -2.117
  275    HE1  PHE  34           1HE      PHE  34  -1.638  -0.826   0.449
  276    HE2  PHE  34           2HE      PHE  34  -2.289  -3.738  -2.596
  277    HZ   PHE  34           HZ       PHE  34  -0.762  -2.304  -1.297
  278    H    ASN  35           H        ASN  35  -7.858  -4.214   1.208
  279    HA   ASN  35           HA       ASN  35 -10.347  -3.048   0.978
  280   1HB   ASN  35          2HB       ASN  35  -9.903  -5.479   0.867
  281   2HB   ASN  35          1HB       ASN  35  -9.597  -5.498   2.599
  282   1HD2  ASN  35          1HD2      ASN  35 -11.686  -6.564   0.583
  283   2HD2  ASN  35          2HD2      ASN  35 -13.181  -6.293   1.407
  284    H    ASP  36           H        ASP  36  -8.386  -3.625   3.808
  285    HA   ASP  36           HA       ASP  36 -10.356  -2.379   5.568
  286   1HB   ASP  36          2HB       ASP  36  -7.754  -3.775   6.207
  287   2HB   ASP  36          1HB       ASP  36  -8.866  -3.125   7.406
  288    H    ASN  37           H        ASN  37  -7.347  -1.579   4.013
  289    HA   ASN  37           HA       ASN  37  -6.728   0.568   5.852
  290   1HB   ASN  37          2HB       ASN  37  -5.594  -0.087   3.121
  291   2HB   ASN  37          1HB       ASN  37  -5.019   1.222   4.144
  292   1HD2  ASN  37          1HD2      ASN  37  -3.836  -1.365   3.085
  293   2HD2  ASN  37          2HD2      ASN  37  -3.146  -2.092   4.494
  294    H    GLY  38           H        GLY  38  -7.976   0.228   2.591
  295   1HA   GLY  38          2HA       GLY  38  -8.411   2.260   1.240
  296   2HA   GLY  38          1HA       GLY  38  -9.876   1.558   1.892
  297    H    VAL  39           H        VAL  39 -11.218   2.927   2.751
  298    HA   VAL  39           HA       VAL  39 -10.239   5.581   3.538
  299    HB   VAL  39           HB       VAL  39 -13.037   4.689   2.921
  300   1HG1  VAL  39          1HG1      VAL  39 -11.813   7.308   3.624
  301   2HG1  VAL  39          2HG1      VAL  39 -13.387   6.641   4.060
  302   3HG1  VAL  39          3HG1      VAL  39 -13.124   7.291   2.443
  303   1HG2  VAL  39          1HG2      VAL  39 -11.554   4.426   0.990
  304   2HG2  VAL  39          2HG2      VAL  39 -11.069   6.114   1.140
  305   3HG2  VAL  39          3HG2      VAL  39 -12.738   5.710   0.736
  306    H    ASP  40           H        ASP  40 -11.000   2.817   5.251
  307    HA   ASP  40           HA       ASP  40 -12.088   4.453   7.436
  308   1HB   ASP  40          2HB       ASP  40 -12.770   1.579   6.791
  309   2HB   ASP  40          1HB       ASP  40 -13.328   2.462   8.210
  310    H    GLY  41           H        GLY  41  -9.300   3.312   6.591
  311   1HA   GLY  41          2HA       GLY  41  -8.660   1.581   8.816
  312   2HA   GLY  41          1HA       GLY  41  -7.538   2.185   7.606
  313    H    GLU  42           H        GLU  42  -6.593   2.100  10.072
  314    HA   GLU  42           HA       GLU  42  -6.947   4.740  11.298
  315   1HB   GLU  42          2HB       GLU  42  -5.438   2.313  12.290
  316   2HB   GLU  42          1HB       GLU  42  -5.655   3.812  13.182
  317   1HG   GLU  42          2HG       GLU  42  -7.854   1.945  12.319
  318   2HG   GLU  42          1HG       GLU  42  -7.180   2.070  13.943
  319    H    TRP  43           H        TRP  43  -5.762   6.181  10.151
  320    HA   TRP  43           HA       TRP  43  -3.049   5.497   9.336
  321   1HB   TRP  43          2HB       TRP  43  -4.717   7.946   8.759
  322   2HB   TRP  43          1HB       TRP  43  -3.149   7.581   8.050
  323    HD1  TRP  43           HD       TRP  43  -6.329   5.344   8.352
  324    HE1  TRP  43           1HE      TRP  43  -6.883   4.483   5.977
  325    HE3  TRP  43           3HE      TRP  43  -2.660   7.744   5.741
  326    HZ2  TRP  43           2HZ      TRP  43  -5.886   4.783   3.362
  327    HZ3  TRP  43           3HZ      TRP  43  -2.525   7.408   3.316
  328    HH2  TRP  43           HH       TRP  43  -4.106   5.958   2.146
  329    H    THR  44           H        THR  44  -1.377   5.986  10.591
  330    HA   THR  44           HA       THR  44  -1.595   8.286  12.415
  331    HB   THR  44           HB       THR  44   0.261   7.198  13.680
  332    HG1  THR  44           1HG      THR  44   0.992   5.933  11.843
  333   1HG2  THR  44          1HG2      THR  44  -1.055   5.154  14.435
  334   2HG2  THR  44          2HG2      THR  44  -2.290   5.681  13.292
  335   3HG2  THR  44          3HG2      THR  44  -1.816   6.734  14.626
  336    H    TYR  45           H        TYR  45  -0.140   9.941  12.254
  337    HA   TYR  45           HA       TYR  45   1.785   9.759  10.036
  338   1HB   TYR  45          2HB       TYR  45   0.091  11.484   9.750
  339   2HB   TYR  45          1HB       TYR  45   0.503  12.182  11.312
  340    HD1  TYR  45           1HD      TYR  45   2.680  11.022   8.507
  341    HD2  TYR  45           2HD      TYR  45   1.376  14.289  10.902
  342    HE1  TYR  45           1HE      TYR  45   4.335  12.476   7.415
  343    HE2  TYR  45           2HE      TYR  45   3.027  15.752   9.814
  344    HH   TYR  45           HH       TYR  45   4.329  15.892   7.813
  345    H    ASP  46           H        ASP  46   3.894  10.410  10.259
  346    HA   ASP  46           HA       ASP  46   4.817  10.960  13.002
  347   1HB   ASP  46          2HB       ASP  46   5.412   8.673  12.331
  348   2HB   ASP  46          1HB       ASP  46   6.208   9.296  10.889
  349    H    ASP  47           H        ASP  47   4.678  13.204  12.455
  350    HA   ASP  47           HA       ASP  47   5.768  14.549  10.345
  351   1HB   ASP  47          2HB       ASP  47   5.818  15.409  13.243
  352   2HB   ASP  47          1HB       ASP  47   6.041  16.480  11.863
  353    H    ALA  48           H        ALA  48   7.488  13.257  13.132
  354    HA   ALA  48           HA       ALA  48   9.917  14.501  12.945
  355   1HB   ALA  48          1HB       ALA  48   9.978  13.128  14.723
  356   2HB   ALA  48          2HB       ALA  48  10.723  12.004  13.587
  357   3HB   ALA  48          3HB       ALA  48   8.998  11.893  13.935
  358    H    THR  49           H        THR  49   8.679  11.953  10.867
  359    HA   THR  49           HA       THR  49  11.077  12.285   9.191
  360    HB   THR  49           HB       THR  49  10.903   9.895   8.566
  361    HG1  THR  49           1HG      THR  49   9.229   8.807   9.152
  362   1HG2  THR  49          1HG2      THR  49  11.349   8.991  11.007
  363   2HG2  THR  49          2HG2      THR  49  11.465  10.717  11.353
  364   3HG2  THR  49          3HG2      THR  49  12.523   9.986  10.145
  365    H    LYS  50           H        LYS  50   8.110  13.248   9.214
  366    HA   LYS  50           HA       LYS  50   6.441  13.633   7.678
  367   1HB   LYS  50          2HB       LYS  50   8.581  13.174   5.596
  368   2HB   LYS  50          1HB       LYS  50   7.181  14.231   5.491
  369   1HG   LYS  50          2HG       LYS  50   9.505  14.636   7.363
  370   2HG   LYS  50          1HG       LYS  50   9.302  15.446   5.810
  371   1HD   LYS  50          2HD       LYS  50   7.166  15.601   7.902
  372   2HD   LYS  50          1HD       LYS  50   8.569  16.672   7.967
  373   1HE   LYS  50          2HE       LYS  50   6.871  17.851   6.825
  374   2HE   LYS  50          1HE       LYS  50   8.017  17.319   5.595
  375   1HZ   LYS  50          1HZ       LYS  50   5.400  16.964   5.412
  376   2HZ   LYS  50          2HZ       LYS  50   5.823  15.510   6.163
  377   3HZ   LYS  50          3HZ       LYS  50   6.524  15.932   4.682
  378    H    THR  51           H        THR  51   6.896  10.903   8.545
  379    HA   THR  51           HA       THR  51   6.180   9.359   6.160
  380    HB   THR  51           HB       THR  51   7.235   8.475   8.848
  381    HG1  THR  51           1HG      THR  51   8.689   9.507   7.296
  382   1HG2  THR  51          1HG2      THR  51   7.505   6.497   6.804
  383   2HG2  THR  51          2HG2      THR  51   5.806   6.906   7.029
  384   3HG2  THR  51          3HG2      THR  51   6.772   6.367   8.402
  385    H    PHE  52           H        PHE  52   4.426   7.951   6.146
  386    HA   PHE  52           HA       PHE  52   2.401   8.445   8.230
  387   1HB   PHE  52          2HB       PHE  52   2.028   7.813   5.296
  388   2HB   PHE  52          1HB       PHE  52   0.719   7.903   6.468
  389    HD1  PHE  52           1HD      PHE  52   0.393  10.115   7.699
  390    HD2  PHE  52           2HD      PHE  52   2.744   9.714   4.173
  391    HE1  PHE  52           1HE      PHE  52   0.183  12.532   7.286
  392    HE2  PHE  52           2HE      PHE  52   2.539  12.128   3.757
  393    HZ   PHE  52           HZ       PHE  52   1.258  13.541   5.316
  394    H    THR  53           H        THR  53   2.031   6.745   9.478
  395    HA   THR  53           HA       THR  53   2.591   4.063   8.420
  396    HB   THR  53           HB       THR  53   2.313   3.443  10.938
  397    HG1  THR  53           1HG      THR  53   3.072   6.152  11.192
  398   1HG2  THR  53          1HG2      THR  53   4.432   3.024  10.331
  399   2HG2  THR  53          2HG2      THR  53   4.744   4.464  11.304
  400   3HG2  THR  53          3HG2      THR  53   4.638   4.593   9.549
  401    H    VAL  54           H        VAL  54   1.034   2.778   7.893
  402    HA   VAL  54           HA       VAL  54  -1.691   3.318   8.878
  403    HB   VAL  54           HB       VAL  54  -0.855   1.825   6.376
  404   1HG1  VAL  54          1HG1      VAL  54  -3.200   1.576   7.798
  405   2HG1  VAL  54          2HG1      VAL  54  -2.976   1.182   6.094
  406   3HG1  VAL  54          3HG1      VAL  54  -3.606   2.763   6.558
  407   1HG2  VAL  54          1HG2      VAL  54  -2.246   3.967   5.499
  408   2HG2  VAL  54          2HG2      VAL  54  -0.489   3.921   5.634
  409   3HG2  VAL  54          3HG2      VAL  54  -1.452   4.657   6.915
  410    H    THR  55           H        THR  55  -2.022   2.044  10.608
  411    HA   THR  55           HA       THR  55  -0.935  -0.672  10.574
  412    HB   THR  55           HB       THR  55  -2.258   0.748  12.883
  413    HG1  THR  55           1HG      THR  55  -0.432   1.906  12.343
  414   1HG2  THR  55          1HG2      THR  55  -0.860  -0.833  14.213
  415   2HG2  THR  55          2HG2      THR  55  -0.501  -1.684  12.709
  416   3HG2  THR  55          3HG2      THR  55  -2.163  -1.591  13.297
  417    H    GLU  56           H        GLU  56  -2.153  -2.292   9.946
  418    HA   GLU  56           HA       GLU  56  -4.858  -2.134   9.322
  419   1HB   GLU  56          2HB       GLU  56  -3.387  -3.853   8.411
  420   2HB   GLU  56          1HB       GLU  56  -3.191  -4.562  10.009
  421   1HG   GLU  56          2HG       GLU  56  -4.741  -5.853   8.661
  422   2HG   GLU  56          1HG       GLU  56  -5.556  -5.142  10.055
  423   1H    MET   1          1HT       MET   1   6.989  18.573  -2.689
  424   2H    MET   1          2HT       MET   1   6.364  19.633  -1.529
  425   3H    MET   1          3HT       MET   1   5.456  18.298  -2.028
  426    HA   MET   1           HA       MET   1   8.100  17.961  -0.772
  427   1HB   MET   1          2HB       MET   1   6.745  19.343   0.728
  428   2HB   MET   1          1HB       MET   1   5.419  18.198   0.609
  429   1HG   MET   1          2HG       MET   1   6.700  16.516   1.751
  430   2HG   MET   1          1HG       MET   1   8.127  17.549   1.753
  431   1HE   MET   1          1HE       MET   1   7.615  20.110   4.373
  432   2HE   MET   1          2HE       MET   1   6.794  20.556   2.878
  433   3HE   MET   1          3HE       MET   1   8.332  19.695   2.817
  434    H    GLN   2           H        GLN   2   8.582  15.861  -0.384
  435    HA   GLN   2           HA       GLN   2   6.691  13.866  -1.402
  436   1HB   GLN   2          2HB       GLN   2   8.915  13.901  -2.456
  437   2HB   GLN   2          1HB       GLN   2   9.665  13.648  -0.886
  438   1HG   GLN   2          2HG       GLN   2   8.583  11.472  -0.709
  439   2HG   GLN   2          1HG       GLN   2   7.810  11.725  -2.273
  440   1HE2  GLN   2          1HE2      GLN   2  10.257  10.177  -0.805
  441   2HE2  GLN   2          2HE2      GLN   2  11.364  10.028  -2.123
  442    H    TYR   3           H        TYR   3   5.987  12.194  -0.139
  443    HA   TYR   3           HA       TYR   3   6.857  12.242   2.674
  444   1HB   TYR   3          2HB       TYR   3   4.096  11.827   1.530
  445   2HB   TYR   3          1HB       TYR   3   4.514  11.426   3.193
  446    HD1  TYR   3           1HD      TYR   3   4.348  13.040   4.844
  447    HD2  TYR   3           2HD      TYR   3   4.568  14.269   0.778
  448    HE1  TYR   3           1HE      TYR   3   3.939  15.361   5.534
  449    HE2  TYR   3           2HE      TYR   3   4.155  16.599   1.452
  450    HH   TYR   3           HH       TYR   3   3.481  17.447   4.824
  451    H    LYS   4           H        LYS   4   7.177  10.337   3.721
  452    HA   LYS   4           HA       LYS   4   7.349   7.961   2.015
  453   1HB   LYS   4          2HB       LYS   4   9.380   8.738   3.260
  454   2HB   LYS   4          1HB       LYS   4   8.523   8.430   4.765
  455   1HG   LYS   4          2HG       LYS   4  10.033   6.610   4.230
  456   2HG   LYS   4          1HG       LYS   4   8.353   6.068   4.194
  457   1HD   LYS   4          2HD       LYS   4   8.341   6.276   1.756
  458   2HD   LYS   4          1HD       LYS   4  10.022   6.814   1.791
  459   1HE   LYS   4          2HE       LYS   4   8.995   4.148   2.739
  460   2HE   LYS   4          1HE       LYS   4   9.843   4.442   1.221
  461   1HZ   LYS   4          1HZ       LYS   4  11.563   3.772   2.530
  462   2HZ   LYS   4          2HZ       LYS   4  10.885   4.383   3.956
  463   3HZ   LYS   4          3HZ       LYS   4  11.622   5.432   2.852
  464    H    VAL   5           H        VAL   5   5.418   6.910   2.067
  465    HA   VAL   5           HA       VAL   5   3.981   6.760   4.599
  466    HB   VAL   5           HB       VAL   5   3.129   5.911   1.832
  467   1HG1  VAL   5          1HG1      VAL   5   1.931   4.541   3.331
  468   2HG1  VAL   5          2HG1      VAL   5   0.840   5.869   2.937
  469   3HG1  VAL   5          3HG1      VAL   5   1.700   5.862   4.477
  470   1HG2  VAL   5          1HG2      VAL   5   3.412   8.438   2.700
  471   2HG2  VAL   5          2HG2      VAL   5   1.772   8.105   3.254
  472   3HG2  VAL   5          3HG2      VAL   5   2.178   7.935   1.546
  473    H    ILE   6           H        ILE   6   4.073   5.092   5.865
  474    HA   ILE   6           HA       ILE   6   5.196   2.576   4.869
  475    HB   ILE   6           HB       ILE   6   4.954   3.669   7.671
  476   1HG1  ILE   6          2HG1      ILE   6   7.250   3.167   5.790
  477   2HG1  ILE   6          1HG1      ILE   6   6.759   4.688   6.512
  478   1HG2  ILE   6          1HG2      ILE   6   4.558   1.312   7.812
  479   2HG2  ILE   6          2HG2      ILE   6   6.199   1.633   8.369
  480   3HG2  ILE   6          3HG2      ILE   6   5.931   0.969   6.757
  481   1HD1  ILE   6          1HD1      ILE   6   8.291   4.351   8.068
  482   2HD1  ILE   6          2HD1      ILE   6   8.603   2.718   7.478
  483   3HD1  ILE   6          3HD1      ILE   6   7.322   3.001   8.660
  484    H    LEU   7           H        LEU   7   3.925   0.888   4.602
  485    HA   LEU   7           HA       LEU   7   1.213   0.970   5.729
  486   1HB   LEU   7          2HB       LEU   7   2.138  -0.949   3.611
  487   2HB   LEU   7          1HB       LEU   7   0.514  -0.383   3.949
  488    HG   LEU   7           HG       LEU   7   2.723   1.204   2.659
  489   1HD1  LEU   7          1HD1      LEU   7   1.405   1.115   0.684
  490   2HD1  LEU   7          2HD1      LEU   7   0.059   0.363   1.542
  491   3HD1  LEU   7          3HD1      LEU   7   1.554  -0.537   1.290
  492   1HD2  LEU   7          1HD2      LEU   7   1.406   2.638   4.109
  493   2HD2  LEU   7          2HD2      LEU   7  -0.083   2.029   3.389
  494   3HD2  LEU   7          3HD2      LEU   7   1.043   2.975   2.416
  495    H    ASN   8           H        ASN   8   1.874   0.267   7.820
  496    HA   ASN   8           HA       ASN   8   3.149  -2.326   8.067
  497   1HB   ASN   8          2HB       ASN   8   3.773  -0.359   9.483
  498   2HB   ASN   8          1HB       ASN   8   2.176  -0.437  10.216
  499   1HD2  ASN   8          1HD2      ASN   8   5.166  -0.998  10.931
  500   2HD2  ASN   8          2HD2      ASN   8   5.049  -2.426  11.897
  501    H    GLY   9           H        GLY   9   1.827  -4.039   7.777
  502   1HA   GLY   9          2HA       GLY   9  -0.789  -3.972   9.152
  503   2HA   GLY   9          1HA       GLY   9  -0.501  -4.841   7.655
  504    H    LYS  10           H        LYS  10  -1.498  -6.572   8.982
  505    HA   LYS  10           HA       LYS  10   0.160  -7.751  11.026
  506   1HB   LYS  10          2HB       LYS  10  -2.334  -8.807   9.679
  507   2HB   LYS  10          1HB       LYS  10  -1.577  -9.501  11.104
  508   1HG   LYS  10          2HG       LYS  10  -2.464  -6.655  11.150
  509   2HG   LYS  10          1HG       LYS  10  -3.652  -7.944  11.324
  510   1HD   LYS  10          2HD       LYS  10  -2.910  -7.162  13.503
  511   2HD   LYS  10          1HD       LYS  10  -2.404  -8.829  13.238
  512   1HE   LYS  10          2HE       LYS  10  -0.528  -6.627  12.532
  513   2HE   LYS  10          1HE       LYS  10  -0.755  -7.032  14.232
  514   1HZ   LYS  10          1HZ       LYS  10  -0.279  -9.270  12.440
  515   2HZ   LYS  10          2HZ       LYS  10   0.308  -8.988  13.999
  516   3HZ   LYS  10          3HZ       LYS  10   1.029  -8.224  12.673
  517    H    THR  11           H        THR  11  -1.093  -8.848   7.884
  518    HA   THR  11           HA       THR  11   1.085 -10.778   7.681
  519    HB   THR  11           HB       THR  11  -0.378 -11.457   5.632
  520    HG1  THR  11           1HG      THR  11  -1.713  -9.627   5.693
  521   1HG2  THR  11          1HG2      THR  11  -1.574 -12.997   6.872
  522   2HG2  THR  11          2HG2      THR  11  -1.760 -11.900   8.240
  523   3HG2  THR  11          3HG2      THR  11  -0.194 -12.642   7.911
  524    H    LEU  12           H        LEU  12   0.560  -7.649   6.847
  525    HA   LEU  12           HA       LEU  12   2.373  -7.885   4.572
  526   1HB   LEU  12          2HB       LEU  12   0.134  -7.694   3.634
  527   2HB   LEU  12          1HB       LEU  12  -0.157  -6.245   4.577
  528    HG   LEU  12           HG       LEU  12   1.374  -4.985   3.285
  529   1HD1  LEU  12          1HD1      LEU  12   3.243  -5.992   2.632
  530   2HD1  LEU  12          2HD1      LEU  12   2.321  -6.619   1.264
  531   3HD1  LEU  12          3HD1      LEU  12   2.501  -7.585   2.724
  532   1HD2  LEU  12          1HD2      LEU  12  -0.281  -4.781   1.818
  533   2HD2  LEU  12          2HD2      LEU  12  -0.760  -6.465   2.032
  534   3HD2  LEU  12          3HD2      LEU  12   0.497  -6.046   0.868
  535    H    LYS  13           H        LYS  13   3.881  -6.354   4.414
  536    HA   LYS  13           HA       LYS  13   3.697  -3.909   5.992
  537   1HB   LYS  13          2HB       LYS  13   6.015  -5.838   6.260
  538   2HB   LYS  13          1HB       LYS  13   5.910  -4.248   7.003
  539   1HG   LYS  13          2HG       LYS  13   4.022  -4.980   8.345
  540   2HG   LYS  13          1HG       LYS  13   4.073  -6.565   7.573
  541   1HD   LYS  13          2HD       LYS  13   5.157  -6.617   9.760
  542   2HD   LYS  13          1HD       LYS  13   6.317  -6.933   8.469
  543   1HE   LYS  13          2HE       LYS  13   7.252  -5.419  10.133
  544   2HE   LYS  13          1HE       LYS  13   7.072  -4.613   8.576
  545   1HZ   LYS  13          1HZ       LYS  13   5.511  -3.221   9.377
  546   2HZ   LYS  13          2HZ       LYS  13   6.253  -3.555  10.858
  547   3HZ   LYS  13          3HZ       LYS  13   4.836  -4.369  10.421
  548    H    GLY  14           H        GLY  14   5.040  -2.217   5.143
  549   1HA   GLY  14          2HA       GLY  14   6.971  -2.731   3.122
  550   2HA   GLY  14          1HA       GLY  14   5.440  -2.284   2.395
  551    H    GLU  15           H        GLU  15   7.047  -0.667   1.568
  552    HA   GLU  15           HA       GLU  15   6.825   1.779   3.165
  553   1HB   GLU  15          2HB       GLU  15   9.323   0.840   1.733
  554   2HB   GLU  15          1HB       GLU  15   9.125   2.408   2.494
  555   1HG   GLU  15          2HG       GLU  15   8.972  -0.215   3.955
  556   2HG   GLU  15          1HG       GLU  15  10.420   0.782   3.842
  557    H    THR  16           H        THR  16   5.942   3.376   1.990
  558    HA   THR  16           HA       THR  16   6.293   3.346  -0.920
  559    HB   THR  16           HB       THR  16   4.163   2.460  -0.869
  560    HG1  THR  16           1HG      THR  16   3.599   5.198  -0.649
  561   1HG2  THR  16          1HG2      THR  16   3.827   2.516   1.559
  562   2HG2  THR  16          2HG2      THR  16   2.392   3.009   0.660
  563   3HG2  THR  16          3HG2      THR  16   3.402   4.222   1.441
  564    H    THR  17           H        THR  17   5.572   5.479  -1.929
  565    HA   THR  17           HA       THR  17   5.888   7.736  -0.098
  566    HB   THR  17           HB       THR  17   7.593   8.746  -1.604
  567    HG1  THR  17           1HG      THR  17   7.922   7.795  -3.424
  568   1HG2  THR  17          1HG2      THR  17   8.461   7.759   0.364
  569   2HG2  THR  17          2HG2      THR  17   9.486   7.243  -0.976
  570   3HG2  THR  17          3HG2      THR  17   8.292   6.134  -0.301
  571    H    THR  18           H        THR  18   4.356   9.146  -0.476
  572    HA   THR  18           HA       THR  18   3.275   9.467  -3.216
  573    HB   THR  18           HB       THR  18   1.642   8.750  -1.492
  574    HG1  THR  18           1HG      THR  18   1.002  10.129  -3.231
  575   1HG2  THR  18          1HG2      THR  18   0.895  10.597   0.109
  576   2HG2  THR  18          2HG2      THR  18   2.514  11.258  -0.122
  577   3HG2  THR  18          3HG2      THR  18   2.309   9.637   0.543
  578    H    GLU  19           H        GLU  19   3.123  11.537  -4.088
  579    HA   GLU  19           HA       GLU  19   4.730  13.602  -2.731
  580   1HB   GLU  19          2HB       GLU  19   5.563  12.980  -4.919
  581   2HB   GLU  19          1HB       GLU  19   3.980  13.225  -5.640
  582   1HG   GLU  19          2HG       GLU  19   5.465  15.054  -6.178
  583   2HG   GLU  19          1HG       GLU  19   4.130  15.614  -5.173
  584    H    ALA  20           H        ALA  20   3.572  15.145  -1.695
  585    HA   ALA  20           HA       ALA  20   1.270  16.304  -3.045
  586   1HB   ALA  20          1HB       ALA  20   0.786  15.742  -0.193
  587   2HB   ALA  20          2HB       ALA  20   0.757  14.351  -1.277
  588   3HB   ALA  20          3HB       ALA  20  -0.324  15.715  -1.563
  589    H    VAL  21           H        VAL  21   0.757  18.367  -2.400
  590    HA   VAL  21           HA       VAL  21   2.780  20.096  -1.732
  591    HB   VAL  21           HB       VAL  21  -0.130  20.598  -1.109
  592   1HG1  VAL  21          1HG1      VAL  21   0.349  22.890  -1.285
  593   2HG1  VAL  21          2HG1      VAL  21   1.932  22.591  -2.000
  594   3HG1  VAL  21          3HG1      VAL  21   1.649  22.224  -0.299
  595   1HG2  VAL  21          1HG2      VAL  21   0.041  21.675  -3.483
  596   2HG2  VAL  21          2HG2      VAL  21  -0.264  19.946  -3.311
  597   3HG2  VAL  21          3HG2      VAL  21   1.360  20.523  -3.693
  598    H    ASP  22           H        ASP  22   0.743  18.293   0.446
  599    HA   ASP  22           HA       ASP  22   2.447  19.054   2.655
  600   1HB   ASP  22          2HB       ASP  22   0.690  19.873   4.118
  601   2HB   ASP  22          1HB       ASP  22   0.762  20.857   2.660
  602    H    ALA  23           H        ALA  23   1.548  17.969   4.771
  603    HA   ALA  23           HA       ALA  23   1.592  15.211   4.327
  604   1HB   ALA  23          1HB       ALA  23   0.472  15.572   6.862
  605   2HB   ALA  23          2HB       ALA  23   1.505  16.976   6.599
  606   3HB   ALA  23          3HB       ALA  23   2.176  15.352   6.468
  607    H    ALA  24           H        ALA  24  -1.118  17.373   5.024
  608    HA   ALA  24           HA       ALA  24  -3.077  15.349   5.228
  609   1HB   ALA  24          1HB       ALA  24  -4.541  17.043   5.522
  610   2HB   ALA  24          2HB       ALA  24  -3.969  17.922   4.105
  611   3HB   ALA  24          3HB       ALA  24  -3.088  18.036   5.628
  612    H    THR  25           H        THR  25  -2.244  17.485   2.482
  613    HA   THR  25           HA       THR  25  -3.907  16.372   0.586
  614    HB   THR  25           HB       THR  25  -2.190  17.133  -1.071
  615    HG1  THR  25           1HG      THR  25  -0.664  17.250   1.227
  616   1HG2  THR  25          1HG2      THR  25  -2.061  19.558  -0.181
  617   2HG2  THR  25          2HG2      THR  25  -3.132  18.955   1.085
  618   3HG2  THR  25          3HG2      THR  25  -3.625  18.862  -0.607
  619    H    ALA  26           H        ALA  26  -0.644  15.403   1.578
  620    HA   ALA  26           HA       ALA  26  -0.343  13.249  -0.201
  621   1HB   ALA  26          1HB       ALA  26   1.449  14.301   1.248
  622   2HB   ALA  26          2HB       ALA  26   1.460  12.538   1.168
  623   3HB   ALA  26          3HB       ALA  26   0.797  13.354   2.584
  624    H    GLU  27           H        GLU  27  -1.471  13.335   3.187
  625    HA   GLU  27           HA       GLU  27  -2.097  10.670   3.498
  626   1HB   GLU  27          2HB       GLU  27  -2.141  12.294   5.329
  627   2HB   GLU  27          1HB       GLU  27  -3.556  13.061   4.621
  628   1HG   GLU  27          2HG       GLU  27  -4.841  11.014   4.962
  629   2HG   GLU  27          1HG       GLU  27  -3.422  10.241   5.667
  630    H    LYS  28           H        LYS  28  -4.095  13.292   2.202
  631    HA   LYS  28           HA       LYS  28  -6.401  11.725   1.740
  632   1HB   LYS  28          2HB       LYS  28  -5.499  14.264   0.364
  633   2HB   LYS  28          1HB       LYS  28  -7.116  13.578   0.276
  634   1HG   LYS  28          2HG       LYS  28  -5.748  14.680   2.718
  635   2HG   LYS  28          1HG       LYS  28  -7.117  15.380   1.850
  636   1HD   LYS  28          2HD       LYS  28  -8.484  13.445   2.445
  637   2HD   LYS  28          1HD       LYS  28  -7.112  12.730   3.295
  638   1HE   LYS  28          2HE       LYS  28  -7.076  14.632   4.833
  639   2HE   LYS  28          1HE       LYS  28  -8.441  15.351   3.981
  640   1HZ   LYS  28          1HZ       LYS  28  -9.894  13.934   4.928
  641   2HZ   LYS  28          2HZ       LYS  28  -8.709  13.827   6.131
  642   3HZ   LYS  28          3HZ       LYS  28  -8.813  12.631   4.939
  643    H    VAL  29           H        VAL  29  -3.726  12.722  -0.376
  644    HA   VAL  29           HA       VAL  29  -4.621  11.512  -2.724
  645    HB   VAL  29           HB       VAL  29  -1.765  11.875  -1.793
  646   1HG1  VAL  29          1HG1      VAL  29  -1.112  10.858  -3.654
  647   2HG1  VAL  29          2HG1      VAL  29  -2.028  12.016  -4.618
  648   3HG1  VAL  29          3HG1      VAL  29  -2.793  10.525  -4.069
  649   1HG2  VAL  29          1HG2      VAL  29  -1.867  14.027  -2.420
  650   2HG2  VAL  29          2HG2      VAL  29  -3.612  13.829  -2.257
  651   3HG2  VAL  29          3HG2      VAL  29  -2.849  13.669  -3.839
  652    H    VAL  30           H        VAL  30  -2.761  10.214  -0.024
  653    HA   VAL  30           HA       VAL  30  -2.275   7.661  -1.157
  654    HB   VAL  30           HB       VAL  30  -2.548   8.334   1.779
  655   1HG1  VAL  30          1HG1      VAL  30  -1.339   6.363   2.223
  656   2HG1  VAL  30          2HG1      VAL  30  -0.862   6.179   0.537
  657   3HG1  VAL  30          3HG1      VAL  30  -2.535   5.899   1.014
  658   1HG2  VAL  30          1HG2      VAL  30  -0.543   9.324   1.775
  659   2HG2  VAL  30          2HG2      VAL  30  -0.770   9.480   0.032
  660   3HG2  VAL  30          3HG2      VAL  30   0.147   8.122   0.683
  661    H    LYS  31           H        LYS  31  -4.830   8.913   1.012
  662    HA   LYS  31           HA       LYS  31  -6.279   6.609   1.429
  663   1HB   LYS  31          2HB       LYS  31  -7.211   9.449   1.054
  664   2HB   LYS  31          1HB       LYS  31  -8.310   8.143   1.473
  665   1HG   LYS  31          2HG       LYS  31  -7.175   7.749   3.529
  666   2HG   LYS  31          1HG       LYS  31  -5.888   8.872   3.094
  667   1HD   LYS  31          2HD       LYS  31  -7.358   9.959   4.652
  668   2HD   LYS  31          1HD       LYS  31  -7.576  10.701   3.068
  669   1HE   LYS  31          2HE       LYS  31  -9.354   8.523   4.147
  670   2HE   LYS  31          1HE       LYS  31  -9.690  10.239   4.351
  671   1HZ   LYS  31          1HZ       LYS  31 -10.748  10.083   2.418
  672   2HZ   LYS  31          2HZ       LYS  31 -10.089   8.567   2.064
  673   3HZ   LYS  31          3HZ       LYS  31  -9.230   9.972   1.680
  674    H    GLN  32           H        GLN  32  -6.422   8.822  -1.310
  675    HA   GLN  32           HA       GLN  32  -8.479   7.538  -2.737
  676   1HB   GLN  32          2HB       GLN  32  -7.599   9.792  -3.301
  677   2HB   GLN  32          1HB       GLN  32  -6.103   9.054  -3.851
  678   1HG   GLN  32          2HG       GLN  32  -7.466   9.585  -5.743
  679   2HG   GLN  32          1HG       GLN  32  -7.366   7.836  -5.575
  680   1HE2  GLN  32          1HE2      GLN  32  -9.404   9.150  -3.223
  681   2HE2  GLN  32          2HE2      GLN  32 -10.907   8.859  -4.017
  682    H    PHE  33           H        PHE  33  -5.034   6.990  -2.513
  683    HA   PHE  33           HA       PHE  33  -4.607   5.196  -4.582
  684   1HB   PHE  33          2HB       PHE  33  -2.895   6.235  -3.017
  685   2HB   PHE  33          1HB       PHE  33  -3.351   5.017  -1.836
  686    HD1  PHE  33           1HD      PHE  33  -2.331   5.206  -5.417
  687    HD2  PHE  33           2HD      PHE  33  -2.031   3.160  -1.688
  688    HE1  PHE  33           1HE      PHE  33  -0.728   3.620  -6.404
  689    HE2  PHE  33           2HE      PHE  33  -0.420   1.588  -2.678
  690    HZ   PHE  33           HZ       PHE  33   0.230   1.821  -5.045
  691    H    PHE  34           H        PHE  34  -5.173   4.365  -1.187
  692    HA   PHE  34           HA       PHE  34  -5.723   1.621  -1.700
  693   1HB   PHE  34          2HB       PHE  34  -6.389   3.276   0.738
  694   2HB   PHE  34          1HB       PHE  34  -6.389   1.513   0.654
  695    HD1  PHE  34           1HD      PHE  34  -4.014   0.932  -0.881
  696    HD2  PHE  34           2HD      PHE  34  -4.639   3.854   2.141
  697    HE1  PHE  34           1HE      PHE  34  -1.611   0.919  -0.382
  698    HE2  PHE  34           2HE      PHE  34  -2.234   3.845   2.653
  699    HZ   PHE  34           HZ       PHE  34  -0.723   2.376   1.376
  700    H    ASN  35           H        ASN  35  -7.736   4.455  -1.228
  701    HA   ASN  35           HA       ASN  35 -10.256   3.351  -1.034
  702   1HB   ASN  35          2HB       ASN  35  -9.754   5.769  -0.915
  703   2HB   ASN  35          1HB       ASN  35  -9.423   5.780  -2.644
  704   1HD2  ASN  35          1HD2      ASN  35 -11.514   6.896  -0.657
  705   2HD2  ASN  35          2HD2      ASN  35 -13.003   6.666  -1.502
  706    H    ASP  36           H        ASP  36  -8.243   3.880  -3.836
  707    HA   ASP  36           HA       ASP  36 -10.216   2.682  -5.624
  708   1HB   ASP  36          2HB       ASP  36  -7.570   4.014  -6.226
  709   2HB   ASP  36          1HB       ASP  36  -8.682   3.391  -7.440
  710    H    ASN  37           H        ASN  37  -7.248   1.810  -4.026
  711    HA   ASN  37           HA       ASN  37  -6.657  -0.353  -5.856
  712   1HB   ASN  37          2HB       ASN  37  -5.545   0.276  -3.110
  713   2HB   ASN  37          1HB       ASN  37  -4.989  -1.048  -4.125
  714   1HD2  ASN  37          1HD2      ASN  37  -3.758   1.509  -3.050
  715   2HD2  ASN  37          2HD2      ASN  37  -3.030   2.219  -4.448
  716    H    GLY  38           H        GLY  38  -7.942   0.017  -2.614
  717   1HA   GLY  38          2HA       GLY  38  -8.445  -2.002  -1.271
  718   2HA   GLY  38          1HA       GLY  38  -9.883  -1.266  -1.942
  719    H    VAL  39           H        VAL  39 -11.246  -2.601  -2.821
  720    HA   VAL  39           HA       VAL  39 -10.320  -5.278  -3.593
  721    HB   VAL  39           HB       VAL  39 -13.105  -4.319  -3.017
  722   1HG1  VAL  39          1HG1      VAL  39 -11.935  -6.965  -3.701
  723   2HG1  VAL  39          2HG1      VAL  39 -13.485  -6.261  -4.161
  724   3HG1  VAL  39          3HG1      VAL  39 -13.261  -6.917  -2.540
  725   1HG2  VAL  39          1HG2      VAL  39 -11.644  -4.092  -1.063
  726   2HG2  VAL  39          2HG2      VAL  39 -11.198  -5.792  -1.207
  727   3HG2  VAL  39          3HG2      VAL  39 -12.862  -5.345  -0.828
  728    H    ASP  40           H        ASP  40 -10.990  -2.496  -5.317
  729    HA   ASP  40           HA       ASP  40 -12.086  -4.106  -7.518
  730   1HB   ASP  40          2HB       ASP  40 -12.707  -1.217  -6.882
  731   2HB   ASP  40          1HB       ASP  40 -13.266  -2.085  -8.308
  732    H    GLY  41           H        GLY  41  -9.284  -3.033  -6.634
  733   1HA   GLY  41          2HA       GLY  41  -8.568  -1.318  -8.848
  734   2HA   GLY  41          1HA       GLY  41  -7.481  -1.952  -7.624
  735    H    GLU  42           H        GLU  42  -6.495  -1.891 -10.072
  736    HA   GLU  42           HA       GLU  42  -6.900  -4.520 -11.307
  737   1HB   GLU  42          2HB       GLU  42  -5.320  -2.128 -12.275
  738   2HB   GLU  42          1HB       GLU  42  -5.560  -3.621 -13.171
  739   1HG   GLU  42          2HG       GLU  42  -7.725  -1.703 -12.341
  740   2HG   GLU  42          1HG       GLU  42  -7.030  -1.844 -13.954
  741    H    TRP  43           H        TRP  43  -5.767  -5.991 -10.145
  742    HA   TRP  43           HA       TRP  43  -3.049  -5.372  -9.292
  743   1HB   TRP  43          2HB       TRP  43  -4.784  -7.778  -8.735
  744   2HB   TRP  43          1HB       TRP  43  -3.219  -7.450  -8.005
  745    HD1  TRP  43           HD       TRP  43  -6.339  -5.135  -8.350
  746    HE1  TRP  43           1HE      TRP  43  -6.905  -4.262  -5.984
  747    HE3  TRP  43           3HE      TRP  43  -2.766  -7.623  -5.690
  748    HZ2  TRP  43           2HZ      TRP  43  -5.952  -4.587  -3.355
  749    HZ3  TRP  43           3HZ      TRP  43  -2.657  -7.293  -3.263
  750    HH2  TRP  43           HH       TRP  43  -4.217  -5.806  -2.114
  751    H    THR  44           H        THR  44  -1.372  -5.901 -10.522
  752    HA   THR  44           HA       THR  44  -1.620  -8.195 -12.350
  753    HB   THR  44           HB       THR  44   0.279  -7.151 -13.587
  754    HG1  THR  44           1HG      THR  44   1.014  -5.904 -11.741
  755   1HG2  THR  44          1HG2      THR  44  -0.976  -5.078 -14.361
  756   2HG2  THR  44          2HG2      THR  44  -2.239  -5.572 -13.235
  757   3HG2  THR  44          3HG2      THR  44  -1.772  -6.637 -14.562
  758    H    TYR  45           H        TYR  45  -0.209  -9.886 -12.165
  759    HA   TYR  45           HA       TYR  45   1.689  -9.748  -9.921
  760   1HB   TYR  45          2HB       TYR  45  -0.050 -11.433  -9.659
  761   2HB   TYR  45          1HB       TYR  45   0.366 -12.139 -11.216
  762    HD1  TYR  45           1HD      TYR  45   2.530 -11.032  -8.380
  763    HD2  TYR  45           2HD      TYR  45   1.183 -14.267 -10.794
  764    HE1  TYR  45           1HE      TYR  45   4.134 -12.525  -7.266
  765    HE2  TYR  45           2HE      TYR  45   2.782 -15.769  -9.685
  766    HH   TYR  45           HH       TYR  45   4.051 -15.941  -7.663
  767    H    ASP  46           H        ASP  46   3.786 -10.452 -10.115
  768    HA   ASP  46           HA       ASP  46   4.732 -11.024 -12.846
  769   1HB   ASP  46          2HB       ASP  46   5.373  -8.751 -12.167
  770   2HB   ASP  46          1HB       ASP  46   6.133  -9.393 -10.713
  771    H    ASP  47           H        ASP  47   4.532 -13.263 -12.299
  772    HA   ASP  47           HA       ASP  47   5.558 -14.634 -10.174
  773   1HB   ASP  47          2HB       ASP  47   5.629 -15.495 -13.074
  774   2HB   ASP  47          1HB       ASP  47   5.806 -16.571 -11.689
  775    H    ALA  48           H        ALA  48   7.349 -13.383 -12.937
  776    HA   ALA  48           HA       ALA  48   9.743 -14.687 -12.718
  777   1HB   ALA  48          1HB       ALA  48   9.865 -13.316 -14.493
  778   2HB   ALA  48          2HB       ALA  48  10.620 -12.210 -13.347
  779   3HB   ALA  48          3HB       ALA  48   8.903 -12.057 -13.718
  780    H    THR  49           H        THR  49   8.538 -12.110 -10.656
  781    HA   THR  49           HA       THR  49  10.904 -12.500  -8.946
  782    HB   THR  49           HB       THR  49  10.779 -10.106  -8.323
  783    HG1  THR  49           1HG      THR  49   9.140  -8.978  -8.932
  784   1HG2  THR  49          1HG2      THR  49  11.281  -9.214 -10.758
  785   2HG2  THR  49          2HG2      THR  49  11.361 -10.942 -11.102
  786   3HG2  THR  49          3HG2      THR  49  12.418 -10.237  -9.880
  787    H    LYS  50           H        LYS  50   7.915 -13.389  -9.011
  788    HA   LYS  50           HA       LYS  50   6.218 -13.734  -7.500
  789   1HB   LYS  50          2HB       LYS  50   8.338 -13.327  -5.388
  790   2HB   LYS  50          1HB       LYS  50   6.911 -14.349  -5.301
  791   1HG   LYS  50          2HG       LYS  50   9.248 -14.812  -7.141
  792   2HG   LYS  50          1HG       LYS  50   9.005 -15.615  -5.591
  793   1HD   LYS  50          2HD       LYS  50   6.896 -15.720  -7.714
  794   2HD   LYS  50          1HD       LYS  50   8.273 -16.824  -7.759
  795   1HE   LYS  50          2HE       LYS  50   6.533 -17.961  -6.641
  796   2HE   LYS  50          1HE       LYS  50   7.672 -17.456  -5.394
  797   1HZ   LYS  50          1HZ       LYS  50   5.062 -17.039  -5.248
  798   2HZ   LYS  50          2HZ       LYS  50   5.531 -15.596  -5.993
  799   3HZ   LYS  50          3HZ       LYS  50   6.201 -16.033  -4.503
  800    H    THR  51           H        THR  51   6.750 -11.016  -8.360
  801    HA   THR  51           HA       THR  51   6.039  -9.454  -5.983
  802    HB   THR  51           HB       THR  51   7.152  -8.597  -8.658
  803    HG1  THR  51           1HG      THR  51   8.557  -9.663  -7.085
  804   1HG2  THR  51          1HG2      THR  51   7.440  -6.626  -6.609
  805   2HG2  THR  51          2HG2      THR  51   5.736  -6.992  -6.859
  806   3HG2  THR  51          3HG2      THR  51   6.733  -6.478  -8.216
  807    H    PHE  52           H        PHE  52   4.318  -8.004  -5.993
  808    HA   PHE  52           HA       PHE  52   2.311  -8.449  -8.108
  809   1HB   PHE  52          2HB       PHE  52   1.911  -7.808  -5.178
  810   2HB   PHE  52          1HB       PHE  52   0.617  -7.868  -6.369
  811    HD1  PHE  52           1HD      PHE  52   0.257 -10.071  -7.604
  812    HD2  PHE  52           2HD      PHE  52   2.566  -9.725  -4.046
  813    HE1  PHE  52           1HE      PHE  52  -0.018 -12.481  -7.196
  814    HE2  PHE  52           2HE      PHE  52   2.297 -12.135  -3.633
  815    HZ   PHE  52           HZ       PHE  52   1.003 -13.515  -5.210
  816    H    THR  53           H        THR  53   2.000  -6.742  -9.360
  817    HA   THR  53           HA       THR  53   2.611  -4.075  -8.294
  818    HB   THR  53           HB       THR  53   2.383  -3.447 -10.816
  819    HG1  THR  53           1HG      THR  53   3.079  -6.172 -11.059
  820   1HG2  THR  53          1HG2      THR  53   4.502  -3.079 -10.177
  821   2HG2  THR  53          2HG2      THR  53   4.793  -4.527 -11.146
  822   3HG2  THR  53          3HG2      THR  53   4.659  -4.654  -9.393
  823    H    VAL  54           H        VAL  54   1.077  -2.751  -7.790
  824    HA   VAL  54           HA       VAL  54  -1.645  -3.225  -8.812
  825    HB   VAL  54           HB       VAL  54  -0.809  -1.752  -6.298
  826   1HG1  VAL  54          1HG1      VAL  54  -3.127  -1.446  -7.754
  827   2HG1  VAL  54          2HG1      VAL  54  -2.918  -1.058  -6.046
  828   3HG1  VAL  54          3HG1      VAL  54  -3.579  -2.623  -6.521
  829   1HG2  VAL  54          1HG2      VAL  54  -2.265  -3.858  -5.442
  830   2HG2  VAL  54          2HG2      VAL  54  -0.504  -3.855  -5.551
  831   3HG2  VAL  54          3HG2      VAL  54  -1.467  -4.569  -6.846
  832    H    THR  55           H        THR  55  -1.918  -1.944 -10.547
  833    HA   THR  55           HA       THR  55  -0.768   0.745 -10.496
  834    HB   THR  55           HB       THR  55  -2.094  -0.642 -12.825
  835    HG1  THR  55           1HG      THR  55  -0.304  -1.845 -12.259
  836   1HG2  THR  55          1HG2      THR  55  -0.637   0.904 -14.134
  837   2HG2  THR  55          2HG2      THR  55  -0.281   1.746 -12.624
  838   3HG2  THR  55          3HG2      THR  55  -1.937   1.692 -13.236
  839    H    GLU  56           H        GLU  56  -1.956   2.395  -9.886
  840    HA   GLU  56           HA       GLU  56  -4.673   2.303  -9.299
  841   1HB   GLU  56          2HB       GLU  56  -3.173   3.985  -8.369
  842   2HB   GLU  56          1HB       GLU  56  -2.939   4.690  -9.963
  843   1HG   GLU  56          2HG       GLU  56  -4.474   6.017  -8.637
  844   2HG   GLU  56          1HG       GLU  56  -5.287   5.327 -10.041
  Start of MODEL    8
    1   1H    MET   1          1HT       MET   1   6.353 -18.485   2.745
    2   2H    MET   1          2HT       MET   1   6.863 -19.849   1.884
    3   3H    MET   1          3HT       MET   1   5.304 -19.235   1.649
    4    HA   MET   1           HA       MET   1   7.880 -18.204   0.696
    5   1HB   MET   1          2HB       MET   1   6.558 -19.555  -0.810
    6   2HB   MET   1          1HB       MET   1   5.122 -18.594  -0.484
    7   1HG   MET   1          2HG       MET   1   5.967 -17.965  -2.618
    8   2HG   MET   1          1HG       MET   1   6.272 -16.639  -1.497
    9   1HE   MET   1          1HE       MET   1   9.454 -19.580  -3.049
   10   2HE   MET   1          2HE       MET   1   7.952 -19.281  -3.925
   11   3HE   MET   1          3HE       MET   1   7.908 -20.034  -2.330
   12    H    GLN   2           H        GLN   2   8.280 -16.083   0.413
   13    HA   GLN   2           HA       GLN   2   6.335 -14.190   1.523
   14   1HB   GLN   2          2HB       GLN   2   8.561 -14.164   2.559
   15   2HB   GLN   2          1HB       GLN   2   9.296 -13.863   0.989
   16   1HG   GLN   2          2HG       GLN   2   8.144 -11.717   0.854
   17   2HG   GLN   2          1HG       GLN   2   7.398 -12.018   2.423
   18   1HE2  GLN   2          1HE2      GLN   2   8.334 -10.970   4.009
   19   2HE2  GLN   2          2HE2      GLN   2  10.012 -10.581   4.132
   20    H    TYR   3           H        TYR   3   5.572 -12.486   0.322
   21    HA   TYR   3           HA       TYR   3   6.450 -12.362  -2.486
   22   1HB   TYR   3          2HB       TYR   3   3.625 -12.181  -1.423
   23   2HB   TYR   3          1HB       TYR   3   4.085 -11.825  -3.087
   24    HD1  TYR   3           1HD      TYR   3   4.288 -13.546  -4.671
   25    HD2  TYR   3           2HD      TYR   3   4.026 -14.528  -0.539
   26    HE1  TYR   3           1HE      TYR   3   4.046 -15.922  -5.257
   27    HE2  TYR   3           2HE      TYR   3   3.785 -16.907  -1.114
   28    HH   TYR   3           HH       TYR   3   4.443 -18.132  -4.184
   29    H    LYS   4           H        LYS   4   6.629 -10.360  -3.412
   30    HA   LYS   4           HA       LYS   4   6.329  -8.084  -1.567
   31   1HB   LYS   4          2HB       LYS   4   8.639  -8.462  -2.238
   32   2HB   LYS   4          1HB       LYS   4   8.177  -8.432  -3.934
   33   1HG   LYS   4          2HG       LYS   4   7.497  -6.084  -3.693
   34   2HG   LYS   4          1HG       LYS   4   8.021  -6.122  -2.009
   35   1HD   LYS   4          2HD       LYS   4   9.782  -6.613  -4.412
   36   2HD   LYS   4          1HD       LYS   4   9.714  -5.117  -3.480
   37   1HE   LYS   4          2HE       LYS   4  10.501  -7.813  -2.380
   38   2HE   LYS   4          1HE       LYS   4  11.631  -6.552  -2.871
   39   1HZ   LYS   4          1HZ       LYS   4   9.558  -5.871  -0.916
   40   2HZ   LYS   4          2HZ       LYS   4  11.132  -5.274  -1.070
   41   3HZ   LYS   4          3HZ       LYS   4  10.870  -6.802  -0.393
   42    H    VAL   5           H        VAL   5   4.537  -6.969  -1.972
   43    HA   VAL   5           HA       VAL   5   3.491  -6.880  -4.695
   44    HB   VAL   5           HB       VAL   5   2.249  -5.840  -2.142
   45   1HG1  VAL   5          1HG1      VAL   5   1.588  -5.001  -4.580
   46   2HG1  VAL   5          2HG1      VAL   5   0.391  -5.250  -3.310
   47   3HG1  VAL   5          3HG1      VAL   5   0.637  -6.487  -4.541
   48   1HG2  VAL   5          1HG2      VAL   5   2.660  -8.464  -2.813
   49   2HG2  VAL   5          2HG2      VAL   5   1.033  -8.162  -3.423
   50   3HG2  VAL   5          3HG2      VAL   5   1.408  -7.868  -1.724
   51    H    ILE   6           H        ILE   6   3.765  -5.231  -5.980
   52    HA   ILE   6           HA       ILE   6   4.954  -2.771  -4.938
   53    HB   ILE   6           HB       ILE   6   4.693  -3.854  -7.739
   54   1HG1  ILE   6          2HG1      ILE   6   7.113  -3.138  -6.075
   55   2HG1  ILE   6          1HG1      ILE   6   6.476  -4.765  -6.263
   56   1HG2  ILE   6          1HG2      ILE   6   4.539  -1.682  -8.346
   57   2HG2  ILE   6          2HG2      ILE   6   6.282  -1.719  -8.080
   58   3HG2  ILE   6          3HG2      ILE   6   5.212  -1.096  -6.824
   59   1HD1  ILE   6          1HD1      ILE   6   8.048  -3.114  -8.125
   60   2HD1  ILE   6          2HD1      ILE   6   6.780  -4.110  -8.840
   61   3HD1  ILE   6          3HD1      ILE   6   8.051  -4.859  -7.870
   62    H    LEU   7           H        LEU   7   3.782  -1.034  -4.593
   63    HA   LEU   7           HA       LEU   7   1.089  -0.888  -5.747
   64   1HB   LEU   7          2HB       LEU   7   2.124   0.860  -3.533
   65   2HB   LEU   7          1HB       LEU   7   0.465   0.417  -3.899
   66    HG   LEU   7           HG       LEU   7   2.574  -1.365  -2.696
   67   1HD1  LEU   7          1HD1      LEU   7   1.602   0.266  -1.160
   68   2HD1  LEU   7          2HD1      LEU   7   1.109  -1.377  -0.758
   69   3HD1  LEU   7          3HD1      LEU   7  -0.015  -0.295  -1.583
   70   1HD2  LEU   7          1HD2      LEU   7   1.171  -2.609  -4.264
   71   2HD2  LEU   7          2HD2      LEU   7  -0.273  -2.013  -3.448
   72   3HD2  LEU   7          3HD2      LEU   7   0.847  -3.077  -2.596
   73    H    ASN   8           H        ASN   8   1.820  -0.140  -7.792
   74    HA   ASN   8           HA       ASN   8   3.171   2.434  -7.898
   75   1HB   ASN   8          2HB       ASN   8   2.394   0.440 -10.018
   76   2HB   ASN   8          1HB       ASN   8   3.047   2.023 -10.411
   77   1HD2  ASN   8          1HD2      ASN   8   4.524   1.284  -7.609
   78   2HD2  ASN   8          2HD2      ASN   8   5.932   0.495  -8.213
   79    H    GLY   9           H        GLY   9   1.897   4.165  -7.584
   80   1HA   GLY   9          2HA       GLY   9  -0.712   4.208  -8.971
   81   2HA   GLY   9          1HA       GLY   9  -0.362   5.103  -7.502
   82    H    LYS  10           H        LYS  10  -1.322   6.804  -9.002
   83    HA   LYS  10           HA       LYS  10   0.417   7.812 -11.056
   84   1HB   LYS  10          2HB       LYS  10  -2.020   9.056  -9.767
   85   2HB   LYS  10          1HB       LYS  10  -1.203   9.669 -11.199
   86   1HG   LYS  10          2HG       LYS  10  -1.753   7.600 -12.390
   87   2HG   LYS  10          1HG       LYS  10  -2.593   7.009 -10.956
   88   1HD   LYS  10          2HD       LYS  10  -3.303   9.489 -12.523
   89   2HD   LYS  10          1HD       LYS  10  -4.157   7.946 -12.591
   90   1HE   LYS  10          2HE       LYS  10  -4.705   8.148 -10.213
   91   2HE   LYS  10          1HE       LYS  10  -3.855   9.690 -10.148
   92   1HZ   LYS  10          1HZ       LYS  10  -6.171  10.117 -10.376
   93   2HZ   LYS  10          2HZ       LYS  10  -6.309   9.068 -11.697
   94   3HZ   LYS  10          3HZ       LYS  10  -5.440  10.510 -11.850
   95    H    THR  11           H        THR  11  -0.688   9.066  -7.908
   96    HA   THR  11           HA       THR  11   1.623  10.861  -7.845
   97    HB   THR  11           HB       THR  11   0.247  11.855  -5.896
   98    HG1  THR  11           1HG      THR  11  -2.004  11.420  -6.128
   99   1HG2  THR  11          1HG2      THR  11  -0.329  13.438  -7.325
  100   2HG2  THR  11          2HG2      THR  11  -1.503  12.375  -8.101
  101   3HG2  THR  11          3HG2      THR  11   0.177  12.373  -8.638
  102    H    LEU  12           H        LEU  12   0.900   7.853  -6.870
  103    HA   LEU  12           HA       LEU  12   2.621   8.086  -4.520
  104   1HB   LEU  12          2HB       LEU  12   0.339   7.994  -3.690
  105   2HB   LEU  12          1HB       LEU  12   0.028   6.554  -4.639
  106    HG   LEU  12           HG       LEU  12   1.472   5.241  -3.270
  107   1HD1  LEU  12          1HD1      LEU  12   2.289   6.866  -1.180
  108   2HD1  LEU  12          2HD1      LEU  12   2.601   7.817  -2.628
  109   3HD1  LEU  12          3HD1      LEU  12   3.301   6.211  -2.469
  110   1HD2  LEU  12          1HD2      LEU  12   0.289   6.669  -1.032
  111   2HD2  LEU  12          2HD2      LEU  12  -0.011   5.035  -1.622
  112   3HD2  LEU  12          3HD2      LEU  12  -0.845   6.404  -2.357
  113    H    LYS  13           H        LYS  13   4.068   6.479  -4.258
  114    HA   LYS  13           HA       LYS  13   3.842   4.039  -5.839
  115   1HB   LYS  13          2HB       LYS  13   6.233   5.885  -6.009
  116   2HB   LYS  13          1HB       LYS  13   6.145   4.274  -6.709
  117   1HG   LYS  13          2HG       LYS  13   4.327   5.001  -8.167
  118   2HG   LYS  13          1HG       LYS  13   4.408   6.616  -7.462
  119   1HD   LYS  13          2HD       LYS  13   6.707   6.851  -8.263
  120   2HD   LYS  13          1HD       LYS  13   6.632   5.231  -8.960
  121   1HE   LYS  13          2HE       LYS  13   6.270   6.940 -10.663
  122   2HE   LYS  13          1HE       LYS  13   4.832   5.944 -10.444
  123   1HZ   LYS  13          1HZ       LYS  13   4.952   8.346  -8.824
  124   2HZ   LYS  13          2HZ       LYS  13   3.650   7.671  -9.665
  125   3HZ   LYS  13          3HZ       LYS  13   4.795   8.604 -10.488
  126    H    GLY  14           H        GLY  14   4.974   2.281  -4.946
  127   1HA   GLY  14          2HA       GLY  14   6.914   2.566  -2.900
  128   2HA   GLY  14          1HA       GLY  14   5.335   2.299  -2.183
  129    H    GLU  15           H        GLU  15   6.855   0.463  -1.421
  130    HA   GLU  15           HA       GLU  15   6.185  -1.879  -3.044
  131   1HB   GLU  15          2HB       GLU  15   8.914  -1.361  -1.841
  132   2HB   GLU  15          1HB       GLU  15   8.403  -2.884  -2.553
  133   1HG   GLU  15          2HG       GLU  15   9.713  -1.772  -4.169
  134   2HG   GLU  15          1HG       GLU  15   8.038  -1.649  -4.701
  135    H    THR  16           H        THR  16   5.481  -3.577  -1.880
  136    HA   THR  16           HA       THR  16   5.863  -3.533   1.023
  137    HB   THR  16           HB       THR  16   3.724  -2.667   0.982
  138    HG1  THR  16           1HG      THR  16   3.177  -5.415   0.803
  139   1HG2  THR  16          1HG2      THR  16   3.315  -2.720  -1.406
  140   2HG2  THR  16          2HG2      THR  16   1.927  -3.340  -0.512
  141   3HG2  THR  16          3HG2      THR  16   3.022  -4.454  -1.325
  142    H    THR  17           H        THR  17   5.229  -5.664   2.046
  143    HA   THR  17           HA       THR  17   5.509  -7.924   0.213
  144    HB   THR  17           HB       THR  17   7.297  -8.903   1.631
  145    HG1  THR  17           1HG      THR  17   7.432  -6.313   2.769
  146   1HG2  THR  17          1HG2      THR  17   7.859  -7.633  -0.430
  147   2HG2  THR  17          2HG2      THR  17   9.125  -7.632   0.796
  148   3HG2  THR  17          3HG2      THR  17   8.107  -6.210   0.578
  149    H    THR  18           H        THR  18   4.021  -9.360   0.655
  150    HA   THR  18           HA       THR  18   3.031  -9.677   3.428
  151    HB   THR  18           HB       THR  18   1.336  -9.049   1.723
  152    HG1  THR  18           1HG      THR  18   0.795 -10.408   3.516
  153   1HG2  THR  18          1HG2      THR  18   0.604 -10.964   0.193
  154   2HG2  THR  18          2HG2      THR  18   2.250 -11.566   0.395
  155   3HG2  THR  18          3HG2      THR  18   1.976  -9.973  -0.306
  156    H    GLU  19           H        GLU  19   2.943 -11.767   4.322
  157    HA   GLU  19           HA       GLU  19   4.568 -13.773   2.895
  158   1HB   GLU  19          2HB       GLU  19   5.509 -13.018   5.033
  159   2HB   GLU  19          1HB       GLU  19   4.028 -13.483   5.859
  160   1HG   GLU  19          2HG       GLU  19   4.422 -15.814   5.275
  161   2HG   GLU  19          1HG       GLU  19   5.897 -15.356   4.424
  162    H    ALA  20           H        ALA  20   3.487 -15.450   2.060
  163    HA   ALA  20           HA       ALA  20   1.303 -16.639   3.569
  164   1HB   ALA  20          1HB       ALA  20   0.810 -15.933   0.697
  165   2HB   ALA  20          2HB       ALA  20   0.390 -14.836   2.013
  166   3HB   ALA  20          3HB       ALA  20  -0.347 -16.435   1.931
  167    H    VAL  21           H        VAL  21   0.775 -18.734   2.957
  168    HA   VAL  21           HA       VAL  21   2.828 -20.439   2.307
  169    HB   VAL  21           HB       VAL  21  -0.068 -21.024   1.699
  170   1HG1  VAL  21          1HG1      VAL  21   0.535 -23.328   2.190
  171   2HG1  VAL  21          2HG1      VAL  21   2.198 -22.838   2.516
  172   3HG1  VAL  21          3HG1      VAL  21   1.537 -22.686   0.888
  173   1HG2  VAL  21          1HG2      VAL  21  -0.181 -20.245   3.884
  174   2HG2  VAL  21          2HG2      VAL  21   1.402 -20.897   4.304
  175   3HG2  VAL  21          3HG2      VAL  21   0.030 -21.984   4.092
  176    H    ASP  22           H        ASP  22   0.741 -18.701   0.133
  177    HA   ASP  22           HA       ASP  22   2.410 -19.493  -2.097
  178   1HB   ASP  22          2HB       ASP  22   0.413 -20.129  -3.511
  179   2HB   ASP  22          1HB       ASP  22   0.863 -21.288  -2.264
  180    H    ALA  23           H        ALA  23   1.506 -18.427  -4.202
  181    HA   ALA  23           HA       ALA  23   1.574 -15.666  -3.816
  182   1HB   ALA  23          1HB       ALA  23   0.330 -16.246  -6.317
  183   2HB   ALA  23          2HB       ALA  23   1.589 -17.441  -6.009
  184   3HB   ALA  23          3HB       ALA  23   1.983 -15.723  -5.997
  185    H    ALA  24           H        ALA  24  -1.170 -17.817  -4.403
  186    HA   ALA  24           HA       ALA  24  -3.129 -15.803  -4.614
  187   1HB   ALA  24          1HB       ALA  24  -3.944 -17.824  -5.334
  188   2HB   ALA  24          2HB       ALA  24  -4.627 -17.783  -3.709
  189   3HB   ALA  24          3HB       ALA  24  -3.172 -18.727  -4.032
  190    H    THR  25           H        THR  25  -2.226 -17.835  -1.812
  191    HA   THR  25           HA       THR  25  -3.843 -16.620   0.075
  192    HB   THR  25           HB       THR  25  -2.080 -17.348   1.728
  193    HG1  THR  25           1HG      THR  25  -0.679 -17.693  -0.630
  194   1HG2  THR  25          1HG2      THR  25  -3.013 -19.344  -0.304
  195   2HG2  THR  25          2HG2      THR  25  -3.761 -18.942   1.243
  196   3HG2  THR  25          3HG2      THR  25  -2.207 -19.776   1.205
  197    H    ALA  26           H        ALA  26  -0.582 -15.749  -1.012
  198    HA   ALA  26           HA       ALA  26  -0.216 -13.543   0.695
  199   1HB   ALA  26          1HB       ALA  26   1.279 -14.787  -1.262
  200   2HB   ALA  26          2HB       ALA  26   1.739 -13.328  -0.383
  201   3HB   ALA  26          3HB       ALA  26   0.950 -13.199  -1.956
  202    H    GLU  27           H        GLU  27  -1.366 -13.717  -2.680
  203    HA   GLU  27           HA       GLU  27  -1.992 -11.092  -3.127
  204   1HB   GLU  27          2HB       GLU  27  -2.111 -12.893  -4.807
  205   2HB   GLU  27          1HB       GLU  27  -3.552 -13.519  -4.021
  206   1HG   GLU  27          2HG       GLU  27  -4.216 -12.278  -5.941
  207   2HG   GLU  27          1HG       GLU  27  -4.687 -11.372  -4.504
  208    H    LYS  28           H        LYS  28  -4.106 -13.593  -1.727
  209    HA   LYS  28           HA       LYS  28  -6.362 -12.008  -1.326
  210   1HB   LYS  28          2HB       LYS  28  -5.372 -14.364   0.287
  211   2HB   LYS  28          1HB       LYS  28  -6.985 -13.675   0.413
  212   1HG   LYS  28          2HG       LYS  28  -5.779 -14.973  -2.020
  213   2HG   LYS  28          1HG       LYS  28  -7.028 -15.648  -0.974
  214   1HD   LYS  28          2HD       LYS  28  -8.526 -13.809  -1.588
  215   2HD   LYS  28          1HD       LYS  28  -7.277 -13.145  -2.640
  216   1HE   LYS  28          2HE       LYS  28  -8.595 -15.842  -2.934
  217   2HE   LYS  28          1HE       LYS  28  -8.925 -14.416  -3.918
  218   1HZ   LYS  28          1HZ       LYS  28  -7.401 -15.357  -5.254
  219   2HZ   LYS  28          2HZ       LYS  28  -6.683 -16.259  -4.016
  220   3HZ   LYS  28          3HZ       LYS  28  -6.289 -14.625  -4.211
  221    H    VAL  29           H        VAL  29  -3.515 -12.477   0.694
  222    HA   VAL  29           HA       VAL  29  -4.408 -11.193   3.004
  223    HB   VAL  29           HB       VAL  29  -1.608 -11.283   1.868
  224   1HG1  VAL  29          1HG1      VAL  29  -1.071 -11.057   4.399
  225   2HG1  VAL  29          2HG1      VAL  29  -2.681 -10.339   4.490
  226   3HG1  VAL  29          3HG1      VAL  29  -1.449  -9.616   3.454
  227   1HG2  VAL  29          1HG2      VAL  29  -1.389 -13.359   2.678
  228   2HG2  VAL  29          2HG2      VAL  29  -3.152 -13.384   2.688
  229   3HG2  VAL  29          3HG2      VAL  29  -2.269 -12.975   4.158
  230    H    VAL  30           H        VAL  30  -2.980  -9.883   0.061
  231    HA   VAL  30           HA       VAL  30  -2.691  -7.228   0.986
  232    HB   VAL  30           HB       VAL  30  -3.204  -8.142  -1.849
  233   1HG1  VAL  30          1HG1      VAL  30  -3.382  -5.660  -1.203
  234   2HG1  VAL  30          2HG1      VAL  30  -2.358  -6.095  -2.573
  235   3HG1  VAL  30          3HG1      VAL  30  -1.631  -5.736  -1.007
  236   1HG2  VAL  30          1HG2      VAL  30  -0.699  -8.056  -2.032
  237   2HG2  VAL  30          2HG2      VAL  30  -1.334  -9.375  -1.050
  238   3HG2  VAL  30          3HG2      VAL  30  -0.646  -7.949  -0.272
  239    H    LYS  31           H        LYS  31  -5.294  -8.870  -0.840
  240    HA   LYS  31           HA       LYS  31  -7.042  -6.808  -1.247
  241   1HB   LYS  31          2HB       LYS  31  -7.516  -9.701  -0.610
  242   2HB   LYS  31          1HB       LYS  31  -8.876  -8.602  -0.799
  243   1HG   LYS  31          2HG       LYS  31  -8.459  -9.758  -2.867
  244   2HG   LYS  31          1HG       LYS  31  -8.088  -8.045  -3.058
  245   1HD   LYS  31          2HD       LYS  31  -5.692  -8.576  -2.695
  246   2HD   LYS  31          1HD       LYS  31  -6.119 -10.288  -2.651
  247   1HE   LYS  31          2HE       LYS  31  -6.620  -8.430  -4.971
  248   2HE   LYS  31          1HE       LYS  31  -5.282  -9.570  -4.858
  249   1HZ   LYS  31          1HZ       LYS  31  -7.782 -10.851  -4.389
  250   2HZ   LYS  31          2HZ       LYS  31  -6.592 -11.214  -5.533
  251   3HZ   LYS  31          3HZ       LYS  31  -7.778 -10.063  -5.887
  252    H    GLN  32           H        GLN  32  -6.596  -8.681   1.705
  253    HA   GLN  32           HA       GLN  32  -8.649  -7.287   3.150
  254   1HB   GLN  32          2HB       GLN  32  -7.913  -9.568   3.783
  255   2HB   GLN  32          1HB       GLN  32  -6.330  -8.928   4.200
  256   1HG   GLN  32          2HG       GLN  32  -7.591  -9.252   6.202
  257   2HG   GLN  32          1HG       GLN  32  -7.377  -7.526   5.930
  258   1HE2  GLN  32          1HE2      GLN  32  -9.663  -8.783   3.789
  259   2HE2  GLN  32          2HE2      GLN  32 -11.083  -8.347   4.664
  260    H    PHE  33           H        PHE  33  -5.201  -6.992   2.723
  261    HA   PHE  33           HA       PHE  33  -4.562  -5.146   4.692
  262   1HB   PHE  33          2HB       PHE  33  -2.986  -6.382   3.156
  263   2HB   PHE  33          1HB       PHE  33  -3.404  -5.223   1.898
  264    HD1  PHE  33           1HD      PHE  33  -2.051  -5.448   5.340
  265    HD2  PHE  33           2HD      PHE  33  -2.185  -3.239   1.692
  266    HE1  PHE  33           1HE      PHE  33  -0.297  -3.943   6.180
  267    HE2  PHE  33           2HE      PHE  33  -0.428  -1.740   2.542
  268    HZ   PHE  33           HZ       PHE  33   0.512  -2.100   4.792
  269    H    PHE  34           H        PHE  34  -5.369  -4.478   1.300
  270    HA   PHE  34           HA       PHE  34  -5.603  -1.657   1.734
  271   1HB   PHE  34          2HB       PHE  34  -6.377  -3.362  -0.631
  272   2HB   PHE  34          1HB       PHE  34  -6.415  -1.596  -0.610
  273    HD1  PHE  34           1HD      PHE  34  -4.026  -0.919   0.872
  274    HD2  PHE  34           2HD      PHE  34  -4.631  -3.936  -2.066
  275    HE1  PHE  34           1HE      PHE  34  -1.633  -0.867   0.336
  276    HE2  PHE  34           2HE      PHE  34  -2.231  -3.881  -2.612
  277    HZ   PHE  34           HZ       PHE  34  -0.739  -2.349  -1.397
  278    H    ASN  35           H        ASN  35  -7.920  -4.296   1.404
  279    HA   ASN  35           HA       ASN  35 -10.287  -2.890   1.263
  280   1HB   ASN  35          2HB       ASN  35 -10.247  -5.311   1.157
  281   2HB   ASN  35          1HB       ASN  35  -9.664  -5.411   2.817
  282   1HD2  ASN  35          1HD2      ASN  35 -12.265  -5.828   0.971
  283   2HD2  ASN  35          2HD2      ASN  35 -13.521  -5.522   2.115
  284    H    ASP  36           H        ASP  36  -8.240  -3.528   4.008
  285    HA   ASP  36           HA       ASP  36 -10.030  -2.090   5.809
  286   1HB   ASP  36          2HB       ASP  36  -7.481  -3.615   6.382
  287   2HB   ASP  36          1HB       ASP  36  -8.494  -2.851   7.603
  288    H    ASN  37           H        ASN  37  -7.069  -1.525   4.063
  289    HA   ASN  37           HA       ASN  37  -6.258   0.653   5.787
  290   1HB   ASN  37          2HB       ASN  37  -5.288  -0.227   3.061
  291   2HB   ASN  37          1HB       ASN  37  -4.643   1.174   3.907
  292   1HD2  ASN  37          1HD2      ASN  37  -3.580  -1.558   3.074
  293   2HD2  ASN  37          2HD2      ASN  37  -2.812  -2.146   4.506
  294    H    GLY  38           H        GLY  38  -7.683   0.258   2.592
  295   1HA   GLY  38          2HA       GLY  38  -8.131   2.264   1.219
  296   2HA   GLY  38          1HA       GLY  38  -9.575   1.617   1.958
  297    H    VAL  39           H        VAL  39 -10.852   3.098   2.715
  298    HA   VAL  39           HA       VAL  39  -9.709   5.677   3.565
  299    HB   VAL  39           HB       VAL  39 -12.518   5.078   2.697
  300   1HG1  VAL  39          1HG1      VAL  39 -12.829   7.073   3.706
  301   2HG1  VAL  39          2HG1      VAL  39 -12.141   7.709   2.212
  302   3HG1  VAL  39          3HG1      VAL  39 -11.118   7.496   3.634
  303   1HG2  VAL  39          1HG2      VAL  39 -11.681   4.894   0.636
  304   2HG2  VAL  39          2HG2      VAL  39 -10.090   5.452   1.148
  305   3HG2  VAL  39          3HG2      VAL  39 -11.341   6.622   0.728
  306    H    ASP  40           H        ASP  40 -10.824   2.987   5.133
  307    HA   ASP  40           HA       ASP  40 -12.002   4.648   7.255
  308   1HB   ASP  40          2HB       ASP  40 -12.805   1.839   6.477
  309   2HB   ASP  40          1HB       ASP  40 -13.431   2.726   7.863
  310    H    GLY  41           H        GLY  41  -9.241   3.277   6.607
  311   1HA   GLY  41          2HA       GLY  41  -8.927   1.513   8.876
  312   2HA   GLY  41          1HA       GLY  41  -7.670   2.005   7.753
  313    H    GLU  42           H        GLU  42  -6.844   1.884  10.217
  314    HA   GLU  42           HA       GLU  42  -7.108   4.525  11.462
  315   1HB   GLU  42          2HB       GLU  42  -5.761   2.012  12.477
  316   2HB   GLU  42          1HB       GLU  42  -5.936   3.511  13.379
  317   1HG   GLU  42          2HG       GLU  42  -8.362   3.269  13.329
  318   2HG   GLU  42          1HG       GLU  42  -8.194   1.772  12.412
  319    H    TRP  43           H        TRP  43  -5.804   5.918  10.387
  320    HA   TRP  43           HA       TRP  43  -3.094   5.080   9.686
  321   1HB   TRP  43          2HB       TRP  43  -4.644   7.566   8.964
  322   2HB   TRP  43          1HB       TRP  43  -3.025   7.186   8.397
  323    HD1  TRP  43           HD       TRP  43  -5.532   4.321   8.470
  324    HE1  TRP  43           1HE      TRP  43  -6.169   3.727   6.044
  325    HE3  TRP  43           3HE      TRP  43  -3.308   8.234   6.070
  326    HZ2  TRP  43           2HZ      TRP  43  -5.778   4.783   3.457
  327    HZ3  TRP  43           3HZ      TRP  43  -3.480   8.378   3.627
  328    HH2  TRP  43           HH       TRP  43  -4.690   6.685   2.342
  329    H    THR  44           H        THR  44  -1.433   5.554  10.952
  330    HA   THR  44           HA       THR  44  -1.673   7.778  12.858
  331    HB   THR  44           HB       THR  44   0.224   6.710  14.034
  332    HG1  THR  44           1HG      THR  44  -0.068   4.657  12.101
  333   1HG2  THR  44          1HG2      THR  44  -0.884   4.596  14.727
  334   2HG2  THR  44          2HG2      THR  44  -2.100   4.888  13.485
  335   3HG2  THR  44          3HG2      THR  44  -1.914   6.025  14.821
  336    H    TYR  45           H        TYR  45  -0.344   9.529  12.700
  337    HA   TYR  45           HA       TYR  45   1.555   9.529  10.456
  338   1HB   TYR  45          2HB       TYR  45  -0.242  11.180  10.285
  339   2HB   TYR  45          1HB       TYR  45   0.200  11.845  11.851
  340    HD1  TYR  45           1HD      TYR  45   2.537  10.808   9.164
  341    HD2  TYR  45           2HD      TYR  45   0.752  14.057  11.249
  342    HE1  TYR  45           1HE      TYR  45   4.090  12.363   8.060
  343    HE2  TYR  45           2HE      TYR  45   2.298  15.620  10.151
  344    HH   TYR  45           HH       TYR  45   3.671  15.730   8.118
  345    H    ASP  46           H        ASP  46   3.660  10.118  10.705
  346    HA   ASP  46           HA       ASP  46   4.562  10.726  13.443
  347   1HB   ASP  46          2HB       ASP  46   5.156   8.419  12.835
  348   2HB   ASP  46          1HB       ASP  46   5.971   9.005  11.388
  349    H    ASP  47           H        ASP  47   4.430  12.956  12.829
  350    HA   ASP  47           HA       ASP  47   5.573  14.225  10.691
  351   1HB   ASP  47          2HB       ASP  47   5.547  15.195  13.556
  352   2HB   ASP  47          1HB       ASP  47   5.799  16.211  12.139
  353    H    ALA  48           H        ALA  48   7.193  12.998  13.556
  354    HA   ALA  48           HA       ALA  48   9.641  14.220  13.419
  355   1HB   ALA  48          1HB       ALA  48   8.664  11.639  14.441
  356   2HB   ALA  48          2HB       ALA  48   9.611  12.896  15.238
  357   3HB   ALA  48          3HB       ALA  48  10.403  11.743  14.162
  358    H    THR  49           H        THR  49   8.405  11.694  11.320
  359    HA   THR  49           HA       THR  49  10.909  11.872   9.778
  360    HB   THR  49           HB       THR  49  10.610   9.501   9.143
  361    HG1  THR  49           1HG      THR  49   9.060   8.274  10.131
  362   1HG2  THR  49          1HG2      THR  49  10.832   8.560  11.588
  363   2HG2  THR  49          2HG2      THR  49  11.006  10.271  11.978
  364   3HG2  THR  49          3HG2      THR  49  12.118   9.507  10.842
  365    H    LYS  50           H        LYS  50   8.006  13.021   9.630
  366    HA   LYS  50           HA       LYS  50   6.449  13.498   8.011
  367   1HB   LYS  50          2HB       LYS  50   8.835  13.104   6.191
  368   2HB   LYS  50          1HB       LYS  50   7.387  14.028   5.821
  369   1HG   LYS  50          2HG       LYS  50   9.268  14.700   8.069
  370   2HG   LYS  50          1HG       LYS  50   9.374  15.395   6.451
  371   1HD   LYS  50          2HD       LYS  50   6.893  15.547   8.152
  372   2HD   LYS  50          1HD       LYS  50   8.150  16.786   8.164
  373   1HE   LYS  50          2HE       LYS  50   7.821  17.167   5.786
  374   2HE   LYS  50          1HE       LYS  50   6.607  15.890   5.730
  375   1HZ   LYS  50          1HZ       LYS  50   5.976  18.425   6.015
  376   2HZ   LYS  50          2HZ       LYS  50   6.186  18.048   7.650
  377   3HZ   LYS  50          3HZ       LYS  50   5.061  17.191   6.724
  378    H    THR  51           H        THR  51   6.518  10.782   8.787
  379    HA   THR  51           HA       THR  51   5.816   9.433   6.265
  380    HB   THR  51           HB       THR  51   7.007   8.269   8.787
  381    HG1  THR  51           1HG      THR  51   8.544   9.252   7.496
  382   1HG2  THR  51          1HG2      THR  51   6.560   6.198   8.141
  383   2HG2  THR  51          2HG2      THR  51   6.959   6.547   6.458
  384   3HG2  THR  51          3HG2      THR  51   5.349   6.911   7.075
  385    H    PHE  52           H        PHE  52   3.909   8.290   6.168
  386    HA   PHE  52           HA       PHE  52   2.132   8.616   8.492
  387   1HB   PHE  52          2HB       PHE  52   1.420   8.260   5.583
  388   2HB   PHE  52          1HB       PHE  52   0.267   8.388   6.906
  389    HD1  PHE  52           1HD      PHE  52  -0.032  10.509   8.092
  390    HD2  PHE  52           2HD      PHE  52   2.526  10.185   4.707
  391    HE1  PHE  52           1HE      PHE  52  -0.036  12.958   7.861
  392    HE2  PHE  52           2HE      PHE  52   2.529  12.635   4.470
  393    HZ   PHE  52           HZ       PHE  52   1.245  14.023   6.048
  394    H    THR  53           H        THR  53   2.524   6.819   9.595
  395    HA   THR  53           HA       THR  53   2.573   4.209   8.395
  396    HB   THR  53           HB       THR  53   2.368   3.471  10.887
  397    HG1  THR  53           1HG      THR  53   3.278   6.109  11.286
  398   1HG2  THR  53          1HG2      THR  53   4.419   3.064   9.927
  399   2HG2  THR  53          2HG2      THR  53   4.812   4.148  11.268
  400   3HG2  THR  53          3HG2      THR  53   4.731   4.777   9.622
  401    H    VAL  54           H        VAL  54   1.020   2.823   8.060
  402    HA   VAL  54           HA       VAL  54  -1.635   3.338   9.230
  403    HB   VAL  54           HB       VAL  54  -1.070   2.214   6.474
  404   1HG1  VAL  54          1HG1      VAL  54  -3.085   1.270   6.860
  405   2HG1  VAL  54          2HG1      VAL  54  -3.680   2.880   6.456
  406   3HG1  VAL  54          3HG1      VAL  54  -3.494   2.408   8.145
  407   1HG2  VAL  54          1HG2      VAL  54  -0.863   4.822   7.166
  408   2HG2  VAL  54          2HG2      VAL  54  -2.574   4.726   6.753
  409   3HG2  VAL  54          3HG2      VAL  54  -1.354   4.256   5.570
  410    H    THR  55           H        THR  55  -2.438   1.667  10.376
  411    HA   THR  55           HA       THR  55  -1.134  -0.942  10.003
  412    HB   THR  55           HB       THR  55  -2.419  -0.030  12.567
  413    HG1  THR  55           1HG      THR  55   0.271   0.246  11.710
  414   1HG2  THR  55          1HG2      THR  55  -1.057  -1.711  13.602
  415   2HG2  THR  55          2HG2      THR  55  -0.284  -2.086  12.061
  416   3HG2  THR  55          3HG2      THR  55  -1.994  -2.448  12.302
  417    H    GLU  56           H        GLU  56  -2.335  -2.553   9.325
  418    HA   GLU  56           HA       GLU  56  -5.060  -2.295   8.723
  419   1HB   GLU  56          2HB       GLU  56  -3.606  -3.872   7.559
  420   2HB   GLU  56          1HB       GLU  56  -3.380  -4.791   9.041
  421   1HG   GLU  56          2HG       GLU  56  -5.778  -5.326   9.055
  422   2HG   GLU  56          1HG       GLU  56  -5.966  -4.447   7.540
  423   1H    MET   1          1HT       MET   1   6.839  18.378  -2.562
  424   2H    MET   1          2HT       MET   1   7.369  19.730  -1.695
  425   3H    MET   1          3HT       MET   1   5.793  19.153  -1.482
  426    HA   MET   1           HA       MET   1   8.329  18.061  -0.492
  427   1HB   MET   1          2HB       MET   1   7.018  19.442   0.995
  428   2HB   MET   1          1HB       MET   1   5.566  18.515   0.650
  429   1HG   MET   1          2HG       MET   1   6.364  17.868   2.793
  430   2HG   MET   1          1HG       MET   1   6.653  16.535   1.677
  431   1HE   MET   1          1HE       MET   1   9.883  19.398   3.275
  432   2HE   MET   1          2HE       MET   1   8.362  19.136   4.129
  433   3HE   MET   1          3HE       MET   1   8.359  19.890   2.534
  434    H    GLN   2           H        GLN   2   8.674  15.930  -0.204
  435    HA   GLN   2           HA       GLN   2   6.698  14.084  -1.341
  436   1HB   GLN   2          2HB       GLN   2   8.938  14.002  -2.345
  437   2HB   GLN   2          1HB       GLN   2   9.644  13.685  -0.767
  438   1HG   GLN   2          2HG       GLN   2   8.437  11.568  -0.648
  439   2HG   GLN   2          1HG       GLN   2   7.721  11.887  -2.227
  440   1HE2  GLN   2          1HE2      GLN   2   8.653  10.818  -3.800
  441   2HE2  GLN   2          2HE2      GLN   2  10.323  10.386  -3.900
  442    H    TYR   3           H        TYR   3   5.877  12.399  -0.152
  443    HA   TYR   3           HA       TYR   3   6.713  12.254   2.668
  444   1HB   TYR   3          2HB       TYR   3   3.900  12.142   1.566
  445   2HB   TYR   3          1HB       TYR   3   4.327  11.775   3.234
  446    HD1  TYR   3           1HD      TYR   3   4.550  13.492   4.822
  447    HD2  TYR   3           2HD      TYR   3   4.371  14.479   0.688
  448    HE1  TYR   3           1HE      TYR   3   4.358  15.872   5.406
  449    HE2  TYR   3           2HE      TYR   3   4.179  16.864   1.260
  450    HH   TYR   3           HH       TYR   3   4.823  18.072   4.337
  451    H    LYS   4           H        LYS   4   6.828  10.250   3.597
  452    HA   LYS   4           HA       LYS   4   6.501   7.981   1.747
  453   1HB   LYS   4          2HB       LYS   4   8.808   8.302   2.451
  454   2HB   LYS   4          1HB       LYS   4   8.323   8.285   4.142
  455   1HG   LYS   4          2HG       LYS   4   7.589   5.954   3.888
  456   2HG   LYS   4          1HG       LYS   4   8.139   5.979   2.213
  457   1HD   LYS   4          2HD       LYS   4   9.876   6.428   4.641
  458   2HD   LYS   4          1HD       LYS   4   9.785   4.933   3.707
  459   1HE   LYS   4          2HE       LYS   4  10.654   7.609   2.619
  460   2HE   LYS   4          1HE       LYS   4  11.745   6.322   3.125
  461   1HZ   LYS   4          1HZ       LYS   4   9.684   5.689   1.141
  462   2HZ   LYS   4          2HZ       LYS   4  11.241   5.056   1.318
  463   3HZ   LYS   4          3HZ       LYS   4  11.026   6.588   0.637
  464    H    VAL   5           H        VAL   5   4.677   6.909   2.127
  465    HA   VAL   5           HA       VAL   5   3.589   6.846   4.833
  466    HB   VAL   5           HB       VAL   5   2.359   5.837   2.264
  467   1HG1  VAL   5          1HG1      VAL   5   1.644   5.015   4.694
  468   2HG1  VAL   5          2HG1      VAL   5   0.472   5.293   3.405
  469   3HG1  VAL   5          3HG1      VAL   5   0.731   6.523   4.641
  470   1HG2  VAL   5          1HG2      VAL   5   2.826   8.451   2.942
  471   2HG2  VAL   5          2HG2      VAL   5   1.182   8.187   3.528
  472   3HG2  VAL   5          3HG2      VAL   5   1.574   7.884   1.835
  473    H    ILE   6           H        ILE   6   3.806   5.191   6.122
  474    HA   ILE   6           HA       ILE   6   4.949   2.703   5.098
  475    HB   ILE   6           HB       ILE   6   4.676   3.792   7.894
  476   1HG1  ILE   6          2HG1      ILE   6   7.101   3.018   6.265
  477   2HG1  ILE   6          1HG1      ILE   6   6.500   4.660   6.444
  478   1HG2  ILE   6          1HG2      ILE   6   4.461   1.625   8.499
  479   2HG2  ILE   6          2HG2      ILE   6   6.208   1.620   8.258
  480   3HG2  ILE   6          3HG2      ILE   6   5.141   1.023   6.986
  481   1HD1  ILE   6          1HD1      ILE   6   8.005   2.971   8.328
  482   2HD1  ILE   6          2HD1      ILE   6   6.754   3.999   9.024
  483   3HD1  ILE   6          3HD1      ILE   6   8.054   4.716   8.073
  484    H    LEU   7           H        LEU   7   3.742   0.995   4.736
  485    HA   LEU   7           HA       LEU   7   1.029   0.914   5.851
  486   1HB   LEU   7          2HB       LEU   7   2.052  -0.857   3.651
  487   2HB   LEU   7          1HB       LEU   7   0.399  -0.376   3.993
  488    HG   LEU   7           HG       LEU   7   2.568   1.355   2.822
  489   1HD1  LEU   7          1HD1      LEU   7   1.578  -0.253   1.271
  490   2HD1  LEU   7          2HD1      LEU   7   1.131   1.403   0.864
  491   3HD1  LEU   7          3HD1      LEU   7  -0.029   0.348   1.672
  492   1HD2  LEU   7          1HD2      LEU   7   1.173   2.633   4.371
  493   2HD2  LEU   7          2HD2      LEU   7  -0.273   2.072   3.534
  494   3HD2  LEU   7          3HD2      LEU   7   0.885   3.109   2.697
  495    H    ASN   8           H        ASN   8   1.713   0.149   7.905
  496    HA   ASN   8           HA       ASN   8   2.999  -2.457   8.031
  497   1HB   ASN   8          2HB       ASN   8   2.241  -0.443  10.139
  498   2HB   ASN   8          1HB       ASN   8   2.849  -2.043  10.541
  499   1HD2  ASN   8          1HD2      ASN   8   4.384  -1.340   7.761
  500   2HD2  ASN   8          2HD2      ASN   8   5.801  -0.586   8.385
  501    H    GLY   9           H        GLY   9   1.688  -4.155   7.698
  502   1HA   GLY   9          2HA       GLY   9  -0.940  -4.134   9.048
  503   2HA   GLY   9          1HA       GLY   9  -0.593  -5.040   7.584
  504    H    LYS  10           H        LYS  10  -1.613  -6.716   9.071
  505    HA   LYS  10           HA       LYS  10   0.070  -7.765  11.150
  506   1HB   LYS  10          2HB       LYS  10  -2.376  -8.950   9.826
  507   2HB   LYS  10          1HB       LYS  10  -1.595  -9.582  11.269
  508   1HG   LYS  10          2HG       LYS  10  -2.113  -7.502  12.453
  509   2HG   LYS  10          1HG       LYS  10  -2.917  -6.889  11.006
  510   1HD   LYS  10          2HD       LYS  10  -3.710  -9.350  12.562
  511   2HD   LYS  10          1HD       LYS  10  -4.525  -7.787  12.619
  512   1HE   LYS  10          2HE       LYS  10  -5.045  -7.977  10.233
  513   2HE   LYS  10          1HE       LYS  10  -4.233  -9.540  10.180
  514   1HZ   LYS  10          1HZ       LYS  10  -6.561  -9.909  10.376
  515   2HZ   LYS  10          2HZ       LYS  10  -6.692  -8.857  11.693
  516   3HZ   LYS  10          3HZ       LYS  10  -5.860 -10.320  11.861
  517    H    THR  11           H        THR  11  -1.019  -8.993   7.985
  518    HA   THR  11           HA       THR  11   1.248 -10.843   7.954
  519    HB   THR  11           HB       THR  11  -0.125 -11.803   5.987
  520    HG1  THR  11           1HG      THR  11  -2.367 -11.315   6.187
  521   1HG2  THR  11          1HG2      THR  11  -0.759 -13.372   7.407
  522   2HG2  THR  11          2HG2      THR  11  -1.917 -12.279   8.165
  523   3HG2  THR  11          3HG2      THR  11  -0.245 -12.320   8.727
  524    H    LEU  12           H        LEU  12   0.612  -7.819   6.971
  525    HA   LEU  12           HA       LEU  12   2.360  -8.093   4.645
  526   1HB   LEU  12          2HB       LEU  12   0.093  -7.947   3.783
  527   2HB   LEU  12          1HB       LEU  12  -0.197  -6.500   4.727
  528    HG   LEU  12           HG       LEU  12   1.298  -5.222   3.379
  529   1HD1  LEU  12          1HD1      LEU  12   2.105  -6.866   1.300
  530   2HD1  LEU  12          2HD1      LEU  12   2.372  -7.825   2.752
  531   3HD1  LEU  12          3HD1      LEU  12   3.114  -6.237   2.604
  532   1HD2  LEU  12          1HD2      LEU  12   0.111  -6.622   1.125
  533   2HD2  LEU  12          2HD2      LEU  12  -0.157  -4.981   1.709
  534   3HD2  LEU  12          3HD2      LEU  12  -1.034  -6.330   2.433
  535    H    LYS  13           H        LYS  13   3.849  -6.523   4.403
  536    HA   LYS  13           HA       LYS  13   3.660  -4.076   5.981
  537   1HB   LYS  13          2HB       LYS  13   6.003  -5.981   6.185
  538   2HB   LYS  13          1HB       LYS  13   5.944  -4.368   6.883
  539   1HG   LYS  13          2HG       LYS  13   4.088  -5.051   8.315
  540   2HG   LYS  13          1HG       LYS  13   4.141  -6.668   7.612
  541   1HD   LYS  13          2HD       LYS  13   6.422  -6.957   8.446
  542   2HD   LYS  13          1HD       LYS  13   6.377  -5.336   9.141
  543   1HE   LYS  13          2HE       LYS  13   5.948  -7.035  10.839
  544   2HE   LYS  13          1HE       LYS  13   4.539  -6.004  10.600
  545   1HZ   LYS  13          1HZ       LYS  13   4.623  -8.410   8.980
  546   2HZ   LYS  13          2HZ       LYS  13   3.325  -7.703   9.803
  547   3HZ   LYS  13          3HZ       LYS  13   4.436  -8.664  10.643
  548    H    GLY  14           H        GLY  14   4.847  -2.347   5.104
  549   1HA   GLY  14          2HA       GLY  14   6.808  -2.678   3.086
  550   2HA   GLY  14          1HA       GLY  14   5.245  -2.373   2.348
  551    H    GLU  15           H        GLU  15   6.821  -0.576   1.608
  552    HA   GLU  15           HA       GLU  15   6.186   1.781   3.220
  553   1HB   GLU  15          2HB       GLU  15   8.918   1.196   2.056
  554   2HB   GLU  15          1HB       GLU  15   8.435   2.731   2.761
  555   1HG   GLU  15          2HG       GLU  15   9.693   1.589   4.395
  556   2HG   GLU  15          1HG       GLU  15   8.008   1.506   4.904
  557    H    THR  16           H        THR  16   5.540   3.497   2.048
  558    HA   THR  16           HA       THR  16   5.961   3.442  -0.850
  559    HB   THR  16           HB       THR  16   3.801   2.629  -0.839
  560    HG1  THR  16           1HG      THR  16   3.319   5.390  -0.667
  561   1HG2  THR  16          1HG2      THR  16   3.359   2.692   1.543
  562   2HG2  THR  16          2HG2      THR  16   2.000   3.346   0.630
  563   3HG2  THR  16          3HG2      THR  16   3.111   4.433   1.458
  564    H    THR  17           H        THR  17   5.393   5.588  -1.882
  565    HA   THR  17           HA       THR  17   5.701   7.841  -0.046
  566    HB   THR  17           HB       THR  17   7.534   8.777  -1.438
  567    HG1  THR  17           1HG      THR  17   7.620   6.184  -2.574
  568   1HG2  THR  17          1HG2      THR  17   8.035   7.493   0.632
  569   2HG2  THR  17          2HG2      THR  17   9.318   7.461  -0.577
  570   3HG2  THR  17          3HG2      THR  17   8.263   6.063  -0.373
  571    H    THR  18           H        THR  18   4.256   9.310  -0.508
  572    HA   THR  18           HA       THR  18   3.314   9.651  -3.294
  573    HB   THR  18           HB       THR  18   1.579   9.066  -1.612
  574    HG1  THR  18           1HG      THR  18   1.097  10.438  -3.412
  575   1HG2  THR  18          1HG2      THR  18   0.873  11.000  -0.095
  576   2HG2  THR  18          2HG2      THR  18   2.536  11.561  -0.273
  577   3HG2  THR  18          3HG2      THR  18   2.212   9.975   0.425
  578    H    GLU  19           H        GLU  19   3.289  11.745  -4.188
  579    HA   GLU  19           HA       GLU  19   4.942  13.710  -2.739
  580   1HB   GLU  19          2HB       GLU  19   5.894  12.933  -4.863
  581   2HB   GLU  19          1HB       GLU  19   4.436  13.432  -5.709
  582   1HG   GLU  19          2HG       GLU  19   4.878  15.753  -5.119
  583   2HG   GLU  19          1HG       GLU  19   6.330  15.260  -4.247
  584    H    ALA  20           H        ALA  20   3.890  15.412  -1.917
  585    HA   ALA  20           HA       ALA  20   1.759  16.654  -3.458
  586   1HB   ALA  20          1HB       ALA  20   1.205  15.962  -0.593
  587   2HB   ALA  20          2HB       ALA  20   0.779  14.874  -1.916
  588   3HB   ALA  20          3HB       ALA  20   0.079  16.490  -1.843
  589    H    VAL  21           H        VAL  21   1.273  18.761  -2.854
  590    HA   VAL  21           HA       VAL  21   3.356  20.416  -2.172
  591    HB   VAL  21           HB       VAL  21   0.467  21.072  -1.607
  592   1HG1  VAL  21          1HG1      VAL  21   1.133  23.360  -2.089
  593   2HG1  VAL  21          2HG1      VAL  21   2.788  22.830  -2.393
  594   3HG1  VAL  21          3HG1      VAL  21   2.100  22.695  -0.774
  595   1HG2  VAL  21          1HG2      VAL  21   0.365  20.296  -3.793
  596   2HG2  VAL  21          2HG2      VAL  21   1.970  20.910  -4.192
  597   3HG2  VAL  21          3HG2      VAL  21   0.621  22.029  -3.999
  598    H    ASP  22           H        ASP  22   1.197  18.731  -0.031
  599    HA   ASP  22           HA       ASP  22   2.852  19.482   2.224
  600   1HB   ASP  22          2HB       ASP  22   0.852  20.168   3.608
  601   2HB   ASP  22          1HB       ASP  22   1.347  21.315   2.369
  602    H    ALA  23           H        ALA  23   1.894  18.438   4.315
  603    HA   ALA  23           HA       ALA  23   1.901  15.677   3.930
  604   1HB   ALA  23          1HB       ALA  23   0.635  16.287   6.414
  605   2HB   ALA  23          2HB       ALA  23   1.927  17.451   6.124
  606   3HB   ALA  23          3HB       ALA  23   2.278  15.723   6.116
  607    H    ALA  24           H        ALA  24  -0.799  17.894   4.480
  608    HA   ALA  24           HA       ALA  24  -2.808  15.928   4.662
  609   1HB   ALA  24          1HB       ALA  24  -3.586  17.969   5.371
  610   2HB   ALA  24          2HB       ALA  24  -4.244  17.944   3.734
  611   3HB   ALA  24          3HB       ALA  24  -2.772  18.851   4.079
  612    H    THR  25           H        THR  25  -1.818  17.936   1.874
  613    HA   THR  25           HA       THR  25  -3.437  16.761  -0.037
  614    HB   THR  25           HB       THR  25  -1.634  17.446  -1.665
  615    HG1  THR  25           1HG      THR  25  -0.258  17.756   0.713
  616   1HG2  THR  25          1HG2      THR  25  -2.546  19.464   0.353
  617   2HG2  THR  25          2HG2      THR  25  -3.281  19.080  -1.202
  618   3HG2  THR  25          3HG2      THR  25  -1.709  19.878  -1.144
  619    H    ALA  26           H        ALA  26  -0.213  15.812   1.095
  620    HA   ALA  26           HA       ALA  26   0.122  13.596  -0.607
  621   1HB   ALA  26          1HB       ALA  26   1.620  14.803   1.371
  622   2HB   ALA  26          2HB       ALA  26   2.056  13.334   0.500
  623   3HB   ALA  26          3HB       ALA  26   1.243  13.225   2.061
  624    H    GLU  27           H        GLU  27  -1.071  13.799   2.752
  625    HA   GLU  27           HA       GLU  27  -1.765  11.190   3.189
  626   1HB   GLU  27          2HB       GLU  27  -1.865  12.993   4.868
  627   2HB   GLU  27          1HB       GLU  27  -3.278  13.655   4.061
  628   1HG   GLU  27          2HG       GLU  27  -3.998  12.430   5.971
  629   2HG   GLU  27          1HG       GLU  27  -4.472  11.536   4.529
  630    H    LYS  28           H        LYS  28  -3.799  13.741   1.761
  631    HA   LYS  28           HA       LYS  28  -6.086  12.212   1.328
  632   1HB   LYS  28          2HB       LYS  28  -5.017  14.543  -0.271
  633   2HB   LYS  28          1HB       LYS  28  -6.645  13.893  -0.420
  634   1HG   LYS  28          2HG       LYS  28  -5.441  15.161   2.031
  635   2HG   LYS  28          1HG       LYS  28  -6.660  15.867   0.966
  636   1HD   LYS  28          2HD       LYS  28  -8.210  14.066   1.559
  637   2HD   LYS  28          1HD       LYS  28  -6.991  13.370   2.628
  638   1HE   LYS  28          2HE       LYS  28  -8.248  16.099   2.904
  639   2HE   LYS  28          1HE       LYS  28  -8.626  14.683   3.883
  640   1HZ   LYS  28          1HZ       LYS  28  -7.099  15.587   5.241
  641   2HZ   LYS  28          2HZ       LYS  28  -6.343  16.469   4.013
  642   3HZ   LYS  28          3HZ       LYS  28  -5.991  14.827   4.214
  643    H    VAL  29           H        VAL  29  -3.201  12.611  -0.652
  644    HA   VAL  29           HA       VAL  29  -4.091  11.350  -2.976
  645    HB   VAL  29           HB       VAL  29  -1.307  11.372  -1.799
  646   1HG1  VAL  29          1HG1      VAL  29  -0.740  11.132  -4.324
  647   2HG1  VAL  29          2HG1      VAL  29  -2.364  10.453  -4.437
  648   3HG1  VAL  29          3HG1      VAL  29  -1.165   9.701  -3.385
  649   1HG2  VAL  29          1HG2      VAL  29  -1.026  13.441  -2.607
  650   2HG2  VAL  29          2HG2      VAL  29  -2.788  13.509  -2.641
  651   3HG2  VAL  29          3HG2      VAL  29  -1.894  13.078  -4.099
  652    H    VAL  30           H        VAL  30  -2.739  10.006  -0.012
  653    HA   VAL  30           HA       VAL  30  -2.501   7.344  -0.933
  654    HB   VAL  30           HB       VAL  30  -3.030   8.270   1.895
  655   1HG1  VAL  30          1HG1      VAL  30  -3.259   5.794   1.245
  656   2HG1  VAL  30          2HG1      VAL  30  -2.246   6.202   2.629
  657   3HG1  VAL  30          3HG1      VAL  30  -1.505   5.827   1.074
  658   1HG2  VAL  30          1HG2      VAL  30  -0.531   8.123   2.113
  659   2HG2  VAL  30          2HG2      VAL  30  -1.120   9.458   1.121
  660   3HG2  VAL  30          3HG2      VAL  30  -0.458   8.015   0.354
  661    H    LYS  31           H        LYS  31  -5.087   9.049   0.855
  662    HA   LYS  31           HA       LYS  31  -6.893   7.031   1.237
  663   1HB   LYS  31          2HB       LYS  31  -7.286   9.933   0.594
  664   2HB   LYS  31          1HB       LYS  31  -8.674   8.869   0.764
  665   1HG   LYS  31          2HG       LYS  31  -8.259  10.013   2.839
  666   2HG   LYS  31          1HG       LYS  31  -7.933   8.291   3.035
  667   1HD   LYS  31          2HD       LYS  31  -5.520   8.766   2.705
  668   2HD   LYS  31          1HD       LYS  31  -5.903  10.487   2.654
  669   1HE   LYS  31          2HE       LYS  31  -6.484   8.642   4.967
  670   2HE   LYS  31          1HE       LYS  31  -5.117   9.751   4.874
  671   1HZ   LYS  31          1HZ       LYS  31  -7.578  11.090   4.369
  672   2HZ   LYS  31          2HZ       LYS  31  -6.394  11.425   5.529
  673   3HZ   LYS  31          3HZ       LYS  31  -7.615  10.303   5.868
  674    H    GLN  32           H        GLN  32  -6.359   8.890  -1.709
  675    HA   GLN  32           HA       GLN  32  -8.425   7.547  -3.180
  676   1HB   GLN  32          2HB       GLN  32  -7.624   9.809  -3.804
  677   2HB   GLN  32          1HB       GLN  32  -6.051   9.131  -4.198
  678   1HG   GLN  32          2HG       GLN  32  -7.276   9.486  -6.217
  679   2HG   GLN  32          1HG       GLN  32  -7.108   7.755  -5.943
  680   1HE2  GLN  32          1HE2      GLN  32  -9.393   9.067  -3.835
  681   2HE2  GLN  32          2HE2      GLN  32 -10.809   8.667  -4.729
  682    H    PHE  33           H        PHE  33  -4.991   7.168  -2.705
  683    HA   PHE  33           HA       PHE  33  -4.369   5.308  -4.666
  684   1HB   PHE  33          2HB       PHE  33  -2.785   6.504  -3.107
  685   2HB   PHE  33          1HB       PHE  33  -3.248   5.356  -1.856
  686    HD1  PHE  33           1HD      PHE  33  -1.843   5.549  -5.278
  687    HD2  PHE  33           2HD      PHE  33  -2.080   3.343  -1.633
  688    HE1  PHE  33           1HE      PHE  33  -0.114   4.002  -6.093
  689    HE2  PHE  33           2HE      PHE  33  -0.349   1.802  -2.459
  690    HZ   PHE  33           HZ       PHE  33   0.630   2.139  -4.694
  691    H    PHE  34           H        PHE  34  -5.239   4.659  -1.286
  692    HA   PHE  34           HA       PHE  34  -5.537   1.845  -1.723
  693   1HB   PHE  34          2HB       PHE  34  -6.301   3.568   0.630
  694   2HB   PHE  34          1HB       PHE  34  -6.383   1.805   0.609
  695    HD1  PHE  34           1HD      PHE  34  -3.990   1.069  -0.839
  696    HD2  PHE  34           2HD      PHE  34  -4.561   4.101   2.090
  697    HE1  PHE  34           1HE      PHE  34  -1.607   0.959  -0.269
  698    HE2  PHE  34           2HE      PHE  34  -2.173   3.988   2.670
  699    HZ   PHE  34           HZ       PHE  34  -0.702   2.419   1.476
  700    H    ASN  35           H        ASN  35  -7.793   4.540  -1.426
  701    HA   ASN  35           HA       ASN  35 -10.195   3.191  -1.317
  702   1HB   ASN  35          2HB       ASN  35 -10.097   5.610  -1.212
  703   2HB   ASN  35          1HB       ASN  35  -9.489   5.697  -2.863
  704   1HD2  ASN  35          1HD2      ASN  35 -12.105   6.177  -1.054
  705   2HD2  ASN  35          2HD2      ASN  35 -13.352   5.903  -2.216
  706    H    ASP  36           H        ASP  36  -8.095   3.780  -4.033
  707    HA   ASP  36           HA       ASP  36  -9.893   2.386  -5.862
  708   1HB   ASP  36          2HB       ASP  36  -7.301   3.846  -6.397
  709   2HB   ASP  36          1HB       ASP  36  -8.313   3.107  -7.632
  710    H    ASN  37           H        ASN  37  -6.973   1.748  -4.073
  711    HA   ASN  37           HA       ASN  37  -6.191  -0.449  -5.786
  712   1HB   ASN  37          2HB       ASN  37  -5.237   0.408  -3.046
  713   2HB   ASN  37          1HB       ASN  37  -4.616  -1.009  -3.884
  714   1HD2  ASN  37          1HD2      ASN  37  -3.497   1.697  -3.035
  715   2HD2  ASN  37          2HD2      ASN  37  -2.696   2.265  -4.457
  716    H    GLY  38           H        GLY  38  -7.650  -0.018  -2.611
  717   1HA   GLY  38          2HA       GLY  38  -8.166  -2.014  -1.244
  718   2HA   GLY  38          1HA       GLY  38  -9.583  -1.331  -2.004
  719    H    VAL  39           H        VAL  39 -10.885  -2.781  -2.780
  720    HA   VAL  39           HA       VAL  39  -9.793  -5.387  -3.614
  721    HB   VAL  39           HB       VAL  39 -12.598  -4.721  -2.785
  722   1HG1  VAL  39          1HG1      VAL  39 -12.944  -6.707  -3.800
  723   2HG1  VAL  39          2HG1      VAL  39 -12.292  -7.360  -2.296
  724   3HG1  VAL  39          3HG1      VAL  39 -11.244  -7.171  -3.703
  725   1HG2  VAL  39          1HG2      VAL  39 -11.787  -4.556  -0.713
  726   2HG2  VAL  39          2HG2      VAL  39 -10.202  -5.153  -1.203
  727   3HG2  VAL  39          3HG2      VAL  39 -11.486  -6.291  -0.800
  728    H    ASP  40           H        ASP  40 -10.820  -2.671  -5.197
  729    HA   ASP  40           HA       ASP  40 -12.008  -4.304  -7.335
  730   1HB   ASP  40          2HB       ASP  40 -12.753  -1.476  -6.568
  731   2HB   ASP  40          1HB       ASP  40 -13.381  -2.348  -7.963
  732    H    GLY  41           H        GLY  41  -9.224  -3.000  -6.649
  733   1HA   GLY  41          2HA       GLY  41  -8.835  -1.244  -8.912
  734   2HA   GLY  41          1HA       GLY  41  -7.606  -1.767  -7.771
  735    H    GLU  42           H        GLU  42  -6.743  -1.667 -10.224
  736    HA   GLU  42           HA       GLU  42  -7.052  -4.301 -11.474
  737   1HB   GLU  42          2HB       GLU  42  -5.631  -1.821 -12.469
  738   2HB   GLU  42          1HB       GLU  42  -5.829  -3.316 -13.374
  739   1HG   GLU  42          2HG       GLU  42  -8.249  -3.014 -13.356
  740   2HG   GLU  42          1HG       GLU  42  -8.058  -1.522 -12.437
  741    H    TRP  43           H        TRP  43  -5.798  -5.724 -10.379
  742    HA   TRP  43           HA       TRP  43  -3.078  -4.951  -9.641
  743   1HB   TRP  43          2HB       TRP  43  -4.700  -7.400  -8.942
  744   2HB   TRP  43          1HB       TRP  43  -3.079  -7.059  -8.350
  745    HD1  TRP  43           HD       TRP  43  -5.516  -4.135  -8.459
  746    HE1  TRP  43           1HE      TRP  43  -6.172  -3.525  -6.042
  747    HE3  TRP  43           3HE      TRP  43  -3.421  -8.100  -6.028
  748    HZ2  TRP  43           2HZ      TRP  43  -5.843  -4.591  -3.452
  749    HZ3  TRP  43           3HZ      TRP  43  -3.630  -8.239  -3.588
  750    HH2  TRP  43           HH       TRP  43  -4.818  -6.516  -2.321
  751    H    THR  44           H        THR  44  -1.412  -5.466 -10.883
  752    HA   THR  44           HA       THR  44  -1.680  -7.685 -12.792
  753    HB   THR  44           HB       THR  44   0.259  -6.664 -13.942
  754    HG1  THR  44           1HG      THR  44  -0.010  -4.603 -12.014
  755   1HG2  THR  44          1HG2      THR  44  -0.787  -4.524 -14.650
  756   2HG2  THR  44          2HG2      THR  44  -2.029  -4.786 -13.425
  757   3HG2  THR  44          3HG2      THR  44  -1.849  -5.927 -14.758
  758    H    TYR  45           H        TYR  45  -0.397  -9.467 -12.616
  759    HA   TYR  45           HA       TYR  45   1.471  -9.513 -10.346
  760   1HB   TYR  45          2HB       TYR  45  -0.367 -11.120 -10.200
  761   2HB   TYR  45          1HB       TYR  45   0.079 -11.796 -11.761
  762    HD1  TYR  45           1HD      TYR  45   2.403 -10.814  -9.038
  763    HD2  TYR  45           2HD      TYR  45   0.568 -14.020 -11.152
  764    HE1  TYR  45           1HE      TYR  45   3.901 -12.406  -7.914
  765    HE2  TYR  45           2HE      TYR  45   2.061 -15.620 -10.031
  766    HH   TYR  45           HH       TYR  45   3.402 -15.764  -7.979
  767    H    ASP  46           H        ASP  46   3.565 -10.152 -10.565
  768    HA   ASP  46           HA       ASP  46   4.489 -10.783 -13.291
  769   1HB   ASP  46          2HB       ASP  46   5.131  -8.492 -12.673
  770   2HB   ASP  46          1HB       ASP  46   5.910  -9.097 -11.214
  771    H    ASP  47           H        ASP  47   4.294 -13.010 -12.678
  772    HA   ASP  47           HA       ASP  47   5.377 -14.305 -10.525
  773   1HB   ASP  47          2HB       ASP  47   5.368 -15.276 -13.389
  774   2HB   ASP  47          1HB       ASP  47   5.574 -16.297 -11.969
  775    H    ALA  48           H        ALA  48   7.066 -13.118 -13.366
  776    HA   ALA  48           HA       ALA  48   9.480 -14.399 -13.194
  777   1HB   ALA  48          1HB       ALA  48   8.583 -11.796 -14.229
  778   2HB   ALA  48          2HB       ALA  48   9.510 -13.075 -15.013
  779   3HB   ALA  48          3HB       ALA  48  10.313 -11.942 -13.927
  780    H    THR  49           H        THR  49   8.278 -11.844 -11.113
  781    HA   THR  49           HA       THR  49  10.755 -12.082  -9.537
  782    HB   THR  49           HB       THR  49  10.504  -9.705  -8.904
  783    HG1  THR  49           1HG      THR  49   8.999  -8.441  -9.912
  784   1HG2  THR  49          1HG2      THR  49  10.783  -8.770 -11.347
  785   2HG2  THR  49          2HG2      THR  49  10.922 -10.484 -11.734
  786   3HG2  THR  49          3HG2      THR  49  12.035  -9.747 -10.582
  787    H    LYS  50           H        LYS  50   7.822 -13.161  -9.429
  788    HA   LYS  50           HA       LYS  50   6.232 -13.599  -7.832
  789   1HB   LYS  50          2HB       LYS  50   8.600 -13.263  -5.978
  790   2HB   LYS  50          1HB       LYS  50   7.125 -14.151  -5.629
  791   1HG   LYS  50          2HG       LYS  50   9.021 -14.870  -7.851
  792   2HG   LYS  50          1HG       LYS  50   9.087 -15.566  -6.231
  793   1HD   LYS  50          2HD       LYS  50   6.628 -15.657  -7.967
  794   2HD   LYS  50          1HD       LYS  50   7.855 -16.927  -7.963
  795   1HE   LYS  50          2HE       LYS  50   7.482 -17.301  -5.588
  796   2HE   LYS  50          1HE       LYS  50   6.300 -15.995  -5.549
  797   1HZ   LYS  50          1HZ       LYS  50   5.611 -18.514  -5.845
  798   2HZ   LYS  50          2HZ       LYS  50   5.854 -18.142  -7.475
  799   3HZ   LYS  50          3HZ       LYS  50   4.736 -17.257  -6.566
  800    H    THR  51           H        THR  51   6.377 -10.887  -8.607
  801    HA   THR  51           HA       THR  51   5.674  -9.520  -6.094
  802    HB   THR  51           HB       THR  51   6.927  -8.386  -8.599
  803    HG1  THR  51           1HG      THR  51   8.422  -9.405  -7.286
  804   1HG2  THR  51          1HG2      THR  51   6.521  -6.305  -7.958
  805   2HG2  THR  51          2HG2      THR  51   6.889  -6.663  -6.271
  806   3HG2  THR  51          3HG2      THR  51   5.279  -6.987  -6.911
  807    H    PHE  52           H        PHE  52   3.794  -8.331  -6.023
  808    HA   PHE  52           HA       PHE  52   2.042  -8.614  -8.373
  809   1HB   PHE  52          2HB       PHE  52   1.298  -8.240  -5.475
  810   2HB   PHE  52          1HB       PHE  52   0.161  -8.339  -6.813
  811    HD1  PHE  52           1HD      PHE  52  -0.172 -10.454  -8.004
  812    HD2  PHE  52           2HD      PHE  52   2.344 -10.191  -4.584
  813    HE1  PHE  52           1HE      PHE  52  -0.240 -12.901  -7.773
  814    HE2  PHE  52           2HE      PHE  52   2.283 -12.640  -4.347
  815    HZ   PHE  52           HZ       PHE  52   0.990 -13.997  -5.943
  816    H    THR  53           H        THR  53   2.494  -6.827  -9.470
  817    HA   THR  53           HA       THR  53   2.588  -4.218  -8.270
  818    HB   THR  53           HB       THR  53   2.437  -3.476 -10.765
  819    HG1  THR  53           1HG      THR  53   3.288  -6.136 -11.151
  820   1HG2  THR  53          1HG2      THR  53   4.482  -3.120  -9.774
  821   2HG2  THR  53          2HG2      THR  53   4.868  -4.213 -11.110
  822   3HG2  THR  53          3HG2      THR  53   4.749  -4.839  -9.465
  823    H    VAL  54           H        VAL  54   1.065  -2.796  -7.956
  824    HA   VAL  54           HA       VAL  54  -1.585  -3.246  -9.163
  825    HB   VAL  54           HB       VAL  54  -1.032  -2.134  -6.401
  826   1HG1  VAL  54          1HG1      VAL  54  -3.018  -1.142  -6.814
  827   2HG1  VAL  54          2HG1      VAL  54  -3.658  -2.738  -6.418
  828   3HG1  VAL  54          3HG1      VAL  54  -3.435  -2.270  -8.104
  829   1HG2  VAL  54          1HG2      VAL  54  -0.877  -4.749  -7.089
  830   2HG2  VAL  54          2HG2      VAL  54  -2.593  -4.611  -6.701
  831   3HG2  VAL  54          3HG2      VAL  54  -1.378  -4.170  -5.500
  832    H    THR  55           H        THR  55  -2.330  -1.557 -10.320
  833    HA   THR  55           HA       THR  55  -0.969   1.019  -9.928
  834    HB   THR  55           HB       THR  55  -2.238   0.138 -12.511
  835    HG1  THR  55           1HG      THR  55   0.430  -0.201 -11.615
  836   1HG2  THR  55          1HG2      THR  55  -0.823   1.786 -13.525
  837   2HG2  THR  55          2HG2      THR  55  -0.062   2.143 -11.974
  838   3HG2  THR  55          3HG2      THR  55  -1.761   2.546 -12.240
  839    H    GLU  56           H        GLU  56  -2.140   2.661  -9.267
  840    HA   GLU  56           HA       GLU  56  -4.879   2.469  -8.704
  841   1HB   GLU  56          2HB       GLU  56  -3.404   4.009  -7.519
  842   2HB   GLU  56          1HB       GLU  56  -3.135   4.922  -8.998
  843   1HG   GLU  56          2HG       GLU  56  -5.518   5.517  -9.046
  844   2HG   GLU  56          1HG       GLU  56  -5.750   4.642  -7.532
  Start of MODEL    9
    1   1H    MET   1          1HT       MET   1   5.553 -19.936   1.761
    2   2H    MET   1          2HT       MET   1   4.577 -18.557   1.808
    3   3H    MET   1          3HT       MET   1   5.581 -18.925   3.118
    4    HA   MET   1           HA       MET   1   7.506 -18.343   2.014
    5   1HB   MET   1          2HB       MET   1   6.848 -19.691   0.000
    6   2HB   MET   1          1HB       MET   1   5.898 -18.320  -0.549
    7   1HG   MET   1          2HG       MET   1   7.834 -16.983  -0.839
    8   2HG   MET   1          1HG       MET   1   8.851 -18.165  -0.018
    9   1HE   MET   1          1HE       MET   1   6.016 -18.969  -2.658
   10   2HE   MET   1          2HE       MET   1   6.932 -18.856  -4.159
   11   3HE   MET   1          3HE       MET   1   6.672 -17.416  -3.174
   12    H    GLN   2           H        GLN   2   8.124 -16.201   0.905
   13    HA   GLN   2           HA       GLN   2   6.127 -14.177   1.660
   14   1HB   GLN   2          2HB       GLN   2   8.173 -14.101   3.007
   15   2HB   GLN   2          1HB       GLN   2   9.142 -13.953   1.547
   16   1HG   GLN   2          2HG       GLN   2   8.081 -11.807   1.062
   17   2HG   GLN   2          1HG       GLN   2   7.115 -11.955   2.526
   18   1HE2  GLN   2          1HE2      GLN   2  10.036 -13.276   3.273
   19   2HE2  GLN   2          2HE2      GLN   2  10.821 -11.885   3.922
   20    H    TYR   3           H        TYR   3   5.821 -12.366   0.321
   21    HA   TYR   3           HA       TYR   3   7.008 -12.531  -2.362
   22   1HB   TYR   3          2HB       TYR   3   4.070 -12.144  -1.744
   23   2HB   TYR   3          1HB       TYR   3   4.790 -11.957  -3.338
   24    HD1  TYR   3           1HD      TYR   3   4.567 -13.728  -4.775
   25    HD2  TYR   3           2HD      TYR   3   4.723 -14.508  -0.595
   26    HE1  TYR   3           1HE      TYR   3   4.249 -16.124  -5.218
   27    HE2  TYR   3           2HE      TYR   3   4.410 -16.909  -1.025
   28    HH   TYR   3           HH       TYR   3   4.115 -18.488  -2.567
   29    H    LYS   4           H        LYS   4   7.109 -10.532  -3.504
   30    HA   LYS   4           HA       LYS   4   7.040  -8.215  -1.698
   31   1HB   LYS   4          2HB       LYS   4   9.200  -8.705  -2.775
   32   2HB   LYS   4          1HB       LYS   4   8.446  -8.553  -4.356
   33   1HG   LYS   4          2HG       LYS   4   7.985  -6.213  -3.946
   34   2HG   LYS   4          1HG       LYS   4   8.648  -6.347  -2.317
   35   1HD   LYS   4          2HD       LYS   4  10.272  -5.349  -3.838
   36   2HD   LYS   4          1HD       LYS   4  10.838  -6.916  -3.259
   37   1HE   LYS   4          2HE       LYS   4  10.096  -7.954  -5.343
   38   2HE   LYS   4          1HE       LYS   4   9.515  -6.392  -5.919
   39   1HZ   LYS   4          1HZ       LYS   4  12.030  -5.783  -5.341
   40   2HZ   LYS   4          2HZ       LYS   4  11.545  -6.341  -6.862
   41   3HZ   LYS   4          3HZ       LYS   4  12.232  -7.413  -5.748
   42    H    VAL   5           H        VAL   5   5.166  -7.158  -1.806
   43    HA   VAL   5           HA       VAL   5   3.749  -7.002  -4.348
   44    HB   VAL   5           HB       VAL   5   2.875  -6.139  -1.588
   45   1HG1  VAL   5          1HG1      VAL   5   1.456  -6.168  -4.240
   46   2HG1  VAL   5          2HG1      VAL   5   1.684  -4.811  -3.138
   47   3HG1  VAL   5          3HG1      VAL   5   0.598  -6.130  -2.699
   48   1HG2  VAL   5          1HG2      VAL   5   2.713  -8.679  -3.073
   49   2HG2  VAL   5          2HG2      VAL   5   1.237  -8.166  -2.259
   50   3HG2  VAL   5          3HG2      VAL   5   2.724  -8.377  -1.336
   51    H    ILE   6           H        ILE   6   4.263  -5.425  -5.619
   52    HA   ILE   6           HA       ILE   6   5.231  -2.876  -4.569
   53    HB   ILE   6           HB       ILE   6   5.188  -4.004  -7.371
   54   1HG1  ILE   6          2HG1      ILE   6   7.456  -3.393  -5.470
   55   2HG1  ILE   6          1HG1      ILE   6   6.839  -4.996  -5.850
   56   1HG2  ILE   6          1HG2      ILE   6   5.863  -2.058  -8.264
   57   2HG2  ILE   6          2HG2      ILE   6   6.773  -1.587  -6.830
   58   3HG2  ILE   6          3HG2      ILE   6   5.027  -1.360  -6.879
   59   1HD1  ILE   6          1HD1      ILE   6   7.460  -4.511  -8.254
   60   2HD1  ILE   6          2HD1      ILE   6   8.795  -4.724  -7.123
   61   3HD1  ILE   6          3HD1      ILE   6   8.328  -3.106  -7.640
   62    H    LEU   7           H        LEU   7   4.063  -1.063  -4.592
   63    HA   LEU   7           HA       LEU   7   1.401  -1.154  -5.854
   64   1HB   LEU   7          2HB       LEU   7   2.224   0.703  -3.633
   65   2HB   LEU   7          1HB       LEU   7   0.603   0.245  -4.125
   66    HG   LEU   7           HG       LEU   7   2.599  -1.530  -2.730
   67   1HD1  LEU   7          1HD1      LEU   7   1.553   0.246  -1.347
   68   2HD1  LEU   7          2HD1      LEU   7   1.138  -1.390  -0.838
   69   3HD1  LEU   7          3HD1      LEU   7  -0.026  -0.427  -1.749
   70   1HD2  LEU   7          1HD2      LEU   7  -0.235  -2.096  -3.597
   71   2HD2  LEU   7          2HD2      LEU   7   0.793  -3.167  -2.646
   72   3HD2  LEU   7          3HD2      LEU   7   1.223  -2.784  -4.312
   73    H    ASN   8           H        ASN   8   1.618  -0.184  -7.820
   74    HA   ASN   8           HA       ASN   8   3.124   2.334  -7.954
   75   1HB   ASN   8          2HB       ASN   8   2.241   0.519 -10.204
   76   2HB   ASN   8          1HB       ASN   8   3.237   1.962 -10.370
   77   1HD2  ASN   8          1HD2      ASN   8   5.298   1.566 -10.584
   78   2HD2  ASN   8          2HD2      ASN   8   6.159   0.222  -9.921
   79    H    GLY   9           H        GLY   9   1.841   4.070  -7.682
   80   1HA   GLY   9          2HA       GLY   9  -0.768   4.059  -9.073
   81   2HA   GLY   9          1HA       GLY   9  -0.449   4.961  -7.599
   82    H    LYS  10           H        LYS  10  -1.405   6.662  -9.085
   83    HA   LYS  10           HA       LYS  10   0.334   7.687 -11.129
   84   1HB   LYS  10          2HB       LYS  10  -2.225   8.663  -9.885
   85   2HB   LYS  10          1HB       LYS  10  -1.311   9.670 -10.999
   86   1HG   LYS  10          2HG       LYS  10  -3.127   8.467 -12.109
   87   2HG   LYS  10          1HG       LYS  10  -1.544   8.016 -12.744
   88   1HD   LYS  10          2HD       LYS  10  -1.570   5.985 -11.393
   89   2HD   LYS  10          1HD       LYS  10  -3.138   6.443 -10.720
   90   1HE   LYS  10          2HE       LYS  10  -3.348   4.788 -12.525
   91   2HE   LYS  10          1HE       LYS  10  -4.149   6.308 -12.921
   92   1HZ   LYS  10          1HZ       LYS  10  -1.404   5.646 -13.822
   93   2HZ   LYS  10          2HZ       LYS  10  -2.398   6.902 -14.367
   94   3HZ   LYS  10          3HZ       LYS  10  -2.783   5.299 -14.740
   95    H    THR  11           H        THR  11  -0.760   8.912  -7.958
   96    HA   THR  11           HA       THR  11   1.538  10.722  -7.908
   97    HB   THR  11           HB       THR  11   0.194  11.676  -5.922
   98    HG1  THR  11           1HG      THR  11  -1.213   9.789  -5.883
   99   1HG2  THR  11          1HG2      THR  11  -0.736  13.227  -7.255
  100   2HG2  THR  11          2HG2      THR  11  -1.499  12.029  -8.298
  101   3HG2  THR  11          3HG2      THR  11   0.209  12.417  -8.503
  102    H    LEU  12           H        LEU  12   0.918   7.685  -6.963
  103    HA   LEU  12           HA       LEU  12   2.663   7.949  -4.632
  104   1HB   LEU  12          2HB       LEU  12   0.387   7.810  -3.782
  105   2HB   LEU  12          1HB       LEU  12   0.112   6.345  -4.704
  106    HG   LEU  12           HG       LEU  12   1.646   5.116  -3.335
  107   1HD1  LEU  12          1HD1      LEU  12   3.415   6.229  -2.574
  108   2HD1  LEU  12          2HD1      LEU  12   2.375   6.768  -1.253
  109   3HD1  LEU  12          3HD1      LEU  12   2.584   7.776  -2.682
  110   1HD2  LEU  12          1HD2      LEU  12  -0.737   6.181  -2.432
  111   2HD2  LEU  12          2HD2      LEU  12   0.384   6.473  -1.103
  112   3HD2  LEU  12          3HD2      LEU  12   0.147   4.835  -1.713
  113    H    LYS  13           H        LYS  13   4.142   6.385  -4.382
  114    HA   LYS  13           HA       LYS  13   3.970   3.932  -5.950
  115   1HB   LYS  13          2HB       LYS  13   6.432   5.680  -6.087
  116   2HB   LYS  13          1HB       LYS  13   6.138   4.186  -6.962
  117   1HG   LYS  13          2HG       LYS  13   5.734   5.732  -8.596
  118   2HG   LYS  13          1HG       LYS  13   4.110   5.505  -7.946
  119   1HD   LYS  13          2HD       LYS  13   4.523   7.862  -8.239
  120   2HD   LYS  13          1HD       LYS  13   4.447   7.502  -6.516
  121   1HE   LYS  13          2HE       LYS  13   6.881   7.497  -6.395
  122   2HE   LYS  13          1HE       LYS  13   6.977   7.809  -8.128
  123   1HZ   LYS  13          1HZ       LYS  13   7.263   9.807  -6.721
  124   2HZ   LYS  13          2HZ       LYS  13   5.668   9.630  -6.182
  125   3HZ   LYS  13          3HZ       LYS  13   5.979   9.938  -7.817
  126    H    GLY  14           H        GLY  14   5.163   2.209  -5.048
  127   1HA   GLY  14          2HA       GLY  14   7.125   2.540  -3.045
  128   2HA   GLY  14          1HA       GLY  14   5.567   2.296  -2.279
  129    H    GLU  15           H        GLU  15   6.901   0.454  -1.433
  130    HA   GLU  15           HA       GLU  15   6.261  -1.925  -2.996
  131   1HB   GLU  15          2HB       GLU  15   9.013  -1.423  -1.840
  132   2HB   GLU  15          1HB       GLU  15   8.477  -2.912  -2.606
  133   1HG   GLU  15          2HG       GLU  15   8.175  -1.718  -4.717
  134   2HG   GLU  15          1HG       GLU  15   8.715  -0.227  -3.948
  135    H    THR  16           H        THR  16   5.712  -3.672  -1.758
  136    HA   THR  16           HA       THR  16   6.140  -3.549   1.125
  137    HB   THR  16           HB       THR  16   4.028  -2.604   1.164
  138    HG1  THR  16           1HG      THR  16   3.385  -5.337   1.057
  139   1HG2  THR  16          1HG2      THR  16   3.037  -4.438  -0.993
  140   2HG2  THR  16          2HG2      THR  16   3.589  -2.789  -1.271
  141   3HG2  THR  16          3HG2      THR  16   2.181  -3.087  -0.252
  142    H    THR  17           H        THR  17   5.360  -5.683   2.184
  143    HA   THR  17           HA       THR  17   5.585  -7.941   0.336
  144    HB   THR  17           HB       THR  17   7.295  -8.995   1.823
  145    HG1  THR  17           1HG      THR  17   6.868  -7.573   3.625
  146   1HG2  THR  17          1HG2      THR  17   8.239  -8.139  -0.121
  147   2HG2  THR  17          2HG2      THR  17   9.198  -7.427   1.175
  148   3HG2  THR  17          3HG2      THR  17   7.959  -6.467   0.368
  149    H    THR  18           H        THR  18   4.050  -9.344   0.750
  150    HA   THR  18           HA       THR  18   2.956  -9.579   3.489
  151    HB   THR  18           HB       THR  18   1.365  -8.925   1.680
  152    HG1  THR  18           1HG      THR  18   0.706 -10.162   3.528
  153   1HG2  THR  18          1HG2      THR  18   0.936 -11.494   0.532
  154   2HG2  THR  18          2HG2      THR  18   2.595 -10.983   0.215
  155   3HG2  THR  18          3HG2      THR  18   1.248  -9.952  -0.267
  156    H    GLU  19           H        GLU  19   2.827 -11.583   4.462
  157    HA   GLU  19           HA       GLU  19   4.459 -13.702   3.248
  158   1HB   GLU  19          2HB       GLU  19   4.983 -12.882   5.559
  159   2HB   GLU  19          1HB       GLU  19   3.413 -13.473   6.082
  160   1HG   GLU  19          2HG       GLU  19   4.979 -15.107   6.713
  161   2HG   GLU  19          1HG       GLU  19   4.139 -15.754   5.306
  162    H    ALA  20           H        ALA  20   3.271 -15.148   2.049
  163    HA   ALA  20           HA       ALA  20   0.921 -16.321   3.316
  164   1HB   ALA  20          1HB       ALA  20   0.542 -15.697   0.461
  165   2HB   ALA  20          2HB       ALA  20   0.499 -14.322   1.564
  166   3HB   ALA  20          3HB       ALA  20  -0.611 -15.673   1.796
  167    H    VAL  21           H        VAL  21   0.421 -18.364   2.638
  168    HA   VAL  21           HA       VAL  21   2.436 -20.103   1.973
  169    HB   VAL  21           HB       VAL  21  -0.471 -20.553   1.305
  170   1HG1  VAL  21          1HG1      VAL  21   0.391 -22.939   2.095
  171   2HG1  VAL  21          2HG1      VAL  21   1.917 -22.298   1.486
  172   3HG1  VAL  21          3HG1      VAL  21   0.516 -22.399   0.420
  173   1HG2  VAL  21          1HG2      VAL  21  -0.373 -21.687   3.632
  174   2HG2  VAL  21          2HG2      VAL  21  -0.568 -19.937   3.530
  175   3HG2  VAL  21          3HG2      VAL  21   1.012 -20.630   3.899
  176    H    ASP  22           H        ASP  22   0.461 -18.238  -0.207
  177    HA   ASP  22           HA       ASP  22   2.209 -18.923  -2.395
  178   1HB   ASP  22          2HB       ASP  22   0.511 -19.792  -3.911
  179   2HB   ASP  22          1HB       ASP  22   0.639 -20.810  -2.481
  180    H    ALA  23           H        ALA  23   1.234 -17.902  -4.531
  181    HA   ALA  23           HA       ALA  23   1.200 -15.143  -4.133
  182   1HB   ALA  23          1HB       ALA  23   0.322 -16.750  -6.524
  183   2HB   ALA  23          2HB       ALA  23   1.924 -16.073  -6.227
  184   3HB   ALA  23          3HB       ALA  23   0.553 -15.001  -6.522
  185    H    ALA  24           H        ALA  24  -1.479 -17.383  -4.706
  186    HA   ALA  24           HA       ALA  24  -3.502 -15.435  -4.906
  187   1HB   ALA  24          1HB       ALA  24  -3.495 -18.072  -5.287
  188   2HB   ALA  24          2HB       ALA  24  -4.977 -17.176  -4.953
  189   3HB   ALA  24          3HB       ALA  24  -4.161 -18.048  -3.654
  190    H    THR  25           H        THR  25  -2.531 -17.431  -2.102
  191    HA   THR  25           HA       THR  25  -4.156 -16.271  -0.191
  192    HB   THR  25           HB       THR  25  -2.375 -16.942   1.435
  193    HG1  THR  25           1HG      THR  25  -0.940 -17.243  -0.937
  194   1HG2  THR  25          1HG2      THR  25  -2.185 -19.394   0.575
  195   2HG2  THR  25          2HG2      THR  25  -3.364 -18.844  -0.617
  196   3HG2  THR  25          3HG2      THR  25  -3.736 -18.745   1.105
  197    H    ALA  26           H        ALA  26  -0.944 -15.296  -1.329
  198    HA   ALA  26           HA       ALA  26  -0.603 -13.070   0.350
  199   1HB   ALA  26          1HB       ALA  26   1.363 -13.428  -0.713
  200   2HB   ALA  26          2HB       ALA  26   0.701 -12.300  -1.895
  201   3HB   ALA  26          3HB       ALA  26   0.583 -14.037  -2.173
  202    H    GLU  27           H        GLU  27  -1.839 -13.278  -2.997
  203    HA   GLU  27           HA       GLU  27  -2.557 -10.678  -3.434
  204   1HB   GLU  27          2HB       GLU  27  -2.728 -12.475  -5.106
  205   2HB   GLU  27          1HB       GLU  27  -4.099 -13.150  -4.236
  206   1HG   GLU  27          2HG       GLU  27  -4.889 -11.921  -6.132
  207   2HG   GLU  27          1HG       GLU  27  -5.353 -11.071  -4.659
  208    H    LYS  28           H        LYS  28  -4.476 -13.211  -1.864
  209    HA   LYS  28           HA       LYS  28  -6.724 -11.591  -1.309
  210   1HB   LYS  28          2HB       LYS  28  -5.764 -14.083   0.115
  211   2HB   LYS  28          1HB       LYS  28  -7.369 -13.378   0.259
  212   1HG   LYS  28          2HG       LYS  28  -6.140 -14.602  -2.199
  213   2HG   LYS  28          1HG       LYS  28  -7.475 -15.241  -1.237
  214   1HD   LYS  28          2HD       LYS  28  -8.839 -13.307  -1.845
  215   2HD   LYS  28          1HD       LYS  28  -7.500 -12.655  -2.791
  216   1HE   LYS  28          2HE       LYS  28  -8.928 -15.264  -3.304
  217   2HE   LYS  28          1HE       LYS  28  -9.138 -13.773  -4.220
  218   1HZ   LYS  28          1HZ       LYS  28  -7.644 -15.291  -5.350
  219   2HZ   LYS  28          2HZ       LYS  28  -6.620 -15.335  -4.006
  220   3HZ   LYS  28          3HZ       LYS  28  -6.810 -13.898  -4.876
  221    H    VAL  29           H        VAL  29  -3.948 -12.584   0.676
  222    HA   VAL  29           HA       VAL  29  -4.632 -11.280   3.028
  223    HB   VAL  29           HB       VAL  29  -1.866 -11.710   1.884
  224   1HG1  VAL  29          1HG1      VAL  29  -2.820 -10.817   4.576
  225   2HG1  VAL  29          2HG1      VAL  29  -1.525 -10.157   3.576
  226   3HG1  VAL  29          3HG1      VAL  29  -1.302 -11.699   4.405
  227   1HG2  VAL  29          1HG2      VAL  29  -3.701 -13.614   2.580
  228   2HG2  VAL  29          2HG2      VAL  29  -2.787 -13.416   4.074
  229   3HG2  VAL  29          3HG2      VAL  29  -1.953 -13.840   2.580
  230    H    VAL  30           H        VAL  30  -2.937 -10.077   0.178
  231    HA   VAL  30           HA       VAL  30  -2.377  -7.496   1.221
  232    HB   VAL  30           HB       VAL  30  -2.793  -8.216  -1.686
  233   1HG1  VAL  30          1HG1      VAL  30  -1.628  -6.268  -2.220
  234   2HG1  VAL  30          2HG1      VAL  30  -0.940  -6.124  -0.604
  235   3HG1  VAL  30          3HG1      VAL  30  -2.646  -5.769  -0.869
  236   1HG2  VAL  30          1HG2      VAL  30  -0.798  -9.237  -1.777
  237   2HG2  VAL  30          2HG2      VAL  30  -0.982  -9.420  -0.034
  238   3HG2  VAL  30          3HG2      VAL  30  -0.047  -8.075  -0.684
  239    H    LYS  31           H        LYS  31  -5.009  -8.772  -0.832
  240    HA   LYS  31           HA       LYS  31  -6.457  -6.464  -1.226
  241   1HB   LYS  31          2HB       LYS  31  -7.330  -9.316  -0.874
  242   2HB   LYS  31          1HB       LYS  31  -8.504  -8.035  -1.145
  243   1HG   LYS  31          2HG       LYS  31  -7.448  -7.469  -3.246
  244   2HG   LYS  31          1HG       LYS  31  -6.203  -8.689  -2.972
  245   1HD   LYS  31          2HD       LYS  31  -7.878 -10.446  -3.051
  246   2HD   LYS  31          1HD       LYS  31  -9.157  -9.242  -3.237
  247   1HE   LYS  31          2HE       LYS  31  -6.880  -9.666  -5.169
  248   2HE   LYS  31          1HE       LYS  31  -8.511 -10.305  -5.376
  249   1HZ   LYS  31          1HZ       LYS  31  -7.765  -7.432  -5.230
  250   2HZ   LYS  31          2HZ       LYS  31  -9.343  -8.021  -5.387
  251   3HZ   LYS  31          3HZ       LYS  31  -8.221  -8.272  -6.626
  252    H    GLN  32           H        GLN  32  -6.438  -8.602   1.572
  253    HA   GLN  32           HA       GLN  32  -8.472  -7.268   3.026
  254   1HB   GLN  32          2HB       GLN  32  -7.643  -9.537   3.605
  255   2HB   GLN  32          1HB       GLN  32  -6.107  -8.836   4.086
  256   1HG   GLN  32          2HG       GLN  32  -7.407  -9.285   6.040
  257   2HG   GLN  32          1HG       GLN  32  -7.268  -7.544   5.830
  258   1HE2  GLN  32          1HE2      GLN  32  -9.428  -8.840   3.581
  259   2HE2  GLN  32          2HE2      GLN  32 -10.892  -8.500   4.427
  260    H    PHE  33           H        PHE  33  -5.020  -6.848   2.698
  261    HA   PHE  33           HA       PHE  33  -4.478  -5.020   4.712
  262   1HB   PHE  33          2HB       PHE  33  -2.846  -6.177   3.142
  263   2HB   PHE  33          1HB       PHE  33  -3.271  -4.970   1.938
  264    HD1  PHE  33           1HD      PHE  33  -2.065  -5.228   5.446
  265    HD2  PHE  33           2HD      PHE  33  -1.982  -3.060   1.768
  266    HE1  PHE  33           1HE      PHE  33  -0.349  -3.718   6.361
  267    HE2  PHE  33           2HE      PHE  33  -0.263  -1.562   2.696
  268    HZ   PHE  33           HZ       PHE  33   0.549  -1.899   5.001
  269    H    PHE  34           H        PHE  34  -5.187  -4.311   1.311
  270    HA   PHE  34           HA       PHE  34  -5.568  -1.512   1.744
  271   1HB   PHE  34          2HB       PHE  34  -6.359  -3.226  -0.615
  272   2HB   PHE  34          1HB       PHE  34  -6.315  -1.461  -0.594
  273    HD1  PHE  34           1HD      PHE  34  -3.903  -0.833   0.806
  274    HD2  PHE  34           2HD      PHE  34  -4.649  -3.951  -1.985
  275    HE1  PHE  34           1HE      PHE  34  -1.514  -0.897   0.254
  276    HE2  PHE  34           2HE      PHE  34  -2.257  -4.017  -2.552
  277    HZ   PHE  34           HZ       PHE  34  -0.693  -2.489  -1.413
  278    H    ASN  35           H        ASN  35  -7.732  -4.258   1.384
  279    HA   ASN  35           HA       ASN  35 -10.188  -3.017   1.234
  280   1HB   ASN  35          2HB       ASN  35  -9.857  -5.458   1.149
  281   2HB   ASN  35          1HB       ASN  35  -9.460  -5.463   2.865
  282   1HD2  ASN  35          1HD2      ASN  35 -11.734  -6.318   0.860
  283   2HD2  ASN  35          2HD2      ASN  35 -13.156  -6.033   1.798
  284    H    ASP  36           H        ASP  36  -8.121  -3.576   3.984
  285    HA   ASP  36           HA       ASP  36  -9.981  -2.249   5.800
  286   1HB   ASP  36          2HB       ASP  36  -7.353  -3.636   6.367
  287   2HB   ASP  36          1HB       ASP  36  -8.431  -2.965   7.588
  288    H    ASN  37           H        ASN  37  -7.045  -1.521   4.062
  289    HA   ASN  37           HA       ASN  37  -6.343   0.678   5.815
  290   1HB   ASN  37          2HB       ASN  37  -5.289  -0.106   3.086
  291   2HB   ASN  37          1HB       ASN  37  -4.686   1.257   4.018
  292   1HD2  ASN  37          1HD2      ASN  37  -3.532  -1.390   3.068
  293   2HD2  ASN  37          2HD2      ASN  37  -2.801  -2.042   4.492
  294    H    GLY  38           H        GLY  38  -7.671   0.246   2.581
  295   1HA   GLY  38          2HA       GLY  38  -8.091   2.287   1.219
  296   2HA   GLY  38          1HA       GLY  38  -9.548   1.542   1.835
  297    H    VAL  39           H        VAL  39 -10.947   2.865   2.680
  298    HA   VAL  39           HA       VAL  39 -10.040   5.527   3.552
  299    HB   VAL  39           HB       VAL  39 -12.787   4.656   2.719
  300   1HG1  VAL  39          1HG1      VAL  39 -12.770   7.287   2.262
  301   2HG1  VAL  39          2HG1      VAL  39 -11.608   7.232   3.588
  302   3HG1  VAL  39          3HG1      VAL  39 -13.237   6.596   3.816
  303   1HG2  VAL  39          1HG2      VAL  39 -12.368   5.550   0.556
  304   2HG2  VAL  39          2HG2      VAL  39 -11.041   4.451   0.929
  305   3HG2  VAL  39          3HG2      VAL  39 -10.805   6.193   1.057
  306    H    ASP  40           H        ASP  40 -10.828   2.738   5.118
  307    HA   ASP  40           HA       ASP  40 -12.153   4.243   7.268
  308   1HB   ASP  40          2HB       ASP  40 -12.643   1.364   6.479
  309   2HB   ASP  40          1HB       ASP  40 -13.336   2.161   7.888
  310    H    GLY  41           H        GLY  41  -9.277   3.154   6.525
  311   1HA   GLY  41          2HA       GLY  41  -8.716   1.467   8.808
  312   2HA   GLY  41          1HA       GLY  41  -7.554   2.038   7.622
  313    H    GLU  42           H        GLU  42  -6.620   2.046  10.050
  314    HA   GLU  42           HA       GLU  42  -7.062   4.688  11.246
  315   1HB   GLU  42          2HB       GLU  42  -5.495   2.315  12.277
  316   2HB   GLU  42          1HB       GLU  42  -5.761   3.819  13.150
  317   1HG   GLU  42          2HG       GLU  42  -8.161   3.389  13.171
  318   2HG   GLU  42          1HG       GLU  42  -7.901   1.886  12.287
  319    H    TRP  43           H        TRP  43  -5.905   6.154  10.094
  320    HA   TRP  43           HA       TRP  43  -3.198   5.532   9.244
  321   1HB   TRP  43          2HB       TRP  43  -4.898   7.993   8.825
  322   2HB   TRP  43          1HB       TRP  43  -3.314   7.722   8.111
  323    HD1  TRP  43           HD       TRP  43  -6.525   5.519   8.220
  324    HE1  TRP  43           1HE      TRP  43  -6.999   4.727   5.820
  325    HE3  TRP  43           3HE      TRP  43  -2.662   7.848   5.837
  326    HZ2  TRP  43           2HZ      TRP  43  -5.869   5.058   3.242
  327    HZ3  TRP  43           3HZ      TRP  43  -2.425   7.565   3.412
  328    HH2  TRP  43           HH       TRP  43  -3.996   6.197   2.137
  329    H    THR  44           H        THR  44  -1.589   5.810  10.637
  330    HA   THR  44           HA       THR  44  -1.714   8.044  12.544
  331    HB   THR  44           HB       THR  44   0.109   6.833  13.741
  332    HG1  THR  44           1HG      THR  44  -0.416   4.770  11.871
  333   1HG2  THR  44          1HG2      THR  44  -1.195   5.198  14.766
  334   2HG2  THR  44          2HG2      THR  44  -2.138   4.904  13.303
  335   3HG2  THR  44          3HG2      THR  44  -2.355   6.404  14.207
  336    H    TYR  45           H        TYR  45  -0.275   9.702  12.393
  337    HA   TYR  45           HA       TYR  45   1.741   9.504  10.254
  338   1HB   TYR  45          2HB       TYR  45  -0.075  11.164   9.897
  339   2HB   TYR  45          1HB       TYR  45   0.434  11.997  11.362
  340    HD1  TYR  45           1HD      TYR  45   2.653  10.516   8.782
  341    HD2  TYR  45           2HD      TYR  45   1.072  14.083  10.479
  342    HE1  TYR  45           1HE      TYR  45   4.245  11.845   7.458
  343    HE2  TYR  45           2HE      TYR  45   2.657  15.421   9.161
  344    HH   TYR  45           HH       TYR  45   4.006  15.259   7.178
  345    H    ASP  46           H        ASP  46   3.822  10.236  10.589
  346    HA   ASP  46           HA       ASP  46   4.533  10.893  13.374
  347   1HB   ASP  46          2HB       ASP  46   5.223   8.598  12.813
  348   2HB   ASP  46          1HB       ASP  46   6.119   9.204  11.423
  349    H    ASP  47           H        ASP  47   4.466  13.126  12.836
  350    HA   ASP  47           HA       ASP  47   5.660  14.435  10.745
  351   1HB   ASP  47          2HB       ASP  47   5.579  15.356  13.627
  352   2HB   ASP  47          1HB       ASP  47   5.840  16.393  12.227
  353    H    ALA  48           H        ALA  48   7.199  13.185  13.652
  354    HA   ALA  48           HA       ALA  48   9.649  14.404  13.591
  355   1HB   ALA  48          1HB       ALA  48  10.282  12.873  15.118
  356   2HB   ALA  48          2HB       ALA  48   9.741  11.511  14.136
  357   3HB   ALA  48          3HB       ALA  48   8.572  12.439  15.075
  358    H    THR  49           H        THR  49   8.511  11.821  11.499
  359    HA   THR  49           HA       THR  49  11.029  12.057   9.989
  360    HB   THR  49           HB       THR  49  10.836   9.660   9.413
  361    HG1  THR  49           1HG      THR  49   8.531   9.565   9.845
  362   1HG2  THR  49          1HG2      THR  49  12.190  10.355  11.375
  363   2HG2  THR  49          2HG2      THR  49  11.551   8.715  11.478
  364   3HG2  THR  49          3HG2      THR  49  10.794  10.016  12.397
  365    H    LYS  50           H        LYS  50   8.110  13.105   9.787
  366    HA   LYS  50           HA       LYS  50   6.524  13.462   8.165
  367   1HB   LYS  50          2HB       LYS  50   8.998  13.278   6.446
  368   2HB   LYS  50          1HB       LYS  50   7.462  13.973   5.943
  369   1HG   LYS  50          2HG       LYS  50   7.976  15.324   8.262
  370   2HG   LYS  50          1HG       LYS  50   9.590  15.108   7.583
  371   1HD   LYS  50          2HD       LYS  50   7.243  16.199   6.054
  372   2HD   LYS  50          1HD       LYS  50   8.433  17.208   6.878
  373   1HE   LYS  50          2HE       LYS  50   9.051  17.085   4.574
  374   2HE   LYS  50          1HE       LYS  50  10.204  16.121   5.492
  375   1HZ   LYS  50          1HZ       LYS  50   9.228  15.169   3.335
  376   2HZ   LYS  50          2HZ       LYS  50   7.846  14.854   4.255
  377   3HZ   LYS  50          3HZ       LYS  50   9.326  14.156   4.686
  378    H    THR  51           H        THR  51   6.821  10.739   8.927
  379    HA   THR  51           HA       THR  51   6.224   9.353   6.401
  380    HB   THR  51           HB       THR  51   7.340   8.254   8.986
  381    HG1  THR  51           1HG      THR  51   9.122   7.768   7.542
  382   1HG2  THR  51          1HG2      THR  51   7.675   6.379   6.961
  383   2HG2  THR  51          2HG2      THR  51   5.987   6.877   6.865
  384   3HG2  THR  51          3HG2      THR  51   6.637   6.254   8.380
  385    H    PHE  52           H        PHE  52   4.451   7.988   6.298
  386    HA   PHE  52           HA       PHE  52   2.475   8.361   8.451
  387   1HB   PHE  52          2HB       PHE  52   2.040   7.762   5.518
  388   2HB   PHE  52          1HB       PHE  52   0.764   7.920   6.720
  389    HD1  PHE  52           1HD      PHE  52  -0.098  10.017   7.292
  390    HD2  PHE  52           2HD      PHE  52   3.491   9.760   5.024
  391    HE1  PHE  52           1HE      PHE  52  -0.194  12.439   6.876
  392    HE2  PHE  52           2HE      PHE  52   3.404  12.183   4.606
  393    HZ   PHE  52           HZ       PHE  52   1.560  13.526   5.534
  394    H    THR  53           H        THR  53   1.839   6.637   9.569
  395    HA   THR  53           HA       THR  53   2.500   3.978   8.508
  396    HB   THR  53           HB       THR  53   2.223   3.332  11.019
  397    HG1  THR  53           1HG      THR  53   2.949   6.046  11.313
  398   1HG2  THR  53          1HG2      THR  53   4.611   4.202  11.481
  399   2HG2  THR  53          2HG2      THR  53   4.570   4.693   9.787
  400   3HG2  THR  53          3HG2      THR  53   4.347   2.996  10.220
  401    H    VAL  54           H        VAL  54   0.918   2.650   8.023
  402    HA   VAL  54           HA       VAL  54  -1.783   3.233   9.052
  403    HB   VAL  54           HB       VAL  54  -1.067   1.859   6.449
  404   1HG1  VAL  54          1HG1      VAL  54  -3.248   1.410   6.134
  405   2HG1  VAL  54          2HG1      VAL  54  -3.770   2.930   6.859
  406   3HG1  VAL  54          3HG1      VAL  54  -3.353   1.560   7.888
  407   1HG2  VAL  54          1HG2      VAL  54  -1.544   4.684   7.156
  408   2HG2  VAL  54          2HG2      VAL  54  -2.362   4.097   5.709
  409   3HG2  VAL  54          3HG2      VAL  54  -0.607   3.984   5.836
  410    H    THR  55           H        THR  55  -2.393   1.806  10.547
  411    HA   THR  55           HA       THR  55  -1.241  -0.885  10.460
  412    HB   THR  55           HB       THR  55  -2.834   0.319  12.718
  413    HG1  THR  55           1HG      THR  55  -0.989   1.586  12.350
  414   1HG2  THR  55          1HG2      THR  55  -2.615  -2.065  12.905
  415   2HG2  THR  55          2HG2      THR  55  -1.550  -1.290  14.078
  416   3HG2  THR  55          3HG2      THR  55  -0.880  -1.966  12.591
  417    H    GLU  56           H        GLU  56  -2.387  -2.376   9.442
  418    HA   GLU  56           HA       GLU  56  -4.968  -2.195   8.546
  419   1HB   GLU  56          2HB       GLU  56  -3.313  -3.915   7.865
  420   2HB   GLU  56          1HB       GLU  56  -3.566  -4.737   9.398
  421   1HG   GLU  56          2HG       GLU  56  -5.737  -4.260   7.369
  422   2HG   GLU  56          1HG       GLU  56  -4.774  -5.732   7.461
  423   1H    MET   1          1HT       MET   1   6.060  19.849  -1.589
  424   2H    MET   1          2HT       MET   1   5.052  18.491  -1.651
  425   3H    MET   1          3HT       MET   1   6.083  18.836  -2.946
  426    HA   MET   1           HA       MET   1   7.978  18.207  -1.815
  427   1HB   MET   1          2HB       MET   1   7.324  19.572   0.190
  428   2HB   MET   1          1HB       MET   1   6.332  18.224   0.724
  429   1HG   MET   1          2HG       MET   1   8.232  16.841   1.042
  430   2HG   MET   1          1HG       MET   1   9.288  17.998   0.236
  431   1HE   MET   1          1HE       MET   1   6.436  18.870   2.834
  432   2HE   MET   1          2HE       MET   1   7.329  18.734   4.349
  433   3HE   MET   1          3HE       MET   1   7.048  17.301   3.361
  434    H    GLN   2           H        GLN   2   8.527  16.052  -0.698
  435    HA   GLN   2           HA       GLN   2   6.492  14.077  -1.480
  436   1HB   GLN   2          2HB       GLN   2   8.554  13.950  -2.799
  437   2HB   GLN   2          1HB       GLN   2   9.498  13.780  -1.327
  438   1HG   GLN   2          2HG       GLN   2   8.380  11.659  -0.856
  439   2HG   GLN   2          1HG       GLN   2   7.438  11.831  -2.333
  440   1HE2  GLN   2          1HE2      GLN   2  10.400  13.080  -3.039
  441   2HE2  GLN   2          2HE2      GLN   2  11.161  11.669  -3.677
  442    H    TYR   3           H        TYR   3   6.124  12.272  -0.146
  443    HA   TYR   3           HA       TYR   3   7.276  12.410   2.552
  444   1HB   TYR   3          2HB       TYR   3   4.339  12.095   1.893
  445   2HB   TYR   3          1HB       TYR   3   5.032  11.889   3.498
  446    HD1  TYR   3           1HD      TYR   3   4.832  13.667   4.931
  447    HD2  TYR   3           2HD      TYR   3   5.065  14.441   0.754
  448    HE1  TYR   3           1HE      TYR   3   4.565  16.070   5.368
  449    HE2  TYR   3           2HE      TYR   3   4.805  16.850   1.179
  450    HH   TYR   3           HH       TYR   3   4.525  18.436   2.716
  451    H    LYS   4           H        LYS   4   7.314  10.410   3.695
  452    HA   LYS   4           HA       LYS   4   7.213   8.094   1.889
  453   1HB   LYS   4          2HB       LYS   4   9.370   8.532   2.996
  454   2HB   LYS   4          1HB       LYS   4   8.589   8.400   4.566
  455   1HG   LYS   4          2HG       LYS   4   8.076   6.071   4.150
  456   2HG   LYS   4          1HG       LYS   4   8.767   6.188   2.530
  457   1HD   LYS   4          2HD       LYS   4  10.343   5.150   4.073
  458   2HD   LYS   4          1HD       LYS   4  10.956   6.703   3.502
  459   1HE   LYS   4          2HE       LYS   4  10.211   7.760   5.576
  460   2HE   LYS   4          1HE       LYS   4   9.583   6.214   6.144
  461   1HZ   LYS   4          1HZ       LYS   4  12.091   5.542   5.602
  462   2HZ   LYS   4          2HZ       LYS   4  11.598   6.113   7.116
  463   3HZ   LYS   4          3HZ       LYS   4  12.326   7.167   6.011
  464    H    VAL   5           H        VAL   5   5.313   7.083   1.969
  465    HA   VAL   5           HA       VAL   5   3.856   6.962   4.492
  466    HB   VAL   5           HB       VAL   5   3.001   6.120   1.720
  467   1HG1  VAL   5          1HG1      VAL   5   1.545   6.184   4.351
  468   2HG1  VAL   5          2HG1      VAL   5   1.757   4.822   3.251
  469   3HG1  VAL   5          3HG1      VAL   5   0.708   6.165   2.798
  470   1HG2  VAL   5          1HG2      VAL   5   2.881   8.664   3.202
  471   2HG2  VAL   5          2HG2      VAL   5   1.402   8.186   2.368
  472   3HG2  VAL   5          3HG2      VAL   5   2.906   8.361   1.466
  473    H    ILE   6           H        ILE   6   4.314   5.374   5.769
  474    HA   ILE   6           HA       ILE   6   5.234   2.802   4.731
  475    HB   ILE   6           HB       ILE   6   5.179   3.932   7.533
  476   1HG1  ILE   6          2HG1      ILE   6   7.459   3.265   5.666
  477   2HG1  ILE   6          1HG1      ILE   6   6.876   4.882   6.037
  478   1HG2  ILE   6          1HG2      ILE   6   5.793   1.967   8.435
  479   2HG2  ILE   6          2HG2      ILE   6   6.713   1.476   7.014
  480   3HG2  ILE   6          3HG2      ILE   6   4.961   1.292   7.037
  481   1HD1  ILE   6          1HD1      ILE   6   7.450   4.383   8.448
  482   2HD1  ILE   6          2HD1      ILE   6   8.807   4.563   7.337
  483   3HD1  ILE   6          3HD1      ILE   6   8.292   2.956   7.848
  484    H    LEU   7           H        LEU   7   4.023   1.018   4.739
  485    HA   LEU   7           HA       LEU   7   1.345   1.173   5.962
  486   1HB   LEU   7          2HB       LEU   7   2.155  -0.704   3.754
  487   2HB   LEU   7          1HB       LEU   7   0.538  -0.206   4.223
  488    HG   LEU   7           HG       LEU   7   2.596   1.520   2.857
  489   1HD1  LEU   7          1HD1      LEU   7   1.528  -0.231   1.458
  490   2HD1  LEU   7          2HD1      LEU   7   1.160   1.414   0.944
  491   3HD1  LEU   7          3HD1      LEU   7  -0.041   0.480   1.836
  492   1HD2  LEU   7          1HD2      LEU   7  -0.235   2.155   3.684
  493   2HD2  LEU   7          2HD2      LEU   7   0.832   3.199   2.747
  494   3HD2  LEU   7          3HD2      LEU   7   1.229   2.808   4.419
  495    H    ASN   8           H        ASN   8   1.510   0.198   7.932
  496    HA   ASN   8           HA       ASN   8   2.955  -2.355   8.087
  497   1HB   ASN   8          2HB       ASN   8   2.084  -0.517  10.323
  498   2HB   ASN   8          1HB       ASN   8   3.042  -1.985  10.504
  499   1HD2  ASN   8          1HD2      ASN   8   5.109  -1.639  10.746
  500   2HD2  ASN   8          2HD2      ASN   8   6.012  -0.317  10.097
  501    H    GLY   9           H        GLY   9   1.634  -4.059   7.796
  502   1HA   GLY   9          2HA       GLY   9  -0.995  -3.986   9.150
  503   2HA   GLY   9          1HA       GLY   9  -0.677  -4.894   7.681
  504    H    LYS  10           H        LYS  10  -1.695  -6.572   9.154
  505    HA   LYS  10           HA       LYS  10  -0.010  -7.638  11.220
  506   1HB   LYS  10          2HB       LYS  10  -2.575  -8.551   9.942
  507   2HB   LYS  10          1HB       LYS  10  -1.701  -9.581  11.068
  508   1HG   LYS  10          2HG       LYS  10  -3.502  -8.333  12.153
  509   2HG   LYS  10          1HG       LYS  10  -1.919  -7.922  12.810
  510   1HD   LYS  10          2HD       LYS  10  -1.876  -5.891  11.457
  511   2HD   LYS  10          1HD       LYS  10  -3.445  -6.310  10.763
  512   1HE   LYS  10          2HE       LYS  10  -3.639  -4.650  12.564
  513   2HE   LYS  10          1HE       LYS  10  -4.483  -6.150  12.949
  514   1HZ   LYS  10          1HZ       LYS  10  -1.736  -5.556  13.889
  515   2HZ   LYS  10          2HZ       LYS  10  -2.767  -6.787  14.419
  516   3HZ   LYS  10          3HZ       LYS  10  -3.119  -5.174  14.788
  517    H    THR  11           H        THR  11  -1.088  -8.836   8.034
  518    HA   THR  11           HA       THR  11   1.165 -10.703   8.015
  519    HB   THR  11           HB       THR  11  -0.174 -11.623   6.013
  520    HG1  THR  11           1HG      THR  11  -1.533  -9.704   5.952
  521   1HG2  THR  11          1HG2      THR  11  -1.160 -13.152   7.330
  522   2HG2  THR  11          2HG2      THR  11  -1.908 -11.935   8.363
  523   3HG2  THR  11          3HG2      THR  11  -0.213 -12.364   8.592
  524    H    LEU  12           H        LEU  12   0.632  -7.652   7.063
  525    HA   LEU  12           HA       LEU  12   2.403  -7.957   4.757
  526   1HB   LEU  12          2HB       LEU  12   0.143  -7.763   3.876
  527   2HB   LEU  12          1HB       LEU  12  -0.108  -6.291   4.795
  528    HG   LEU  12           HG       LEU  12   1.475  -5.101   3.446
  529   1HD1  LEU  12          1HD1      LEU  12   3.226  -6.257   2.711
  530   2HD1  LEU  12          2HD1      LEU  12   2.192  -6.771   1.375
  531   3HD1  LEU  12          3HD1      LEU  12   2.358  -7.782   2.806
  532   1HD2  LEU  12          1HD2      LEU  12  -0.921  -6.108   2.510
  533   2HD2  LEU  12          2HD2      LEU  12   0.213  -6.428   1.197
  534   3HD2  LEU  12          3HD2      LEU  12   0.005  -4.784   1.803
  535    H    LYS  13           H        LYS  13   3.923  -6.430   4.529
  536    HA   LYS  13           HA       LYS  13   3.789  -3.974   6.095
  537   1HB   LYS  13          2HB       LYS  13   6.205  -5.781   6.265
  538   2HB   LYS  13          1HB       LYS  13   5.935  -4.280   7.138
  539   1HG   LYS  13          2HG       LYS  13   5.471  -5.817   8.764
  540   2HG   LYS  13          1HG       LYS  13   3.862  -5.549   8.091
  541   1HD   LYS  13          2HD       LYS  13   4.213  -7.915   8.390
  542   2HD   LYS  13          1HD       LYS  13   4.172  -7.554   6.666
  543   1HE   LYS  13          2HE       LYS  13   6.607  -7.608   6.581
  544   2HE   LYS  13          1HE       LYS  13   6.669  -7.922   8.314
  545   1HZ   LYS  13          1HZ       LYS  13   6.926  -9.927   6.910
  546   2HZ   LYS  13          2HZ       LYS  13   5.345  -9.710   6.350
  547   3HZ   LYS  13          3HZ       LYS  13   5.624 -10.026   7.988
  548    H    GLY  14           H        GLY  14   5.035  -2.280   5.209
  549   1HA   GLY  14          2HA       GLY  14   7.017  -2.660   3.235
  550   2HA   GLY  14          1HA       GLY  14   5.477  -2.378   2.447
  551    H    GLU  15           H        GLU  15   6.869  -0.568   1.620
  552    HA   GLU  15           HA       GLU  15   6.262   1.825   3.174
  553   1HB   GLU  15          2HB       GLU  15   9.017   1.256   2.057
  554   2HB   GLU  15          1HB       GLU  15   8.507   2.757   2.816
  555   1HG   GLU  15          2HG       GLU  15   8.146   1.572   4.922
  556   2HG   GLU  15          1HG       GLU  15   8.661   0.068   4.161
  557    H    THR  16           H        THR  16   5.774   3.585   1.929
  558    HA   THR  16           HA       THR  16   6.239   3.451  -0.948
  559    HB   THR  16           HB       THR  16   4.106   2.559  -1.016
  560    HG1  THR  16           1HG      THR  16   3.527   5.305  -0.918
  561   1HG2  THR  16          1HG2      THR  16   3.129   4.415   1.126
  562   2HG2  THR  16          2HG2      THR  16   3.637   2.753   1.410
  563   3HG2  THR  16          3HG2      THR  16   2.252   3.087   0.373
  564    H    THR  17           H        THR  17   5.526   5.603  -2.018
  565    HA   THR  17           HA       THR  17   5.781   7.856  -0.167
  566    HB   THR  17           HB       THR  17   7.537   8.868  -1.629
  567    HG1  THR  17           1HG      THR  17   7.101   7.457  -3.437
  568   1HG2  THR  17          1HG2      THR  17   8.431   7.989   0.329
  569   2HG2  THR  17          2HG2      THR  17   9.391   7.255  -0.954
  570   3HG2  THR  17          3HG2      THR  17   8.118   6.326  -0.165
  571    H    THR  18           H        THR  18   4.286   9.294  -0.602
  572    HA   THR  18           HA       THR  18   3.237   9.556  -3.356
  573    HB   THR  18           HB       THR  18   1.604   8.942  -1.569
  574    HG1  THR  18           1HG      THR  18   1.002  10.194  -3.426
  575   1HG2  THR  18          1HG2      THR  18   1.223  11.521  -0.426
  576   2HG2  THR  18          2HG2      THR  18   2.863  10.969  -0.086
  577   3HG2  THR  18          3HG2      THR  18   1.485   9.972   0.376
  578    H    GLU  19           H        GLU  19   3.170  11.564  -4.330
  579    HA   GLU  19           HA       GLU  19   4.837  13.642  -3.094
  580   1HB   GLU  19          2HB       GLU  19   5.373  12.808  -5.395
  581   2HB   GLU  19          1HB       GLU  19   3.824  13.437  -5.941
  582   1HG   GLU  19          2HG       GLU  19   5.439  15.032  -6.550
  583   2HG   GLU  19          1HG       GLU  19   4.595  15.700  -5.154
  584    H    ALA  20           H        ALA  20   3.667  15.116  -1.910
  585    HA   ALA  20           HA       ALA  20   1.365  16.345  -3.210
  586   1HB   ALA  20          1HB       ALA  20   0.930  15.733  -0.362
  587   2HB   ALA  20          2HB       ALA  20   0.869  14.359  -1.466
  588   3HB   ALA  20          3HB       ALA  20  -0.205  15.735  -1.712
  589    H    VAL  21           H        VAL  21   0.904  18.400  -2.539
  590    HA   VAL  21           HA       VAL  21   2.953  20.090  -1.846
  591    HB   VAL  21           HB       VAL  21   0.047  20.611  -1.217
  592   1HG1  VAL  21          1HG1      VAL  21   0.977  22.974  -1.996
  593   2HG1  VAL  21          2HG1      VAL  21   2.479  22.298  -1.365
  594   3HG1  VAL  21          3HG1      VAL  21   1.065  22.433  -0.319
  595   1HG2  VAL  21          1HG2      VAL  21   0.205  21.742  -3.545
  596   2HG2  VAL  21          2HG2      VAL  21  -0.034  19.997  -3.445
  597   3HG2  VAL  21          3HG2      VAL  21   1.568  20.650  -3.791
  598    H    ASP  22           H        ASP  22   0.901  18.274   0.306
  599    HA   ASP  22           HA       ASP  22   2.634  18.917   2.518
  600   1HB   ASP  22          2HB       ASP  22   0.936  19.827   4.010
  601   2HB   ASP  22          1HB       ASP  22   1.109  20.842   2.583
  602    H    ALA  23           H        ALA  23   1.605  17.920   4.640
  603    HA   ALA  23           HA       ALA  23   1.509  15.163   4.242
  604   1HB   ALA  23          1HB       ALA  23   0.636  16.790   6.621
  605   2HB   ALA  23          2HB       ALA  23   2.225  16.075   6.345
  606   3HB   ALA  23          3HB       ALA  23   0.826  15.037   6.622
  607    H    ALA  24           H        ALA  24  -1.123  17.467   4.778
  608    HA   ALA  24           HA       ALA  24  -3.195  15.570   4.948
  609   1HB   ALA  24          1HB       ALA  24  -3.129  18.205   5.329
  610   2HB   ALA  24          2HB       ALA  24  -4.627  17.346   4.973
  611   3HB   ALA  24          3HB       ALA  24  -3.772  18.197   3.688
  612    H    THR  25           H        THR  25  -2.135  17.541   2.158
  613    HA   THR  25           HA       THR  25  -3.762  16.420   0.224
  614    HB   THR  25           HB       THR  25  -1.942  17.046  -1.376
  615    HG1  THR  25           1HG      THR  25  -0.534  17.313   1.016
  616   1HG2  THR  25          1HG2      THR  25  -1.705  19.493  -0.513
  617   2HG2  THR  25          2HG2      THR  25  -2.913  18.974   0.661
  618   3HG2  THR  25          3HG2      THR  25  -3.264  18.882  -1.065
  619    H    ALA  26           H        ALA  26  -0.590  15.366   1.408
  620    HA   ALA  26           HA       ALA  26  -0.279  13.135  -0.266
  621   1HB   ALA  26          1HB       ALA  26   1.679  13.443   0.824
  622   2HB   ALA  26          2HB       ALA  26   0.973  12.333   1.998
  623   3HB   ALA  26          3HB       ALA  26   0.893  14.072   2.272
  624    H    GLU  27           H        GLU  27  -1.559  13.373   3.062
  625    HA   GLU  27           HA       GLU  27  -2.345  10.792   3.488
  626   1HB   GLU  27          2HB       GLU  27  -2.496  12.592   5.157
  627   2HB   GLU  27          1HB       GLU  27  -3.837  13.298   4.269
  628   1HG   GLU  27          2HG       GLU  27  -4.684  12.090   6.154
  629   2HG   GLU  27          1HG       GLU  27  -5.147  11.253   4.675
  630    H    LYS  28           H        LYS  28  -4.181  13.369   1.893
  631    HA   LYS  28           HA       LYS  28  -6.459  11.805   1.304
  632   1HB   LYS  28          2HB       LYS  28  -5.417  14.272  -0.105
  633   2HB   LYS  28          1HB       LYS  28  -7.037  13.606  -0.272
  634   1HG   LYS  28          2HG       LYS  28  -5.813  14.800   2.203
  635   2HG   LYS  28          1HG       LYS  28  -7.119  15.470   1.223
  636   1HD   LYS  28          2HD       LYS  28  -8.538  13.572   1.812
  637   2HD   LYS  28          1HD       LYS  28  -7.228  12.886   2.775
  638   1HE   LYS  28          2HE       LYS  28  -8.599  15.530   3.269
  639   2HE   LYS  28          1HE       LYS  28  -8.860  14.045   4.184
  640   1HZ   LYS  28          1HZ       LYS  28  -7.346  15.526   5.334
  641   2HZ   LYS  28          2HZ       LYS  28  -6.301  15.544   4.003
  642   3HZ   LYS  28          3HZ       LYS  28  -6.539  14.112   4.870
  643    H    VAL  29           H        VAL  29  -3.632  12.729  -0.640
  644    HA   VAL  29           HA       VAL  29  -4.314  11.441  -3.002
  645    HB   VAL  29           HB       VAL  29  -1.555  11.804  -1.818
  646   1HG1  VAL  29          1HG1      VAL  29  -2.493  10.934  -4.524
  647   2HG1  VAL  29          2HG1      VAL  29  -1.228  10.244  -3.506
  648   3HG1  VAL  29          3HG1      VAL  29  -0.956  11.778  -4.331
  649   1HG2  VAL  29          1HG2      VAL  29  -3.332  13.752  -2.540
  650   2HG2  VAL  29          2HG2      VAL  29  -2.402  13.532  -4.022
  651   3HG2  VAL  29          3HG2      VAL  29  -1.579  13.935  -2.515
  652    H    VAL  30           H        VAL  30  -2.689  10.198  -0.127
  653    HA   VAL  30           HA       VAL  30  -2.177   7.606  -1.163
  654    HB   VAL  30           HB       VAL  30  -2.616   8.333   1.737
  655   1HG1  VAL  30          1HG1      VAL  30  -1.508   6.359   2.287
  656   2HG1  VAL  30          2HG1      VAL  30  -0.800   6.199   0.680
  657   3HG1  VAL  30          3HG1      VAL  30  -2.517   5.885   0.921
  658   1HG2  VAL  30          1HG2      VAL  30  -0.598   9.307   1.858
  659   2HG2  VAL  30          2HG2      VAL  30  -0.754   9.494   0.111
  660   3HG2  VAL  30          3HG2      VAL  30   0.140   8.127   0.775
  661    H    LYS  31           H        LYS  31  -4.806   8.944   0.852
  662    HA   LYS  31           HA       LYS  31  -6.314   6.672   1.225
  663   1HB   LYS  31          2HB       LYS  31  -7.112   9.544   0.862
  664   2HB   LYS  31          1HB       LYS  31  -8.321   8.293   1.116
  665   1HG   LYS  31          2HG       LYS  31  -7.309   7.701   3.231
  666   2HG   LYS  31          1HG       LYS  31  -6.032   8.889   2.976
  667   1HD   LYS  31          2HD       LYS  31  -7.666  10.688   3.031
  668   2HD   LYS  31          1HD       LYS  31  -8.975   9.515   3.199
  669   1HE   LYS  31          2HE       LYS  31  -6.716   9.884   5.161
  670   2HE   LYS  31          1HE       LYS  31  -8.334  10.562   5.346
  671   1HZ   LYS  31          1HZ       LYS  31  -7.655   7.673   5.211
  672   2HZ   LYS  31          2HZ       LYS  31  -9.220   8.300   5.345
  673   3HZ   LYS  31          3HZ       LYS  31  -8.110   8.525   6.601
  674    H    GLN  32           H        GLN  32  -6.204   8.809  -1.573
  675    HA   GLN  32           HA       GLN  32  -8.250   7.524  -3.055
  676   1HB   GLN  32          2HB       GLN  32  -7.358   9.771  -3.621
  677   2HB   GLN  32          1HB       GLN  32  -5.831   9.033  -4.082
  678   1HG   GLN  32          2HG       GLN  32  -7.094   9.515  -6.053
  679   2HG   GLN  32          1HG       GLN  32  -7.000   7.770  -5.841
  680   1HE2  GLN  32          1HE2      GLN  32  -9.160   9.119  -3.624
  681   2HE2  GLN  32          2HE2      GLN  32 -10.619   8.814  -4.489
  682    H    PHE  33           H        PHE  33  -4.813   7.021  -2.679
  683    HA   PHE  33           HA       PHE  33  -4.288   5.180  -4.686
  684   1HB   PHE  33          2HB       PHE  33  -2.651   6.297  -3.092
  685   2HB   PHE  33          1HB       PHE  33  -3.122   5.100  -1.893
  686    HD1  PHE  33           1HD      PHE  33  -1.860   5.327  -5.384
  687    HD2  PHE  33           2HD      PHE  33  -1.882   3.160  -1.707
  688    HE1  PHE  33           1HE      PHE  33  -0.169   3.777  -6.275
  689    HE2  PHE  33           2HE      PHE  33  -0.187   1.619  -2.610
  690    HZ   PHE  33           HZ       PHE  33   0.666   1.936  -4.903
  691    H    PHE  34           H        PHE  34  -5.063   4.488  -1.294
  692    HA   PHE  34           HA       PHE  34  -5.505   1.699  -1.732
  693   1HB   PHE  34          2HB       PHE  34  -6.287   3.433   0.615
  694   2HB   PHE  34          1HB       PHE  34  -6.287   1.668   0.595
  695    HD1  PHE  34           1HD      PHE  34  -3.870   0.980  -0.773
  696    HD2  PHE  34           2HD      PHE  34  -4.578   4.116   2.011
  697    HE1  PHE  34           1HE      PHE  34  -1.487   0.986  -0.186
  698    HE2  PHE  34           2HE      PHE  34  -2.194   4.124   2.610
  699    HZ   PHE  34           HZ       PHE  34  -0.651   2.558   1.493
  700    H    ASN  35           H        ASN  35  -7.607   4.498  -1.403
  701    HA   ASN  35           HA       ASN  35 -10.093   3.315  -1.288
  702   1HB   ASN  35          2HB       ASN  35  -9.703   5.749  -1.197
  703   2HB   ASN  35          1HB       ASN  35  -9.283   5.744  -2.907
  704   1HD2  ASN  35          1HD2      ASN  35 -11.564   6.654  -0.935
  705   2HD2  ASN  35          2HD2      ASN  35 -12.979   6.404  -1.893
  706    H    ASP  36           H        ASP  36  -7.976   3.823  -4.008
  707    HA   ASP  36           HA       ASP  36  -9.842   2.542  -5.851
  708   1HB   ASP  36          2HB       ASP  36  -7.172   3.865  -6.379
  709   2HB   ASP  36          1HB       ASP  36  -8.248   3.220  -7.616
  710    H    ASN  37           H        ASN  37  -6.949   1.745  -4.072
  711    HA   ASN  37           HA       ASN  37  -6.275  -0.473  -5.815
  712   1HB   ASN  37          2HB       ASN  37  -5.242   0.286  -3.071
  713   2HB   ASN  37          1HB       ASN  37  -4.658  -1.092  -3.995
  714   1HD2  ASN  37          1HD2      ASN  37  -3.456   1.527  -3.027
  715   2HD2  ASN  37          2HD2      ASN  37  -2.686   2.161  -4.440
  716    H    GLY  38           H        GLY  38  -7.636  -0.007  -2.600
  717   1HA   GLY  38          2HA       GLY  38  -8.125  -2.037  -1.243
  718   2HA   GLY  38          1HA       GLY  38  -9.556  -1.256  -1.880
  719    H    VAL  39           H        VAL  39 -10.975  -2.545  -2.746
  720    HA   VAL  39           HA       VAL  39 -10.121  -5.228  -3.604
  721    HB   VAL  39           HB       VAL  39 -12.856  -4.291  -2.812
  722   1HG1  VAL  39          1HG1      VAL  39 -12.910  -6.922  -2.354
  723   2HG1  VAL  39          2HG1      VAL  39 -11.728  -6.894  -3.663
  724   3HG1  VAL  39          3HG1      VAL  39 -13.338  -6.219  -3.914
  725   1HG2  VAL  39          1HG2      VAL  39 -12.491  -5.196  -0.642
  726   2HG2  VAL  39          2HG2      VAL  39 -11.132  -4.129  -0.996
  727   3HG2  VAL  39          3HG2      VAL  39 -10.936  -5.877  -1.120
  728    H    ASP  40           H        ASP  40 -10.817  -2.424  -5.181
  729    HA   ASP  40           HA       ASP  40 -12.148  -3.894  -7.351
  730   1HB   ASP  40          2HB       ASP  40 -12.581  -1.005  -6.567
  731   2HB   ASP  40          1HB       ASP  40 -13.272  -1.785  -7.988
  732    H    GLY  41           H        GLY  41  -9.256  -2.875  -6.567
  733   1HA   GLY  41          2HA       GLY  41  -8.625  -1.203  -8.841
  734   2HA   GLY  41          1HA       GLY  41  -7.493  -1.804  -7.640
  735    H    GLU  42           H        GLU  42  -6.524  -1.835 -10.054
  736    HA   GLU  42           HA       GLU  42  -7.015  -4.465 -11.256
  737   1HB   GLU  42          2HB       GLU  42  -5.375  -2.131 -12.266
  738   2HB   GLU  42          1HB       GLU  42  -5.667  -3.627 -13.140
  739   1HG   GLU  42          2HG       GLU  42  -8.054  -3.140 -13.196
  740   2HG   GLU  42          1HG       GLU  42  -7.770  -1.644 -12.308
  741    H    TRP  43           H        TRP  43  -5.910  -5.958 -10.090
  742    HA   TRP  43           HA       TRP  43  -3.201  -5.402  -9.201
  743   1HB   TRP  43          2HB       TRP  43  -4.966  -7.820  -8.805
  744   2HB   TRP  43          1HB       TRP  43  -3.385  -7.589  -8.069
  745    HD1  TRP  43           HD       TRP  43  -6.541  -5.307  -8.222
  746    HE1  TRP  43           1HE      TRP  43  -7.028  -4.503  -5.829
  747    HE3  TRP  43           3HE      TRP  43  -2.769  -7.728  -5.786
  748    HZ2  TRP  43           2HZ      TRP  43  -5.944  -4.862  -3.236
  749    HZ3  TRP  43           3HZ      TRP  43  -2.560  -7.452  -3.358
  750    HH2  TRP  43           HH       TRP  43  -4.115  -6.045  -2.105
  751    H    THR  44           H        THR  44  -1.579  -5.718 -10.570
  752    HA   THR  44           HA       THR  44  -1.731  -7.949 -12.479
  753    HB   THR  44           HB       THR  44   0.137  -6.782 -13.648
  754    HG1  THR  44           1HG      THR  44  -0.366  -4.708 -11.787
  755   1HG2  THR  44          1HG2      THR  44  -1.114  -5.117 -14.691
  756   2HG2  THR  44          2HG2      THR  44  -2.070  -4.801 -13.244
  757   3HG2  THR  44          3HG2      THR  44  -2.309  -6.296 -14.150
  758    H    TYR  45           H        TYR  45  -0.336  -9.643 -12.307
  759    HA   TYR  45           HA       TYR  45   1.655  -9.494 -10.141
  760   1HB   TYR  45          2HB       TYR  45  -0.206 -11.108  -9.810
  761   2HB   TYR  45          1HB       TYR  45   0.303 -11.953 -11.266
  762    HD1  TYR  45           1HD      TYR  45   2.521 -10.528  -8.655
  763    HD2  TYR  45           2HD      TYR  45   0.877 -14.053 -10.375
  764    HE1  TYR  45           1HE      TYR  45   4.062 -11.893  -7.310
  765    HE2  TYR  45           2HE      TYR  45   2.411 -15.431  -9.035
  766    HH   TYR  45           HH       TYR  45   3.736 -15.301  -7.035
  767    H    ASP  46           H        ASP  46   3.723 -10.276 -10.447
  768    HA   ASP  46           HA       ASP  46   4.457 -10.950 -13.220
  769   1HB   ASP  46          2HB       ASP  46   5.191  -8.673 -12.650
  770   2HB   ASP  46          1HB       ASP  46   6.054  -9.299 -11.249
  771    H    ASP  47           H        ASP  47   4.326 -13.182 -12.684
  772    HA   ASP  47           HA       ASP  47   5.461 -14.518 -10.576
  773   1HB   ASP  47          2HB       ASP  47   5.397 -15.435 -13.457
  774   2HB   ASP  47          1HB       ASP  47   5.612 -16.480 -12.057
  775    H    ALA  48           H        ALA  48   7.068 -13.307 -13.462
  776    HA   ALA  48           HA       ALA  48   9.487 -14.584 -13.367
  777   1HB   ALA  48          1HB       ALA  48  10.179 -13.068 -14.884
  778   2HB   ALA  48          2HB       ALA  48   9.657 -11.694 -13.910
  779   3HB   ALA  48          3HB       ALA  48   8.479 -12.594 -14.865
  780    H    THR  49           H        THR  49   8.384 -11.972 -11.290
  781    HA   THR  49           HA       THR  49  10.873 -12.270  -9.745
  782    HB   THR  49           HB       THR  49  10.731  -9.869  -9.171
  783    HG1  THR  49           1HG      THR  49   8.434  -9.719  -9.634
  784   1HG2  THR  49          1HG2      THR  49  12.094 -10.597 -11.114
  785   2HG2  THR  49          2HG2      THR  49  11.497  -8.941 -11.225
  786   3HG2  THR  49          3HG2      THR  49  10.721 -10.224 -12.154
  787    H    LYS  50           H        LYS  50   7.927 -13.247  -9.584
  788    HA   LYS  50           HA       LYS  50   6.310 -13.564  -7.984
  789   1HB   LYS  50          2HB       LYS  50   8.764 -13.441  -6.231
  790   2HB   LYS  50          1HB       LYS  50   7.203 -14.099  -5.750
  791   1HG   LYS  50          2HG       LYS  50   7.716 -15.463  -8.061
  792   2HG   LYS  50          1HG       LYS  50   9.325 -15.284  -7.359
  793   1HD   LYS  50          2HD       LYS  50   6.933 -16.319  -5.863
  794   2HD   LYS  50          1HD       LYS  50   8.108 -17.356  -6.671
  795   1HE   LYS  50          2HE       LYS  50   8.697 -17.250  -4.358
  796   2HE   LYS  50          1HE       LYS  50   9.886 -16.313  -5.261
  797   1HZ   LYS  50          1HZ       LYS  50   8.903 -15.336  -3.116
  798   2HZ   LYS  50          2HZ       LYS  50   7.542 -14.988  -4.056
  799   3HZ   LYS  50          3HZ       LYS  50   9.044 -14.326  -4.467
  800    H    THR  51           H        THR  51   6.682 -10.850  -8.742
  801    HA   THR  51           HA       THR  51   6.084  -9.450  -6.225
  802    HB   THR  51           HB       THR  51   7.262  -8.381  -8.794
  803    HG1  THR  51           1HG      THR  51   9.036  -7.937  -7.325
  804   1HG2  THR  51          1HG2      THR  51   7.616  -6.512  -6.764
  805   2HG2  THR  51          2HG2      THR  51   5.915  -6.970  -6.691
  806   3HG2  THR  51          3HG2      THR  51   6.601  -6.363  -8.197
  807    H    PHE  52           H        PHE  52   4.344  -8.043  -6.147
  808    HA   PHE  52           HA       PHE  52   2.391  -8.367  -8.327
  809   1HB   PHE  52          2HB       PHE  52   1.928  -7.758  -5.401
  810   2HB   PHE  52          1HB       PHE  52   0.666  -7.885  -6.621
  811    HD1  PHE  52           1HD      PHE  52  -0.239  -9.959  -7.205
  812    HD2  PHE  52           2HD      PHE  52   3.324  -9.790  -4.886
  813    HE1  PHE  52           1HE      PHE  52  -0.399 -12.379  -6.791
  814    HE2  PHE  52           2HE      PHE  52   3.172 -12.210  -4.470
  815    HZ   PHE  52           HZ       PHE  52   1.308 -13.509  -5.423
  816    H    THR  53           H        THR  53   1.811  -6.628  -9.453
  817    HA   THR  53           HA       THR  53   2.522  -3.986  -8.383
  818    HB   THR  53           HB       THR  53   2.296  -3.334 -10.897
  819    HG1  THR  53           1HG      THR  53   2.960  -6.065 -11.181
  820   1HG2  THR  53          1HG2      THR  53   4.670  -4.261 -11.326
  821   2HG2  THR  53          2HG2      THR  53   4.591  -4.751  -9.632
  822   3HG2  THR  53          3HG2      THR  53   4.414  -3.049 -10.068
  823    H    VAL  54           H        VAL  54   0.966  -2.620  -7.920
  824    HA   VAL  54           HA       VAL  54  -1.733  -3.137  -8.988
  825    HB   VAL  54           HB       VAL  54  -1.020  -1.782  -6.374
  826   1HG1  VAL  54          1HG1      VAL  54  -3.194  -1.279  -6.090
  827   2HG1  VAL  54          2HG1      VAL  54  -3.743  -2.786  -6.823
  828   3HG1  VAL  54          3HG1      VAL  54  -3.279  -1.426  -7.846
  829   1HG2  VAL  54          1HG2      VAL  54  -1.555  -4.593  -7.089
  830   2HG2  VAL  54          2HG2      VAL  54  -2.380  -3.986  -5.652
  831   3HG2  VAL  54          3HG2      VAL  54  -0.621  -3.916  -5.755
  832    H    THR  55           H        THR  55  -2.286  -1.697 -10.491
  833    HA   THR  55           HA       THR  55  -1.071   0.966 -10.386
  834    HB   THR  55           HB       THR  55  -2.660  -0.199 -12.669
  835    HG1  THR  55           1HG      THR  55  -0.852  -1.511 -12.275
  836   1HG2  THR  55          1HG2      THR  55  -2.381   2.180 -12.851
  837   2HG2  THR  55          2HG2      THR  55  -1.319   1.377 -14.009
  838   3HG2  THR  55          3HG2      THR  55  -0.654   2.037 -12.512
  839    H    GLU  56           H        GLU  56  -2.195   2.485  -9.385
  840    HA   GLU  56           HA       GLU  56  -4.791   2.366  -8.525
  841   1HB   GLU  56          2HB       GLU  56  -3.106   4.045  -7.821
  842   2HB   GLU  56          1HB       GLU  56  -3.318   4.872  -9.357
  843   1HG   GLU  56          2HG       GLU  56  -5.527   4.448  -7.359
  844   2HG   GLU  56          1HG       GLU  56  -4.527   5.897  -7.437
  Start of MODEL   10
    1   1H    MET   1          1HT       MET   1   6.602 -18.486   3.425
    2   2H    MET   1          2HT       MET   1   6.023 -19.692   2.391
    3   3H    MET   1          3HT       MET   1   5.109 -18.294   2.652
    4    HA   MET   1           HA       MET   1   7.817 -18.171   1.489
    5   1HB   MET   1          2HB       MET   1   6.220 -19.728   0.245
    6   2HB   MET   1          1HB       MET   1   5.249 -18.304  -0.091
    7   1HG   MET   1          2HG       MET   1   6.984 -17.320  -1.383
    8   2HG   MET   1          1HG       MET   1   8.143 -18.544  -0.864
    9   1HE   MET   1          1HE       MET   1   8.375 -18.016  -3.467
   10   2HE   MET   1          2HE       MET   1   7.688 -19.116  -4.663
   11   3HE   MET   1          3HE       MET   1   8.828 -19.719  -3.460
   12    H    GLN   2           H        GLN   2   8.304 -16.125   0.688
   13    HA   GLN   2           HA       GLN   2   6.422 -14.016   1.496
   14   1HB   GLN   2          2HB       GLN   2   8.590 -13.940   2.622
   15   2HB   GLN   2          1HB       GLN   2   9.412 -13.887   1.069
   16   1HG   GLN   2          2HG       GLN   2   8.368 -11.730   0.591
   17   2HG   GLN   2          1HG       GLN   2   7.554 -11.782   2.154
   18   1HE2  GLN   2          1HE2      GLN   2   8.485 -10.568   3.621
   19   2HE2  GLN   2          2HE2      GLN   2  10.176 -10.244   3.762
   20    H    TYR   3           H        TYR   3   5.804 -12.420   0.096
   21    HA   TYR   3           HA       TYR   3   6.792 -12.621  -2.671
   22   1HB   TYR   3          2HB       TYR   3   3.926 -12.229  -1.785
   23   2HB   TYR   3          1HB       TYR   3   4.489 -12.104  -3.448
   24    HD1  TYR   3           1HD      TYR   3   4.604 -14.009  -4.803
   25    HD2  TYR   3           2HD      TYR   3   4.253 -14.469  -0.587
   26    HE1  TYR   3           1HE      TYR   3   4.261 -16.427  -5.098
   27    HE2  TYR   3           2HE      TYR   3   3.912 -16.888  -0.872
   28    HH   TYR   3           HH       TYR   3   4.486 -18.488  -3.828
   29    H    LYS   4           H        LYS   4   6.872 -10.691  -3.850
   30    HA   LYS   4           HA       LYS   4   6.971  -8.298  -2.175
   31   1HB   LYS   4          2HB       LYS   4   8.945  -8.824  -3.545
   32   2HB   LYS   4          1HB       LYS   4   7.958  -8.774  -4.993
   33   1HG   LYS   4          2HG       LYS   4   9.246  -6.731  -4.734
   34   2HG   LYS   4          1HG       LYS   4   7.515  -6.414  -4.647
   35   1HD   LYS   4          2HD       LYS   4   8.511  -5.120  -2.941
   36   2HD   LYS   4          1HD       LYS   4   7.750  -6.490  -2.135
   37   1HE   LYS   4          2HE       LYS   4  10.673  -6.349  -2.863
   38   2HE   LYS   4          1HE       LYS   4  10.025  -5.926  -1.282
   39   1HZ   LYS   4          1HZ       LYS   4  10.425  -8.060  -0.820
   40   2HZ   LYS   4          2HZ       LYS   4  10.498  -8.522  -2.444
   41   3HZ   LYS   4          3HZ       LYS   4   8.999  -8.378  -1.674
   42    H    VAL   5           H        VAL   5   5.629  -6.590  -2.433
   43    HA   VAL   5           HA       VAL   5   3.670  -6.740  -4.626
   44    HB   VAL   5           HB       VAL   5   3.160  -5.710  -1.832
   45   1HG1  VAL   5          1HG1      VAL   5   1.014  -6.311  -3.809
   46   2HG1  VAL   5          2HG1      VAL   5   1.897  -4.791  -3.944
   47   3HG1  VAL   5          3HG1      VAL   5   1.020  -5.172  -2.462
   48   1HG2  VAL   5          1HG2      VAL   5   3.410  -8.306  -2.458
   49   2HG2  VAL   5          2HG2      VAL   5   1.712  -8.063  -2.867
   50   3HG2  VAL   5          3HG2      VAL   5   2.285  -7.707  -1.239
   51    H    ILE   6           H        ILE   6   3.894  -5.128  -5.994
   52    HA   ILE   6           HA       ILE   6   5.136  -2.626  -5.123
   53    HB   ILE   6           HB       ILE   6   4.636  -3.785  -7.864
   54   1HG1  ILE   6          2HG1      ILE   6   7.189  -3.171  -6.365
   55   2HG1  ILE   6          1HG1      ILE   6   6.502  -4.774  -6.602
   56   1HG2  ILE   6          1HG2      ILE   6   6.239  -1.709  -8.380
   57   2HG2  ILE   6          2HG2      ILE   6   5.318  -1.039  -7.033
   58   3HG2  ILE   6          3HG2      ILE   6   4.480  -1.618  -8.472
   59   1HD1  ILE   6          1HD1      ILE   6   6.954  -4.731  -8.910
   60   2HD1  ILE   6          2HD1      ILE   6   8.408  -4.124  -8.118
   61   3HD1  ILE   6          3HD1      ILE   6   7.289  -3.000  -8.890
   62    H    LEU   7           H        LEU   7   3.855  -0.972  -4.632
   63    HA   LEU   7           HA       LEU   7   1.123  -0.919  -5.703
   64   1HB   LEU   7          2HB       LEU   7   2.164   0.879  -3.534
   65   2HB   LEU   7          1HB       LEU   7   0.513   0.373  -3.840
   66    HG   LEU   7           HG       LEU   7   2.728  -1.303  -2.679
   67   1HD1  LEU   7          1HD1      LEU   7   0.178  -0.157  -1.571
   68   2HD1  LEU   7          2HD1      LEU   7   1.831   0.156  -1.042
   69   3HD1  LEU   7          3HD1      LEU   7   1.102  -1.425  -0.769
   70   1HD2  LEU   7          1HD2      LEU   7   1.014  -3.068  -2.487
   71   2HD2  LEU   7          2HD2      LEU   7   1.419  -2.685  -4.160
   72   3HD2  LEU   7          3HD2      LEU   7  -0.080  -2.080  -3.455
   73    H    ASN   8           H        ASN   8   1.585  -0.099  -7.759
   74    HA   ASN   8           HA       ASN   8   2.902   2.498  -7.947
   75   1HB   ASN   8          2HB       ASN   8   2.031   0.500 -10.029
   76   2HB   ASN   8          1HB       ASN   8   2.638   2.097 -10.444
   77   1HD2  ASN   8          1HD2      ASN   8   4.270   1.305  -7.734
   78   2HD2  ASN   8          2HD2      ASN   8   5.658   0.563  -8.433
   79    H    GLY   9           H        GLY   9   1.572   4.174  -7.498
   80   1HA   GLY   9          2HA       GLY   9  -1.110   4.146  -8.733
   81   2HA   GLY   9          1HA       GLY   9  -0.687   5.056  -7.292
   82    H    LYS  10           H        LYS  10  -1.800   6.724  -8.708
   83    HA   LYS  10           HA       LYS  10  -0.355   7.772 -10.937
   84   1HB   LYS  10          2HB       LYS  10  -2.545   9.016  -9.268
   85   2HB   LYS  10          1HB       LYS  10  -1.947   9.656 -10.792
   86   1HG   LYS  10          2HG       LYS  10  -2.700   7.632 -11.938
   87   2HG   LYS  10          1HG       LYS  10  -3.304   6.995 -10.408
   88   1HD   LYS  10          2HD       LYS  10  -4.851   8.884 -10.232
   89   2HD   LYS  10          1HD       LYS  10  -4.240   9.527 -11.758
   90   1HE   LYS  10          2HE       LYS  10  -5.624   6.873 -11.382
   91   2HE   LYS  10          1HE       LYS  10  -6.347   8.325 -12.073
   92   1HZ   LYS  10          1HZ       LYS  10  -5.617   6.789 -13.789
   93   2HZ   LYS  10          2HZ       LYS  10  -4.031   6.849 -13.206
   94   3HZ   LYS  10          3HZ       LYS  10  -4.740   8.233 -13.870
   95    H    THR  11           H        THR  11  -0.920   9.036  -7.635
   96    HA   THR  11           HA       THR  11   1.472  10.708  -7.953
   97    HB   THR  11           HB       THR  11   0.348  11.928  -5.957
   98    HG1  THR  11           1HG      THR  11  -1.922  11.693  -5.977
   99   1HG2  THR  11          1HG2      THR  11  -0.396  13.490  -7.371
  100   2HG2  THR  11          2HG2      THR  11  -1.427  12.350  -8.238
  101   3HG2  THR  11          3HG2      THR  11   0.294  12.446  -8.614
  102    H    LEU  12           H        LEU  12   0.894   7.821  -6.862
  103    HA   LEU  12           HA       LEU  12   2.631   8.148  -4.534
  104   1HB   LEU  12          2HB       LEU  12   0.380   7.994  -3.664
  105   2HB   LEU  12          1HB       LEU  12   0.076   6.556  -4.613
  106    HG   LEU  12           HG       LEU  12   1.562   5.261  -3.263
  107   1HD1  LEU  12          1HD1      LEU  12   2.606   7.872  -2.585
  108   2HD1  LEU  12          2HD1      LEU  12   3.374   6.294  -2.490
  109   3HD1  LEU  12          3HD1      LEU  12   2.358   6.863  -1.163
  110   1HD2  LEU  12          1HD2      LEU  12   0.375   6.606  -0.994
  111   2HD2  LEU  12          2HD2      LEU  12   0.047   5.006  -1.658
  112   3HD2  LEU  12          3HD2      LEU  12  -0.771   6.420  -2.322
  113    H    LYS  13           H        LYS  13   4.150   6.604  -4.289
  114    HA   LYS  13           HA       LYS  13   4.020   4.176  -5.925
  115   1HB   LYS  13          2HB       LYS  13   6.376   6.076  -5.910
  116   2HB   LYS  13          1HB       LYS  13   6.342   4.503  -6.694
  117   1HG   LYS  13          2HG       LYS  13   4.560   6.824  -7.398
  118   2HG   LYS  13          1HG       LYS  13   6.027   6.365  -8.263
  119   1HD   LYS  13          2HD       LYS  13   5.035   4.185  -8.780
  120   2HD   LYS  13          1HD       LYS  13   3.568   4.648  -7.916
  121   1HE   LYS  13          2HE       LYS  13   3.274   4.936 -10.312
  122   2HE   LYS  13          1HE       LYS  13   3.231   6.495  -9.488
  123   1HZ   LYS  13          1HZ       LYS  13   5.537   6.850 -10.137
  124   2HZ   LYS  13          2HZ       LYS  13   4.558   6.612 -11.493
  125   3HZ   LYS  13          3HZ       LYS  13   5.560   5.365 -10.945
  126    H    GLY  14           H        GLY  14   5.002   2.406  -4.974
  127   1HA   GLY  14          2HA       GLY  14   6.948   2.621  -2.918
  128   2HA   GLY  14          1HA       GLY  14   5.355   2.395  -2.217
  129    H    GLU  15           H        GLU  15   6.801   0.507  -1.450
  130    HA   GLU  15           HA       GLU  15   6.035  -1.803  -3.058
  131   1HB   GLU  15          2HB       GLU  15   8.839  -1.382  -1.999
  132   2HB   GLU  15          1HB       GLU  15   8.244  -2.868  -2.720
  133   1HG   GLU  15          2HG       GLU  15   9.452  -1.819  -4.414
  134   2HG   GLU  15          1HG       GLU  15   7.765  -1.494  -4.797
  135    H    THR  16           H        THR  16   5.500  -3.573  -1.873
  136    HA   THR  16           HA       THR  16   5.962  -3.514   1.012
  137    HB   THR  16           HB       THR  16   3.816  -2.648   1.054
  138    HG1  THR  16           1HG      THR  16   3.276  -5.403   0.906
  139   1HG2  THR  16          1HG2      THR  16   2.090  -4.108  -0.510
  140   2HG2  THR  16          2HG2      THR  16   3.506  -3.898  -1.536
  141   3HG2  THR  16          3HG2      THR  16   2.702  -2.491  -0.855
  142    H    THR  17           H        THR  17   5.282  -5.673   2.035
  143    HA   THR  17           HA       THR  17   5.544  -7.914   0.175
  144    HB   THR  17           HB       THR  17   7.338  -8.923   1.525
  145    HG1  THR  17           1HG      THR  17   8.402  -7.603   3.047
  146   1HG2  THR  17          1HG2      THR  17   9.133  -7.721   0.672
  147   2HG2  THR  17          2HG2      THR  17   8.265  -6.187   0.755
  148   3HG2  THR  17          3HG2      THR  17   7.813  -7.393  -0.450
  149    H    THR  18           H        THR  18   4.086  -9.387   0.622
  150    HA   THR  18           HA       THR  18   3.026  -9.632   3.371
  151    HB   THR  18           HB       THR  18   1.373  -9.102   1.609
  152    HG1  THR  18           1HG      THR  18   0.846 -10.477   3.427
  153   1HG2  THR  18          1HG2      THR  18   1.028 -11.568   0.337
  154   2HG2  THR  18          2HG2      THR  18   2.730 -11.146   0.144
  155   3HG2  THR  18          3HG2      THR  18   1.476 -10.026  -0.392
  156    H    GLU  19           H        GLU  19   3.047 -11.595   4.407
  157    HA   GLU  19           HA       GLU  19   4.704 -13.686   3.176
  158   1HB   GLU  19          2HB       GLU  19   5.473 -12.850   5.343
  159   2HB   GLU  19          1HB       GLU  19   3.914 -13.229   6.062
  160   1HG   GLU  19          2HG       GLU  19   5.547 -14.897   6.665
  161   2HG   GLU  19          1HG       GLU  19   4.300 -15.605   5.641
  162    H    ALA  20           H        ALA  20   3.544 -15.250   2.166
  163    HA   ALA  20           HA       ALA  20   1.320 -16.445   3.614
  164   1HB   ALA  20          1HB       ALA  20   0.644 -14.534   1.926
  165   2HB   ALA  20          2HB       ALA  20  -0.325 -15.996   2.109
  166   3HB   ALA  20          3HB       ALA  20   0.797 -15.843   0.756
  167    H    VAL  21           H        VAL  21   0.773 -18.506   2.965
  168    HA   VAL  21           HA       VAL  21   2.790 -20.249   2.310
  169    HB   VAL  21           HB       VAL  21  -0.109 -20.764   1.660
  170   1HG1  VAL  21          1HG1      VAL  21   2.106 -22.629   2.500
  171   2HG1  VAL  21          2HG1      VAL  21   1.474 -22.454   0.863
  172   3HG1  VAL  21          3HG1      VAL  21   0.439 -23.083   2.145
  173   1HG2  VAL  21          1HG2      VAL  21  -0.009 -21.764   4.066
  174   2HG2  VAL  21          2HG2      VAL  21  -0.292 -20.036   3.838
  175   3HG2  VAL  21          3HG2      VAL  21   1.315 -20.618   4.280
  176    H    ASP  22           H        ASP  22   0.540 -18.675   0.106
  177    HA   ASP  22           HA       ASP  22   2.289 -19.412  -2.110
  178   1HB   ASP  22          2HB       ASP  22   0.478 -20.198  -3.527
  179   2HB   ASP  22          1HB       ASP  22   0.554 -21.164  -2.058
  180    H    ALA  23           H        ALA  23   1.532 -18.290  -4.193
  181    HA   ALA  23           HA       ALA  23   1.603 -15.543  -3.785
  182   1HB   ALA  23          1HB       ALA  23   1.282 -17.331  -6.084
  183   2HB   ALA  23          2HB       ALA  23   2.301 -15.904  -5.888
  184   3HB   ALA  23          3HB       ALA  23   0.597 -15.720  -6.304
  185    H    ALA  24           H        ALA  24  -1.164 -17.636  -4.467
  186    HA   ALA  24           HA       ALA  24  -3.065 -15.566  -4.730
  187   1HB   ALA  24          1HB       ALA  24  -3.148 -18.254  -5.072
  188   2HB   ALA  24          2HB       ALA  24  -4.578 -17.226  -4.980
  189   3HB   ALA  24          3HB       ALA  24  -4.021 -18.094  -3.549
  190    H    THR  25           H        THR  25  -2.290 -17.647  -1.924
  191    HA   THR  25           HA       THR  25  -3.946 -16.444  -0.067
  192    HB   THR  25           HB       THR  25  -2.324 -17.266   1.622
  193    HG1  THR  25           1HG      THR  25  -0.355 -17.699   1.125
  194   1HG2  THR  25          1HG2      THR  25  -3.229 -19.025  -0.576
  195   2HG2  THR  25          2HG2      THR  25  -3.639 -19.048   1.139
  196   3HG2  THR  25          3HG2      THR  25  -2.082 -19.675   0.596
  197    H    ALA  26           H        ALA  26  -0.644 -15.619  -1.038
  198    HA   ALA  26           HA       ALA  26  -0.288 -13.428   0.687
  199   1HB   ALA  26          1HB       ALA  26   1.110 -12.816  -1.650
  200   2HB   ALA  26          2HB       ALA  26   1.080 -14.578  -1.587
  201   3HB   ALA  26          3HB       ALA  26   1.735 -13.659  -0.233
  202    H    GLU  27           H        GLU  27  -1.385 -13.567  -2.713
  203    HA   GLU  27           HA       GLU  27  -1.903 -10.895  -3.113
  204   1HB   GLU  27          2HB       GLU  27  -1.992 -12.570  -4.891
  205   2HB   GLU  27          1HB       GLU  27  -3.438 -13.268  -4.173
  206   1HG   GLU  27          2HG       GLU  27  -4.652 -11.191  -4.588
  207   2HG   GLU  27          1HG       GLU  27  -3.203 -10.489  -5.305
  208    H    LYS  28           H        LYS  28  -4.097 -13.389  -1.824
  209    HA   LYS  28           HA       LYS  28  -6.348 -11.776  -1.484
  210   1HB   LYS  28          2HB       LYS  28  -5.434 -14.162   0.131
  211   2HB   LYS  28          1HB       LYS  28  -7.040 -13.451   0.225
  212   1HG   LYS  28          2HG       LYS  28  -5.798 -14.729  -2.202
  213   2HG   LYS  28          1HG       LYS  28  -7.059 -15.419  -1.179
  214   1HD   LYS  28          2HD       LYS  28  -8.552 -13.578  -1.785
  215   2HD   LYS  28          1HD       LYS  28  -7.291 -12.891  -2.808
  216   1HE   LYS  28          2HE       LYS  28  -8.920 -14.148  -4.127
  217   2HE   LYS  28          1HE       LYS  28  -7.320 -14.888  -4.205
  218   1HZ   LYS  28          1HZ       LYS  28  -9.527 -15.790  -2.433
  219   2HZ   LYS  28          2HZ       LYS  28  -8.014 -16.527  -2.600
  220   3HZ   LYS  28          3HZ       LYS  28  -9.099 -16.521  -3.899
  221    H    VAL  29           H        VAL  29  -3.578 -12.330   0.620
  222    HA   VAL  29           HA       VAL  29  -4.498 -11.053   2.919
  223    HB   VAL  29           HB       VAL  29  -1.682 -11.201   1.827
  224   1HG1  VAL  29          1HG1      VAL  29  -1.087 -10.895   4.288
  225   2HG1  VAL  29          2HG1      VAL  29  -2.731 -10.284   4.485
  226   3HG1  VAL  29          3HG1      VAL  29  -1.608  -9.464   3.399
  227   1HG2  VAL  29          1HG2      VAL  29  -2.479 -12.833   4.135
  228   2HG2  VAL  29          2HG2      VAL  29  -1.495 -13.250   2.732
  229   3HG2  VAL  29          3HG2      VAL  29  -3.255 -13.259   2.611
  230    H    VAL  30           H        VAL  30  -2.983  -9.742   0.023
  231    HA   VAL  30           HA       VAL  30  -2.676  -7.096   0.966
  232    HB   VAL  30           HB       VAL  30  -3.211  -7.848  -1.904
  233   1HG1  VAL  30          1HG1      VAL  30  -1.295  -5.772  -0.924
  234   2HG1  VAL  30          2HG1      VAL  30  -3.020  -5.420  -1.030
  235   3HG1  VAL  30          3HG1      VAL  30  -2.125  -5.883  -2.477
  236   1HG2  VAL  30          1HG2      VAL  30  -0.508  -7.814  -1.739
  237   2HG2  VAL  30          2HG2      VAL  30  -1.487  -9.280  -1.688
  238   3HG2  VAL  30          3HG2      VAL  30  -0.928  -8.540  -0.187
  239    H    LYS  31           H        LYS  31  -5.283  -8.700  -0.896
  240    HA   LYS  31           HA       LYS  31  -6.992  -6.594  -1.311
  241   1HB   LYS  31          2HB       LYS  31  -7.518  -9.487  -0.721
  242   2HB   LYS  31          1HB       LYS  31  -8.859  -8.364  -0.899
  243   1HG   LYS  31          2HG       LYS  31  -8.360  -9.574  -2.969
  244   2HG   LYS  31          1HG       LYS  31  -8.168  -7.831  -3.149
  245   1HD   LYS  31          2HD       LYS  31  -5.736  -8.101  -2.846
  246   2HD   LYS  31          1HD       LYS  31  -5.964  -9.846  -2.752
  247   1HE   LYS  31          2HE       LYS  31  -5.253  -9.029  -4.998
  248   2HE   LYS  31          1HE       LYS  31  -6.764  -9.939  -5.001
  249   1HZ   LYS  31          1HZ       LYS  31  -6.523  -7.656  -6.252
  250   2HZ   LYS  31          2HZ       LYS  31  -6.924  -7.033  -4.733
  251   3HZ   LYS  31          3HZ       LYS  31  -7.976  -8.104  -5.510
  252    H    GLN  32           H        GLN  32  -6.707  -8.582   1.600
  253    HA   GLN  32           HA       GLN  32  -8.710  -7.157   3.056
  254   1HB   GLN  32          2HB       GLN  32  -7.950  -9.474   3.619
  255   2HB   GLN  32          1HB       GLN  32  -6.411  -8.803   4.137
  256   1HG   GLN  32          2HG       GLN  32  -7.762  -9.213   6.060
  257   2HG   GLN  32          1HG       GLN  32  -7.594  -7.475   5.840
  258   1HE2  GLN  32          1HE2      GLN  32  -9.716  -8.732   3.546
  259   2HE2  GLN  32          2HE2      GLN  32 -11.194  -8.377   4.356
  260    H    PHE  33           H        PHE  33  -5.242  -6.950   2.694
  261    HA   PHE  33           HA       PHE  33  -4.578  -5.126   4.671
  262   1HB   PHE  33          2HB       PHE  33  -2.999  -6.402   3.209
  263   2HB   PHE  33          1HB       PHE  33  -3.387  -5.303   1.892
  264    HD1  PHE  33           1HD      PHE  33  -1.894  -5.519   5.252
  265    HD2  PHE  33           2HD      PHE  33  -2.291  -3.216   1.683
  266    HE1  PHE  33           1HE      PHE  33  -0.104  -4.016   6.014
  267    HE2  PHE  33           2HE      PHE  33  -0.499  -1.716   2.455
  268    HZ   PHE  33           HZ       PHE  33   0.592  -2.123   4.627
  269    H    PHE  34           H        PHE  34  -5.423  -4.457   1.287
  270    HA   PHE  34           HA       PHE  34  -5.534  -1.614   1.725
  271   1HB   PHE  34          2HB       PHE  34  -6.324  -3.286  -0.656
  272   2HB   PHE  34          1HB       PHE  34  -6.351  -1.522  -0.627
  273    HD1  PHE  34           1HD      PHE  34  -3.939  -0.934   0.920
  274    HD2  PHE  34           2HD      PHE  34  -4.601  -3.802  -2.154
  275    HE1  PHE  34           1HE      PHE  34  -1.548  -0.893   0.379
  276    HE2  PHE  34           2HE      PHE  34  -2.201  -3.762  -2.704
  277    HZ   PHE  34           HZ       PHE  34  -0.681  -2.309  -1.422
  278    H    ASN  35           H        ASN  35  -7.902  -4.192   1.380
  279    HA   ASN  35           HA       ASN  35 -10.244  -2.745   1.223
  280   1HB   ASN  35          2HB       ASN  35 -10.236  -5.169   1.113
  281   2HB   ASN  35          1HB       ASN  35  -9.668  -5.278   2.777
  282   1HD2  ASN  35          1HD2      ASN  35 -12.264  -5.670   0.923
  283   2HD2  ASN  35          2HD2      ASN  35 -13.521  -5.341   2.059
  284    H    ASP  36           H        ASP  36  -8.225  -3.432   3.982
  285    HA   ASP  36           HA       ASP  36 -10.002  -1.975   5.781
  286   1HB   ASP  36          2HB       ASP  36  -7.470  -3.524   6.365
  287   2HB   ASP  36          1HB       ASP  36  -8.500  -2.771   7.579
  288    H    ASN  37           H        ASN  37  -6.990  -1.465   4.087
  289    HA   ASN  37           HA       ASN  37  -6.166   0.704   5.807
  290   1HB   ASN  37          2HB       ASN  37  -5.216  -0.187   3.076
  291   2HB   ASN  37          1HB       ASN  37  -4.565   1.223   3.902
  292   1HD2  ASN  37          1HD2      ASN  37  -3.464  -1.475   3.082
  293   2HD2  ASN  37          2HD2      ASN  37  -2.702  -2.064   4.518
  294    H    GLY  38           H        GLY  38  -7.616   0.323   2.634
  295   1HA   GLY  38          2HA       GLY  38  -8.071   2.312   1.242
  296   2HA   GLY  38          1HA       GLY  38  -9.509   1.701   2.024
  297    H    VAL  39           H        VAL  39 -10.746   3.238   2.724
  298    HA   VAL  39           HA       VAL  39  -9.540   5.793   3.563
  299    HB   VAL  39           HB       VAL  39 -12.345   5.256   2.648
  300   1HG1  VAL  39          1HG1      VAL  39 -10.878   7.685   3.515
  301   2HG1  VAL  39          2HG1      VAL  39 -12.574   7.251   3.725
  302   3HG1  VAL  39          3HG1      VAL  39 -12.005   7.854   2.168
  303   1HG2  VAL  39          1HG2      VAL  39  -9.858   5.709   1.156
  304   2HG2  VAL  39          2HG2      VAL  39 -11.214   6.720   0.659
  305   3HG2  VAL  39          3HG2      VAL  39 -11.371   4.963   0.643
  306    H    ASP  40           H        ASP  40 -10.729   3.152   5.140
  307    HA   ASP  40           HA       ASP  40 -11.937   4.852   7.215
  308   1HB   ASP  40          2HB       ASP  40 -12.726   2.030   6.473
  309   2HB   ASP  40          1HB       ASP  40 -13.384   2.947   7.825
  310    H    GLY  41           H        GLY  41  -9.164   3.468   6.657
  311   1HA   GLY  41          2HA       GLY  41  -8.903   1.742   8.958
  312   2HA   GLY  41          1HA       GLY  41  -7.617   2.224   7.864
  313    H    GLU  42           H        GLU  42  -6.849   2.144  10.344
  314    HA   GLU  42           HA       GLU  42  -7.170   4.793  11.559
  315   1HB   GLU  42          2HB       GLU  42  -5.798   2.309  12.611
  316   2HB   GLU  42          1HB       GLU  42  -5.996   3.814  13.498
  317   1HG   GLU  42          2HG       GLU  42  -8.422   3.544  13.418
  318   2HG   GLU  42          1HG       GLU  42  -8.223   2.035  12.528
  319    H    TRP  43           H        TRP  43  -5.867   6.222  10.544
  320    HA   TRP  43           HA       TRP  43  -3.141   5.417   9.856
  321   1HB   TRP  43          2HB       TRP  43  -4.703   7.893   9.115
  322   2HB   TRP  43          1HB       TRP  43  -3.095   7.484   8.529
  323    HD1  TRP  43           HD       TRP  43  -6.039   4.978   8.700
  324    HE1  TRP  43           1HE      TRP  43  -6.561   4.216   6.297
  325    HE3  TRP  43           3HE      TRP  43  -2.850   8.054   6.167
  326    HZ2  TRP  43           2HZ      TRP  43  -5.728   4.836   3.678
  327    HZ3  TRP  43           3HZ      TRP  43  -2.772   7.913   3.719
  328    HH2  TRP  43           HH       TRP  43  -4.189   6.336   2.497
  329    H    THR  44           H        THR  44  -1.506   5.916  11.140
  330    HA   THR  44           HA       THR  44  -1.768   8.217  12.957
  331    HB   THR  44           HB       THR  44   0.054   7.145  14.263
  332    HG1  THR  44           1HG      THR  44  -0.288   5.000  12.443
  333   1HG2  THR  44          1HG2      THR  44  -2.437   6.588  14.601
  334   2HG2  THR  44          2HG2      THR  44  -1.218   5.563  15.358
  335   3HG2  THR  44          3HG2      THR  44  -2.019   5.034  13.879
  336    H    TYR  45           H        TYR  45  -0.326   9.890  12.798
  337    HA   TYR  45           HA       TYR  45   1.675   9.667  10.648
  338   1HB   TYR  45          2HB       TYR  45  -0.157  11.312  10.284
  339   2HB   TYR  45          1HB       TYR  45   0.370  12.174  11.724
  340    HD1  TYR  45           1HD      TYR  45   2.606  10.645   9.200
  341    HD2  TYR  45           2HD      TYR  45   0.946  14.249  10.734
  342    HE1  TYR  45           1HE      TYR  45   4.181  11.945   7.831
  343    HE2  TYR  45           2HE      TYR  45   2.517  15.559   9.369
  344    HH   TYR  45           HH       TYR  45   4.630  15.322   8.252
  345    H    ASP  46           H        ASP  46   3.756  10.401  10.951
  346    HA   ASP  46           HA       ASP  46   4.490  11.133  13.708
  347   1HB   ASP  46          2HB       ASP  46   5.182   8.828  13.221
  348   2HB   ASP  46          1HB       ASP  46   6.049   9.382  11.793
  349    H    ASP  47           H        ASP  47   4.378  13.348  13.064
  350    HA   ASP  47           HA       ASP  47   5.563  14.590  10.930
  351   1HB   ASP  47          2HB       ASP  47   5.457  15.604  13.779
  352   2HB   ASP  47          1HB       ASP  47   5.742  16.600  12.355
  353    H    ALA  48           H        ALA  48   7.107  13.477  13.889
  354    HA   ALA  48           HA       ALA  48   9.568  14.707  13.703
  355   1HB   ALA  48          1HB       ALA  48  10.201  13.339  15.378
  356   2HB   ALA  48          2HB       ALA  48   9.629  11.888  14.557
  357   3HB   ALA  48          3HB       ALA  48   8.486  12.931  15.402
  358    H    THR  49           H        THR  49   8.399  11.885  11.949
  359    HA   THR  49           HA       THR  49  10.967  11.810  10.506
  360    HB   THR  49           HB       THR  49  10.447   9.449   9.987
  361    HG1  THR  49           1HG      THR  49   8.176   9.578  10.190
  362   1HG2  THR  49          1HG2      THR  49  11.192   8.573  11.947
  363   2HG2  THR  49          2HG2      THR  49  10.136   9.583  12.932
  364   3HG2  THR  49          3HG2      THR  49  11.589  10.270  12.207
  365    H    LYS  50           H        LYS  50   8.133  13.170  10.076
  366    HA   LYS  50           HA       LYS  50   6.769  13.671   8.282
  367   1HB   LYS  50          2HB       LYS  50   9.452  13.203   6.982
  368   2HB   LYS  50          1HB       LYS  50   8.061  13.783   6.084
  369   1HG   LYS  50          2HG       LYS  50   8.989  15.205   8.544
  370   2HG   LYS  50          1HG       LYS  50   9.768  15.483   6.987
  371   1HD   LYS  50          2HD       LYS  50   6.792  15.660   7.219
  372   2HD   LYS  50          1HD       LYS  50   7.796  17.010   7.746
  373   1HE   LYS  50          2HE       LYS  50   7.087  17.332   5.451
  374   2HE   LYS  50          1HE       LYS  50   8.832  17.094   5.527
  375   1HZ   LYS  50          1HZ       LYS  50   8.654  14.967   4.640
  376   2HZ   LYS  50          2HZ       LYS  50   7.546  15.865   3.733
  377   3HZ   LYS  50          3HZ       LYS  50   6.998  14.849   4.967
  378    H    THR  51           H        THR  51   6.712  10.912   9.133
  379    HA   THR  51           HA       THR  51   6.022   9.644   6.567
  380    HB   THR  51           HB       THR  51   7.212   8.287   8.989
  381    HG1  THR  51           1HG      THR  51   8.986   7.972   7.570
  382   1HG2  THR  51          1HG2      THR  51   5.757   6.752   7.844
  383   2HG2  THR  51          2HG2      THR  51   7.439   6.331   7.519
  384   3HG2  THR  51          3HG2      THR  51   6.487   7.169   6.294
  385    H    PHE  52           H        PHE  52   4.211   8.355   6.496
  386    HA   PHE  52           HA       PHE  52   2.386   8.588   8.800
  387   1HB   PHE  52          2HB       PHE  52   1.670   8.085   5.900
  388   2HB   PHE  52          1HB       PHE  52   0.550   8.390   7.222
  389    HD1  PHE  52           1HD      PHE  52  -0.370  10.478   7.310
  390    HD2  PHE  52           2HD      PHE  52   3.528  10.025   5.663
  391    HE1  PHE  52           1HE      PHE  52  -0.316  12.882   6.786
  392    HE2  PHE  52           2HE      PHE  52   3.590  12.429   5.143
  393    HZ   PHE  52           HZ       PHE  52   1.668  13.859   5.705
  394    H    THR  53           H        THR  53   1.389   6.732   9.590
  395    HA   THR  53           HA       THR  53   2.217   4.211   8.325
  396    HB   THR  53           HB       THR  53   1.918   3.285  10.742
  397    HG1  THR  53           1HG      THR  53   2.635   5.951  11.337
  398   1HG2  THR  53          1HG2      THR  53   4.039   3.021   9.933
  399   2HG2  THR  53          2HG2      THR  53   4.307   4.095  11.311
  400   3HG2  THR  53          3HG2      THR  53   4.275   4.752   9.673
  401    H    VAL  54           H        VAL  54   0.712   2.862   7.749
  402    HA   VAL  54           HA       VAL  54  -2.046   3.317   8.681
  403    HB   VAL  54           HB       VAL  54  -1.138   1.872   6.182
  404   1HG1  VAL  54          1HG1      VAL  54  -3.913   2.854   6.743
  405   2HG1  VAL  54          2HG1      VAL  54  -3.373   1.280   7.327
  406   3HG1  VAL  54          3HG1      VAL  54  -3.376   1.625   5.598
  407   1HG2  VAL  54          1HG2      VAL  54  -0.713   3.977   5.485
  408   2HG2  VAL  54          2HG2      VAL  54  -1.731   4.708   6.725
  409   3HG2  VAL  54          3HG2      VAL  54  -2.463   4.032   5.270
  410    H    THR  55           H        THR  55  -2.483   1.958  10.307
  411    HA   THR  55           HA       THR  55  -1.283  -0.709  10.252
  412    HB   THR  55           HB       THR  55  -2.810   0.430  12.578
  413    HG1  THR  55           1HG      THR  55  -0.069   0.816  11.939
  414   1HG2  THR  55          1HG2      THR  55  -0.515  -1.514  12.392
  415   2HG2  THR  55          2HG2      THR  55  -2.201  -1.923  12.722
  416   3HG2  THR  55          3HG2      THR  55  -1.285  -0.959  13.880
  417    H    GLU  56           H        GLU  56  -2.429  -2.238   9.340
  418    HA   GLU  56           HA       GLU  56  -5.189  -2.102   8.813
  419   1HB   GLU  56          2HB       GLU  56  -3.664  -3.460   7.473
  420   2HB   GLU  56          1HB       GLU  56  -3.332  -4.488   8.859
  421   1HG   GLU  56          2HG       GLU  56  -5.666  -5.216   8.880
  422   2HG   GLU  56          1HG       GLU  56  -5.992  -4.191   7.483
  423   1H    MET   1          1HT       MET   1   7.098  18.371  -3.239
  424   2H    MET   1          2HT       MET   1   6.532  19.592  -2.213
  425   3H    MET   1          3HT       MET   1   5.589  18.216  -2.487
  426    HA   MET   1           HA       MET   1   8.277  18.028  -1.286
  427   1HB   MET   1          2HB       MET   1   6.701  19.623  -0.064
  428   2HB   MET   1          1HB       MET   1   5.689  18.223   0.259
  429   1HG   MET   1          2HG       MET   1   7.383  17.198   1.574
  430   2HG   MET   1          1HG       MET   1   8.578  18.394   1.071
  431   1HE   MET   1          1HE       MET   1   8.760  17.861   3.678
  432   2HE   MET   1          2HE       MET   1   8.084  18.977   4.863
  433   3HE   MET   1          3HE       MET   1   9.255  19.553   3.678
  434    H    GLN   2           H        GLN   2   8.702  15.971  -0.479
  435    HA   GLN   2           HA       GLN   2   6.781  13.908  -1.313
  436   1HB   GLN   2          2HB       GLN   2   8.964  13.780  -2.409
  437   2HB   GLN   2          1HB       GLN   2   9.761  13.708  -0.843
  438   1HG   GLN   2          2HG       GLN   2   8.659  11.576  -0.382
  439   2HG   GLN   2          1HG       GLN   2   7.866  11.648  -1.956
  440   1HE2  GLN   2          1HE2      GLN   2   8.790  10.411  -3.410
  441   2HE2  GLN   2          2HE2      GLN   2  10.474  10.046  -3.527
  442    H    TYR   3           H        TYR   3   6.105  12.328   0.078
  443    HA   TYR   3           HA       TYR   3   7.058  12.505   2.858
  444   1HB   TYR   3          2HB       TYR   3   4.197  12.182   1.932
  445   2HB   TYR   3          1HB       TYR   3   4.732  12.045   3.602
  446    HD1  TYR   3           1HD      TYR   3   4.874  13.947   4.959
  447    HD2  TYR   3           2HD      TYR   3   4.594  14.415   0.739
  448    HE1  TYR   3           1HE      TYR   3   4.586  16.371   5.251
  449    HE2  TYR   3           2HE      TYR   3   4.309  16.840   1.020
  450    HH   TYR   3           HH       TYR   3   4.880  18.427   3.983
  451    H    LYS   4           H        LYS   4   7.075  10.574   4.038
  452    HA   LYS   4           HA       LYS   4   7.140   8.179   2.365
  453   1HB   LYS   4          2HB       LYS   4   9.105   8.657   3.762
  454   2HB   LYS   4          1HB       LYS   4   8.097   8.632   5.195
  455   1HG   LYS   4          2HG       LYS   4   9.339   6.558   4.954
  456   2HG   LYS   4          1HG       LYS   4   7.601   6.284   4.842
  457   1HD   LYS   4          2HD       LYS   4   8.591   4.964   3.149
  458   2HD   LYS   4          1HD       LYS   4   7.875   6.352   2.336
  459   1HE   LYS   4          2HE       LYS   4  10.783   6.140   3.104
  460   2HE   LYS   4          1HE       LYS   4  10.146   5.734   1.513
  461   1HZ   LYS   4          1HZ       LYS   4  10.605   7.856   1.057
  462   2HZ   LYS   4          2HZ       LYS   4  10.667   8.318   2.683
  463   3HZ   LYS   4          3HZ       LYS   4   9.176   8.209   1.891
  464    H    VAL   5           H        VAL   5   5.753   6.504   2.602
  465    HA   VAL   5           HA       VAL   5   3.767   6.702   4.768
  466    HB   VAL   5           HB       VAL   5   3.271   5.685   1.966
  467   1HG1  VAL   5          1HG1      VAL   5   1.113   6.337   3.913
  468   2HG1  VAL   5          2HG1      VAL   5   1.957   4.797   4.060
  469   3HG1  VAL   5          3HG1      VAL   5   1.111   5.199   2.567
  470   1HG2  VAL   5          1HG2      VAL   5   3.576   8.273   2.597
  471   2HG2  VAL   5          2HG2      VAL   5   1.867   8.071   2.982
  472   3HG2  VAL   5          3HG2      VAL   5   2.454   7.701   1.361
  473    H    ILE   6           H        ILE   6   3.933   5.085   6.139
  474    HA   ILE   6           HA       ILE   6   5.126   2.555   5.285
  475    HB   ILE   6           HB       ILE   6   4.614   3.725   8.018
  476   1HG1  ILE   6          2HG1      ILE   6   7.173   3.049   6.556
  477   2HG1  ILE   6          1HG1      ILE   6   6.522   4.667   6.783
  478   1HG2  ILE   6          1HG2      ILE   6   6.159   1.610   8.556
  479   2HG2  ILE   6          2HG2      ILE   6   5.241   0.963   7.198
  480   3HG2  ILE   6          3HG2      ILE   6   4.398   1.564   8.625
  481   1HD1  ILE   6          1HD1      ILE   6   6.940   4.615   9.098
  482   2HD1  ILE   6          2HD1      ILE   6   8.390   3.973   8.326
  483   3HD1  ILE   6          3HD1      ILE   6   7.234   2.876   9.081
  484    H    LEU   7           H        LEU   7   3.811   0.932   4.776
  485    HA   LEU   7           HA       LEU   7   1.065   0.945   5.806
  486   1HB   LEU   7          2HB       LEU   7   2.092  -0.879   3.653
  487   2HB   LEU   7          1HB       LEU   7   0.450  -0.332   3.937
  488    HG   LEU   7           HG       LEU   7   2.721   1.289   2.807
  489   1HD1  LEU   7          1HD1      LEU   7   0.160   0.205   1.664
  490   2HD1  LEU   7          2HD1      LEU   7   1.811  -0.147   1.158
  491   3HD1  LEU   7          3HD1      LEU   7   1.126   1.452   0.873
  492   1HD2  LEU   7          1HD2      LEU   7   1.054   3.096   2.590
  493   2HD2  LEU   7          2HD2      LEU   7   1.424   2.704   4.268
  494   3HD2  LEU   7          3HD2      LEU   7  -0.078   2.134   3.543
  495    H    ASN   8           H        ASN   8   1.478   0.114   7.871
  496    HA   ASN   8           HA       ASN   8   2.727  -2.514   8.076
  497   1HB   ASN   8          2HB       ASN   8   1.877  -0.495  10.147
  498   2HB   ASN   8          1HB       ASN   8   2.438  -2.105  10.569
  499   1HD2  ASN   8          1HD2      ASN   8   4.127  -1.354   7.881
  500   2HD2  ASN   8          2HD2      ASN   8   5.523  -0.646   8.602
  501    H    GLY   9           H        GLY   9   1.363  -4.157   7.608
  502   1HA   GLY   9          2HA       GLY   9  -1.334  -4.064   8.804
  503   2HA   GLY   9          1HA       GLY   9  -0.913  -4.984   7.370
  504    H    LYS  10           H        LYS  10  -2.085  -6.624   8.770
  505    HA   LYS  10           HA       LYS  10  -0.697  -7.707  11.018
  506   1HB   LYS  10          2HB       LYS  10  -2.895  -8.898   9.318
  507   2HB   LYS  10          1HB       LYS  10  -2.334  -9.550  10.851
  508   1HG   LYS  10          2HG       LYS  10  -3.054  -7.509  11.986
  509   2HG   LYS  10          1HG       LYS  10  -3.621  -6.858  10.447
  510   1HD   LYS  10          2HD       LYS  10  -5.209  -8.709  10.251
  511   2HD   LYS  10          1HD       LYS  10  -4.635  -9.367  11.784
  512   1HE   LYS  10          2HE       LYS  10  -5.950  -6.679  11.391
  513   2HE   LYS  10          1HE       LYS  10  -6.717  -8.114  12.070
  514   1HZ   LYS  10          1HZ       LYS  10  -5.975  -6.595  13.797
  515   2HZ   LYS  10          2HZ       LYS  10  -4.383  -6.695  13.236
  516   3HZ   LYS  10          3HZ       LYS  10  -5.134  -8.060  13.891
  517    H    THR  11           H        THR  11  -1.247  -8.958   7.710
  518    HA   THR  11           HA       THR  11   1.099 -10.687   8.061
  519    HB   THR  11           HB       THR  11  -0.025 -11.880   6.049
  520    HG1  THR  11           1HG      THR  11  -2.290 -11.588   6.036
  521   1HG2  THR  11          1HG2      THR  11  -0.828 -13.421   7.452
  522   2HG2  THR  11          2HG2      THR  11  -1.842 -12.258   8.304
  523   3HG2  THR  11          3HG2      THR  11  -0.130 -12.396   8.706
  524    H    LEU  12           H        LEU  12   0.606  -7.786   6.961
  525    HA   LEU  12           HA       LEU  12   2.367  -8.157   4.659
  526   1HB   LEU  12          2HB       LEU  12   0.133  -7.948   3.756
  527   2HB   LEU  12          1HB       LEU  12  -0.148  -6.502   4.701
  528    HG   LEU  12           HG       LEU  12   1.388  -5.244   3.371
  529   1HD1  LEU  12          1HD1      LEU  12   2.378  -7.880   2.709
  530   2HD1  LEU  12          2HD1      LEU  12   3.186  -6.321   2.625
  531   3HD1  LEU  12          3HD1      LEU  12   2.174  -6.866   1.285
  532   1HD2  LEU  12          1HD2      LEU  12   0.199  -6.561   1.089
  533   2HD2  LEU  12          2HD2      LEU  12  -0.098  -4.953   1.747
  534   3HD2  LEU  12          3HD2      LEU  12  -0.959  -6.346   2.400
  535    H    LYS  13           H        LYS  13   3.928  -6.650   4.434
  536    HA   LYS  13           HA       LYS  13   3.834  -4.218   6.070
  537   1HB   LYS  13          2HB       LYS  13   6.143  -6.175   6.087
  538   2HB   LYS  13          1HB       LYS  13   6.135  -4.601   6.871
  539   1HG   LYS  13          2HG       LYS  13   4.288  -6.878   7.550
  540   2HG   LYS  13          1HG       LYS  13   5.754  -6.455   8.436
  541   1HD   LYS  13          2HD       LYS  13   4.808  -4.253   8.939
  542   2HD   LYS  13          1HD       LYS  13   3.342  -4.680   8.054
  543   1HE   LYS  13          2HE       LYS  13   3.006  -4.959  10.445
  544   2HE   LYS  13          1HE       LYS  13   2.938  -6.517   9.622
  545   1HZ   LYS  13          1HZ       LYS  13   5.225  -6.929  10.302
  546   2HZ   LYS  13          2HZ       LYS  13   4.232  -6.665  11.644
  547   3HZ   LYS  13          3HZ       LYS  13   5.272  -5.444  11.111
  548    H    GLY  14           H        GLY  14   4.872  -2.473   5.132
  549   1HA   GLY  14          2HA       GLY  14   6.839  -2.735   3.105
  550   2HA   GLY  14          1HA       GLY  14   5.264  -2.471   2.381
  551    H    GLU  15           H        GLU  15   6.766  -0.620   1.637
  552    HA   GLU  15           HA       GLU  15   6.034   1.709   3.232
  553   1HB   GLU  15          2HB       GLU  15   8.842   1.219   2.213
  554   2HB   GLU  15          1HB       GLU  15   8.272   2.721   2.925
  555   1HG   GLU  15          2HG       GLU  15   9.430   1.643   4.636
  556   2HG   GLU  15          1HG       GLU  15   7.730   1.358   4.996
  557    H    THR  16           H        THR  16   5.557   3.491   2.040
  558    HA   THR  16           HA       THR  16   6.059   3.421  -0.837
  559    HB   THR  16           HB       THR  16   3.893   2.608  -0.909
  560    HG1  THR  16           1HG      THR  16   3.420   5.374  -0.770
  561   1HG2  THR  16          1HG2      THR  16   2.182   4.108   0.629
  562   2HG2  THR  16          2HG2      THR  16   3.579   3.865   1.676
  563   3HG2  THR  16          3HG2      THR  16   2.749   2.477   0.982
  564    H    THR  17           H        THR  17   5.446   5.596  -1.871
  565    HA   THR  17           HA       THR  17   5.735   7.829  -0.005
  566    HB   THR  17           HB       THR  17   7.574   8.794  -1.330
  567    HG1  THR  17           1HG      THR  17   8.626   7.449  -2.837
  568   1HG2  THR  17          1HG2      THR  17   9.326   7.549  -0.452
  569   2HG2  THR  17          2HG2      THR  17   8.423   6.037  -0.548
  570   3HG2  THR  17          3HG2      THR  17   7.984   7.254   0.651
  571    H    THR  18           H        THR  18   4.322   9.337  -0.474
  572    HA   THR  18           HA       THR  18   3.307   9.607  -3.237
  573    HB   THR  18           HB       THR  18   1.616   9.117  -1.499
  574    HG1  THR  18           1HG      THR  18   1.148  10.504  -3.323
  575   1HG2  THR  18          1HG2      THR  18   1.314  11.592  -0.232
  576   2HG2  THR  18          2HG2      THR  18   3.002  11.128  -0.015
  577   3HG2  THR  18          3HG2      THR  18   1.714  10.040   0.503
  578    H    GLU  19           H        GLU  19   3.391  11.568  -4.272
  579    HA   GLU  19           HA       GLU  19   5.080  13.619  -3.017
  580   1HB   GLU  19          2HB       GLU  19   5.858  12.763  -5.175
  581   2HB   GLU  19          1HB       GLU  19   4.319  13.181  -5.915
  582   1HG   GLU  19          2HG       GLU  19   6.001  14.808  -6.494
  583   2HG   GLU  19          1HG       GLU  19   4.759  15.547  -5.487
  584    H    ALA  20           H        ALA  20   3.943  15.211  -2.024
  585    HA   ALA  20           HA       ALA  20   1.770  16.461  -3.504
  586   1HB   ALA  20          1HB       ALA  20   1.025  14.567  -1.826
  587   2HB   ALA  20          2HB       ALA  20   0.094  16.051  -2.022
  588   3HB   ALA  20          3HB       ALA  20   1.194  15.873  -0.653
  589    H    VAL  21           H        VAL  21   1.265  18.534  -2.861
  590    HA   VAL  21           HA       VAL  21   3.314  20.227  -2.179
  591    HB   VAL  21           HB       VAL  21   0.419  20.812  -1.568
  592   1HG1  VAL  21          1HG1      VAL  21   2.690  22.623  -2.377
  593   2HG1  VAL  21          2HG1      VAL  21   2.031  22.464  -0.748
  594   3HG1  VAL  21          3HG1      VAL  21   1.031  23.118  -2.046
  595   1HG2  VAL  21          1HG2      VAL  21   0.577  21.808  -3.972
  596   2HG2  VAL  21          2HG2      VAL  21   0.250  20.089  -3.748
  597   3HG2  VAL  21          3HG2      VAL  21   1.876  20.632  -4.168
  598    H    ASP  22           H        ASP  22   0.994  18.709  -0.006
  599    HA   ASP  22           HA       ASP  22   2.732  19.403   2.235
  600   1HB   ASP  22          2HB       ASP  22   0.919  20.234   3.627
  601   2HB   ASP  22          1HB       ASP  22   1.039  21.197   2.159
  602    H    ALA  23           H        ALA  23   1.917  18.300   4.308
  603    HA   ALA  23           HA       ALA  23   1.928  15.552   3.899
  604   1HB   ALA  23          1HB       ALA  23   1.617  17.347   6.194
  605   2HB   ALA  23          2HB       ALA  23   2.603  15.897   6.012
  606   3HB   ALA  23          3HB       ALA  23   0.890  15.756   6.403
  607    H    ALA  24           H        ALA  24  -0.798  17.712   4.542
  608    HA   ALA  24           HA       ALA  24  -2.752  15.690   4.778
  609   1HB   ALA  24          1HB       ALA  24  -2.775  18.379   5.120
  610   2HB   ALA  24          2HB       ALA  24  -4.228  17.385   5.007
  611   3HB   ALA  24          3HB       ALA  24  -3.630  18.239   3.584
  612    H    THR  25           H        THR  25  -1.888  17.751   1.984
  613    HA   THR  25           HA       THR  25  -3.547  16.589   0.103
  614    HB   THR  25           HB       THR  25  -1.880  17.370  -1.562
  615    HG1  THR  25           1HG      THR  25   0.091  17.755  -1.036
  616   1HG2  THR  25          1HG2      THR  25  -2.773  19.149   0.624
  617   2HG2  THR  25          2HG2      THR  25  -3.159  19.182  -1.098
  618   3HG2  THR  25          3HG2      THR  25  -1.595  19.772  -0.533
  619    H    ALA  26           H        ALA  26  -0.278  15.683   1.121
  620    HA   ALA  26           HA       ALA  26   0.050  13.484  -0.600
  621   1HB   ALA  26          1HB       ALA  26   1.397  12.838   1.758
  622   2HB   ALA  26          2HB       ALA  26   1.410  14.601   1.694
  623   3HB   ALA  26          3HB       ALA  26   2.063  13.664   0.349
  624    H    GLU  27           H        GLU  27  -1.093  13.650   2.785
  625    HA   GLU  27           HA       GLU  27  -1.681  10.991   3.177
  626   1HB   GLU  27          2HB       GLU  27  -1.756  12.668   4.954
  627   2HB   GLU  27          1HB       GLU  27  -3.174  13.401   4.216
  628   1HG   GLU  27          2HG       GLU  27  -4.443  11.356   4.614
  629   2HG   GLU  27          1HG       GLU  27  -3.021  10.618   5.350
  630    H    LYS  28           H        LYS  28  -3.795  13.538   1.857
  631    HA   LYS  28           HA       LYS  28  -6.080  11.980   1.485
  632   1HB   LYS  28          2HB       LYS  28  -5.085  14.344  -0.117
  633   2HB   LYS  28          1HB       LYS  28  -6.707  13.671  -0.233
  634   1HG   LYS  28          2HG       LYS  28  -5.468  14.918   2.212
  635   2HG   LYS  28          1HG       LYS  28  -6.697  15.640   1.172
  636   1HD   LYS  28          2HD       LYS  28  -8.245  13.835   1.755
  637   2HD   LYS  28          1HD       LYS  28  -7.015  13.117   2.797
  638   1HE   LYS  28          2HE       LYS  28  -8.630  14.414   4.093
  639   2HE   LYS  28          1HE       LYS  28  -7.016  15.115   4.193
  640   1HZ   LYS  28          1HZ       LYS  28  -9.174  16.070   2.390
  641   2HZ   LYS  28          2HZ       LYS  28  -7.646  16.770   2.579
  642   3HZ   LYS  28          3HZ       LYS  28  -8.749  16.791   3.861
  643    H    VAL  29           H        VAL  29  -3.267  12.467  -0.579
  644    HA   VAL  29           HA       VAL  29  -4.186  11.211  -2.890
  645    HB   VAL  29           HB       VAL  29  -1.384  11.290  -1.759
  646   1HG1  VAL  29          1HG1      VAL  29  -0.762  10.970  -4.211
  647   2HG1  VAL  29          2HG1      VAL  29  -2.416  10.399  -4.433
  648   3HG1  VAL  29          3HG1      VAL  29  -1.330   9.552  -3.330
  649   1HG2  VAL  29          1HG2      VAL  29  -2.107  12.942  -4.078
  650   2HG2  VAL  29          2HG2      VAL  29  -1.136  13.335  -2.661
  651   3HG2  VAL  29          3HG2      VAL  29  -2.895  13.387  -2.565
  652    H    VAL  30           H        VAL  30  -2.746   9.864   0.025
  653    HA   VAL  30           HA       VAL  30  -2.488   7.211  -0.913
  654    HB   VAL  30           HB       VAL  30  -3.047   7.976   1.948
  655   1HG1  VAL  30          1HG1      VAL  30  -1.167   5.854   0.995
  656   2HG1  VAL  30          2HG1      VAL  30  -2.901   5.543   1.078
  657   3HG1  VAL  30          3HG1      VAL  30  -2.015   5.986   2.537
  658   1HG2  VAL  30          1HG2      VAL  30  -0.342   7.878   1.823
  659   2HG2  VAL  30          2HG2      VAL  30  -1.286   9.366   1.757
  660   3HG2  VAL  30          3HG2      VAL  30  -0.723   8.613   0.266
  661    H    LYS  31           H        LYS  31  -5.082   8.879   0.912
  662    HA   LYS  31           HA       LYS  31  -6.848   6.815   1.302
  663   1HB   LYS  31          2HB       LYS  31  -7.295   9.719   0.706
  664   2HB   LYS  31          1HB       LYS  31  -8.665   8.631   0.865
  665   1HG   LYS  31          2HG       LYS  31  -8.166   9.829   2.943
  666   2HG   LYS  31          1HG       LYS  31  -8.020   8.080   3.124
  667   1HD   LYS  31          2HD       LYS  31  -5.577   8.291   2.855
  668   2HD   LYS  31          1HD       LYS  31  -5.762  10.041   2.757
  669   1HE   LYS  31          2HE       LYS  31  -5.103   9.207   5.014
  670   2HE   LYS  31          1HE       LYS  31  -6.591  10.154   4.995
  671   1HZ   LYS  31          1HZ       LYS  31  -6.423   7.866   6.250
  672   2HZ   LYS  31          2HZ       LYS  31  -6.817   7.252   4.725
  673   3HZ   LYS  31          3HZ       LYS  31  -7.853   8.349   5.487
  674    H    GLN  32           H        GLN  32  -6.473   8.794  -1.604
  675    HA   GLN  32           HA       GLN  32  -8.489   7.419  -3.089
  676   1HB   GLN  32          2HB       GLN  32  -7.665   9.716  -3.641
  677   2HB   GLN  32          1HB       GLN  32  -6.134   9.007  -4.137
  678   1HG   GLN  32          2HG       GLN  32  -7.449   9.451  -6.078
  679   2HG   GLN  32          1HG       GLN  32  -7.326   7.709  -5.856
  680   1HE2  GLN  32          1HE2      GLN  32  -9.450   9.018  -3.591
  681   2HE2  GLN  32          2HE2      GLN  32 -10.925   8.698  -4.423
  682    H    PHE  33           H        PHE  33  -5.033   7.127  -2.678
  683    HA   PHE  33           HA       PHE  33  -4.387   5.287  -4.646
  684   1HB   PHE  33          2HB       PHE  33  -2.796   6.525  -3.161
  685   2HB   PHE  33          1HB       PHE  33  -3.230   5.436  -1.850
  686    HD1  PHE  33           1HD      PHE  33  -1.684   5.615  -5.188
  687    HD2  PHE  33           2HD      PHE  33  -2.188   3.323  -1.626
  688    HE1  PHE  33           1HE      PHE  33   0.079   4.069  -5.924
  689    HE2  PHE  33           2HE      PHE  33  -0.424   1.780  -2.372
  690    HZ   PHE  33           HZ       PHE  33   0.709   2.159  -4.528
  691    H    PHE  34           H        PHE  34  -5.296   4.641  -1.273
  692    HA   PHE  34           HA       PHE  34  -5.468   1.800  -1.712
  693   1HB   PHE  34          2HB       PHE  34  -6.252   3.492   0.657
  694   2HB   PHE  34          1HB       PHE  34  -6.321   1.728   0.627
  695    HD1  PHE  34           1HD      PHE  34  -3.902   1.082  -0.885
  696    HD2  PHE  34           2HD      PHE  34  -4.536   3.966   2.179
  697    HE1  PHE  34           1HE      PHE  34  -1.519   0.982  -0.311
  698    HE2  PHE  34           2HE      PHE  34  -2.146   3.866   2.762
  699    HZ   PHE  34           HZ       PHE  34  -0.645   2.378   1.501
  700    H    ASN  35           H        ASN  35  -7.777   4.435  -1.402
  701    HA   ASN  35           HA       ASN  35 -10.157   3.045  -1.277
  702   1HB   ASN  35          2HB       ASN  35 -10.091   5.468  -1.168
  703   2HB   ASN  35          1HB       ASN  35  -9.496   5.564  -2.822
  704   1HD2  ASN  35          1HD2      ASN  35 -12.108   6.017  -1.006
  705   2HD2  ASN  35          2HD2      ASN  35 -13.357   5.720  -2.158
  706    H    ASP  36           H        ASP  36  -8.081   3.683  -4.009
  707    HA   ASP  36           HA       ASP  36  -9.868   2.271  -5.832
  708   1HB   ASP  36          2HB       ASP  36  -7.292   3.755  -6.380
  709   2HB   ASP  36          1HB       ASP  36  -8.322   3.029  -7.608
  710    H    ASN  37           H        ASN  37  -6.894   1.686  -4.096
  711    HA   ASN  37           HA       ASN  37  -6.099  -0.502  -5.804
  712   1HB   ASN  37          2HB       ASN  37  -5.167   0.366  -3.059
  713   2HB   ASN  37          1HB       ASN  37  -4.537  -1.060  -3.877
  714   1HD2  ASN  37          1HD2      ASN  37  -3.384   1.611  -3.041
  715   2HD2  ASN  37          2HD2      ASN  37  -2.587   2.181  -4.466
  716    H    GLY  38           H        GLY  38  -7.584  -0.086  -2.653
  717   1HA   GLY  38          2HA       GLY  38  -8.106  -2.062  -1.267
  718   2HA   GLY  38          1HA       GLY  38  -9.520  -1.417  -2.069
  719    H    VAL  39           H        VAL  39 -10.782  -2.924  -2.787
  720    HA   VAL  39           HA       VAL  39  -9.627  -5.506  -3.611
  721    HB   VAL  39           HB       VAL  39 -12.430  -4.903  -2.733
  722   1HG1  VAL  39          1HG1      VAL  39 -11.011  -7.366  -3.580
  723   2HG1  VAL  39          2HG1      VAL  39 -12.693  -6.892  -3.814
  724   3HG1  VAL  39          3HG1      VAL  39 -12.161  -7.507  -2.250
  725   1HG2  VAL  39          1HG2      VAL  39  -9.976  -5.415  -1.207
  726   2HG2  VAL  39          2HG2      VAL  39 -11.364  -6.393  -0.730
  727   3HG2  VAL  39          3HG2      VAL  39 -11.479  -4.634  -0.715
  728    H    ASP  40           H        ASP  40 -10.729  -2.839  -5.203
  729    HA   ASP  40           HA       ASP  40 -11.948  -4.509  -7.293
  730   1HB   ASP  40          2HB       ASP  40 -12.678  -1.669  -6.563
  731   2HB   ASP  40          1HB       ASP  40 -13.339  -2.571  -7.924
  732    H    GLY  41           H        GLY  41  -9.151  -3.192  -6.696
  733   1HA   GLY  41          2HA       GLY  41  -8.815  -1.473  -8.995
  734   2HA   GLY  41          1HA       GLY  41  -7.557  -1.987  -7.882
  735    H    GLU  42           H        GLU  42  -6.752  -1.927 -10.350
  736    HA   GLU  42           HA       GLU  42  -7.121  -4.567 -11.570
  737   1HB   GLU  42          2HB       GLU  42  -5.674  -2.116 -12.602
  738   2HB   GLU  42          1HB       GLU  42  -5.896  -3.617 -13.492
  739   1HG   GLU  42          2HG       GLU  42  -8.315  -3.288 -13.446
  740   2HG   GLU  42          1HG       GLU  42  -8.092  -1.784 -12.553
  741    H    TRP  43           H        TRP  43  -5.867  -6.028 -10.537
  742    HA   TRP  43           HA       TRP  43  -3.132  -5.289  -9.810
  743   1HB   TRP  43          2HB       TRP  43  -4.763  -7.725  -9.093
  744   2HB   TRP  43          1HB       TRP  43  -3.155  -7.355  -8.483
  745    HD1  TRP  43           HD       TRP  43  -6.034  -4.777  -8.696
  746    HE1  TRP  43           1HE      TRP  43  -6.571  -4.004  -6.299
  747    HE3  TRP  43           3HE      TRP  43  -2.958  -7.930  -6.118
  748    HZ2  TRP  43           2HZ      TRP  43  -5.792  -4.643  -3.669
  749    HZ3  TRP  43           3HZ      TRP  43  -2.910  -7.791  -3.669
  750    HH2  TRP  43           HH       TRP  43  -4.306  -6.180  -2.467
  751    H    THR  44           H        THR  44  -1.491  -5.827 -11.072
  752    HA   THR  44           HA       THR  44  -1.784  -8.121 -12.893
  753    HB   THR  44           HB       THR  44   0.082  -7.095 -14.172
  754    HG1  THR  44           1HG      THR  44  -0.233  -4.940 -12.356
  755   1HG2  THR  44          1HG2      THR  44  -2.390  -6.476 -14.547
  756   2HG2  THR  44          2HG2      THR  44  -1.135  -5.482 -15.285
  757   3HG2  THR  44          3HG2      THR  44  -1.946  -4.934 -13.818
  758    H    TYR  45           H        TYR  45  -0.385  -9.828 -12.714
  759    HA   TYR  45           HA       TYR  45   1.590  -9.654 -10.536
  760   1HB   TYR  45          2HB       TYR  45  -0.286 -11.254 -10.198
  761   2HB   TYR  45          1HB       TYR  45   0.240 -12.129 -11.631
  762    HD1  TYR  45           1HD      TYR  45   2.476 -10.655  -9.074
  763    HD2  TYR  45           2HD      TYR  45   0.752 -14.217 -10.632
  764    HE1  TYR  45           1HE      TYR  45   4.000 -11.992  -7.684
  765    HE2  TYR  45           2HE      TYR  45   2.271 -15.564  -9.245
  766    HH   TYR  45           HH       TYR  45   4.372 -15.379  -8.100
  767    H    ASP  46           H        ASP  46   3.656 -10.439 -10.808
  768    HA   ASP  46           HA       ASP  46   4.411 -11.190 -13.555
  769   1HB   ASP  46          2HB       ASP  46   5.152  -8.901 -13.059
  770   2HB   ASP  46          1HB       ASP  46   5.986  -9.476 -11.617
  771    H    ASP  47           H        ASP  47   4.237 -13.401 -12.913
  772    HA   ASP  47           HA       ASP  47   5.360 -14.670 -10.764
  773   1HB   ASP  47          2HB       ASP  47   5.271 -15.681 -13.614
  774   2HB   ASP  47          1HB       ASP  47   5.512 -16.684 -12.187
  775    H    ALA  48           H        ALA  48   6.972 -13.595 -13.700
  776    HA   ALA  48           HA       ALA  48   9.401 -14.885 -13.479
  777   1HB   ALA  48          1HB       ALA  48  10.091 -13.535 -15.146
  778   2HB   ALA  48          2HB       ALA  48   9.542 -12.068 -14.332
  779   3HB   ALA  48          3HB       ALA  48   8.387 -13.085 -15.194
  780    H    THR  49           H        THR  49   8.275 -12.034 -11.743
  781    HA   THR  49           HA       THR  49  10.823 -12.023 -10.263
  782    HB   THR  49           HB       THR  49  10.355  -9.650  -9.751
  783    HG1  THR  49           1HG      THR  49   8.085  -9.723  -9.986
  784   1HG2  THR  49          1HG2      THR  49  11.147  -8.791 -11.699
  785   2HG2  THR  49          2HG2      THR  49  10.082  -9.777 -12.700
  786   3HG2  THR  49          3HG2      THR  49  11.507 -10.498 -11.953
  787    H    LYS  50           H        LYS  50   7.953 -13.312  -9.873
  788    HA   LYS  50           HA       LYS  50   6.551 -13.779  -8.098
  789   1HB   LYS  50          2HB       LYS  50   9.225 -13.376  -6.761
  790   2HB   LYS  50          1HB       LYS  50   7.808 -13.923  -5.882
  791   1HG   LYS  50          2HG       LYS  50   8.737 -15.367  -8.330
  792   2HG   LYS  50          1HG       LYS  50   9.487 -15.665  -6.761
  793   1HD   LYS  50          2HD       LYS  50   6.510 -15.769  -7.036
  794   2HD   LYS  50          1HD       LYS  50   7.489 -17.144  -7.549
  795   1HE   LYS  50          2HE       LYS  50   6.740 -17.448  -5.264
  796   2HE   LYS  50          1HE       LYS  50   8.490 -17.252  -5.316
  797   1HZ   LYS  50          1HZ       LYS  50   8.352 -15.121  -4.431
  798   2HZ   LYS  50          2HZ       LYS  50   7.209 -15.993  -3.539
  799   3HZ   LYS  50          3HZ       LYS  50   6.704 -14.964  -4.780
  800    H    THR  51           H        THR  51   6.573 -11.021  -8.948
  801    HA   THR  51           HA       THR  51   5.878  -9.737  -6.393
  802    HB   THR  51           HB       THR  51   7.135  -8.408  -8.799
  803    HG1  THR  51           1HG      THR  51   8.896  -8.137  -7.354
  804   1HG2  THR  51          1HG2      THR  51   5.701  -6.838  -7.674
  805   2HG2  THR  51          2HG2      THR  51   7.388  -6.459  -7.325
  806   3HG2  THR  51          3HG2      THR  51   6.399  -7.273  -6.114
  807    H    PHE  52           H        PHE  52   4.098  -8.404  -6.348
  808    HA   PHE  52           HA       PHE  52   2.300  -8.593  -8.677
  809   1HB   PHE  52          2HB       PHE  52   1.556  -8.071  -5.789
  810   2HB   PHE  52          1HB       PHE  52   0.448  -8.350  -7.126
  811    HD1  PHE  52           1HD      PHE  52  -0.521 -10.414  -7.227
  812    HD2  PHE  52           2HD      PHE  52   3.363 -10.057  -5.525
  813    HE1  PHE  52           1HE      PHE  52  -0.532 -12.819  -6.702
  814    HE2  PHE  52           2HE      PHE  52   3.360 -12.461  -5.006
  815    HZ   PHE  52           HZ       PHE  52   1.411 -13.843  -5.593
  816    H    THR  53           H        THR  53   1.360  -6.713  -9.481
  817    HA   THR  53           HA       THR  53   2.232  -4.212  -8.205
  818    HB   THR  53           HB       THR  53   1.989  -3.280 -10.625
  819    HG1  THR  53           1HG      THR  53   2.651  -5.963 -11.210
  820   1HG2  THR  53          1HG2      THR  53   4.105  -3.068  -9.787
  821   2HG2  THR  53          2HG2      THR  53   4.365  -4.149 -11.158
  822   3HG2  THR  53          3HG2      THR  53   4.294  -4.803  -9.523
  823    H    VAL  54           H        VAL  54   0.752  -2.827  -7.650
  824    HA   VAL  54           HA       VAL  54  -2.002  -3.215  -8.621
  825    HB   VAL  54           HB       VAL  54  -1.096  -1.792  -6.108
  826   1HG1  VAL  54          1HG1      VAL  54  -3.886  -2.707  -6.709
  827   2HG1  VAL  54          2HG1      VAL  54  -3.299  -1.147  -7.286
  828   3HG1  VAL  54          3HG1      VAL  54  -3.335  -1.491  -5.557
  829   1HG2  VAL  54          1HG2      VAL  54  -0.732  -3.906  -5.406
  830   2HG2  VAL  54          2HG2      VAL  54  -1.749  -4.613  -6.661
  831   3HG2  VAL  54          3HG2      VAL  54  -2.485  -3.920  -5.215
  832    H    THR  55           H        THR  55  -2.384  -1.846 -10.253
  833    HA   THR  55           HA       THR  55  -1.119   0.791 -10.179
  834    HB   THR  55           HB       THR  55  -2.640  -0.311 -12.527
  835    HG1  THR  55           1HG      THR  55   0.081  -0.763 -11.851
  836   1HG2  THR  55          1HG2      THR  55  -0.304   1.576 -12.308
  837   2HG2  THR  55          2HG2      THR  55  -1.974   2.025 -12.663
  838   3HG2  THR  55          3HG2      THR  55  -1.064   1.040 -13.807
  839    H    GLU  56           H        GLU  56  -2.241   2.346  -9.284
  840    HA   GLU  56           HA       GLU  56  -5.011   2.278  -8.796
  841   1HB   GLU  56          2HB       GLU  56  -3.473   3.599  -7.434
  842   2HB   GLU  56          1HB       GLU  56  -3.096   4.619  -8.816
  843   1HG   GLU  56          2HG       GLU  56  -5.411   5.402  -8.870
  844   2HG   GLU  56          1HG       GLU  56  -5.783   4.386  -7.478
  Start of MODEL   11
    1   1H    MET   1          1HT       MET   1   7.316 -19.402   2.337
    2   2H    MET   1          2HT       MET   1   5.784 -18.847   1.882
    3   3H    MET   1          3HT       MET   1   6.660 -18.028   3.075
    4    HA   MET   1           HA       MET   1   8.430 -17.759   1.237
    5   1HB   MET   1          2HB       MET   1   5.877 -18.334  -0.268
    6   2HB   MET   1          1HB       MET   1   7.252 -17.512  -0.990
    7   1HG   MET   1          2HG       MET   1   7.298 -20.284   0.179
    8   2HG   MET   1          1HG       MET   1   7.181 -19.897  -1.537
    9   1HE   MET   1          1HE       MET   1   8.813 -18.507  -2.785
   10   2HE   MET   1          2HE       MET   1  10.553 -18.500  -2.499
   11   3HE   MET   1          3HE       MET   1   9.520 -17.334  -1.673
   12    H    GLN   2           H        GLN   2   8.718 -15.637   0.636
   13    HA   GLN   2           HA       GLN   2   6.667 -13.759   1.580
   14   1HB   GLN   2          2HB       GLN   2   8.827 -13.579   2.722
   15   2HB   GLN   2          1HB       GLN   2   9.642 -13.368   1.179
   16   1HG   GLN   2          2HG       GLN   2   8.424 -11.273   0.830
   17   2HG   GLN   2          1HG       GLN   2   7.630 -11.483   2.389
   18   1HE2  GLN   2          1HE2      GLN   2   8.476 -10.284   3.919
   19   2HE2  GLN   2          2HE2      GLN   2  10.137  -9.836   4.071
   20    H    TYR   3           H        TYR   3   6.016 -12.049   0.278
   21    HA   TYR   3           HA       TYR   3   6.958 -12.127  -2.512
   22   1HB   TYR   3          2HB       TYR   3   4.115 -11.696  -1.572
   23   2HB   TYR   3          1HB       TYR   3   4.664 -11.603  -3.243
   24    HD1  TYR   3           1HD      TYR   3   4.556 -13.495  -4.583
   25    HD2  TYR   3           2HD      TYR   3   4.545 -13.960  -0.355
   26    HE1  TYR   3           1HE      TYR   3   4.135 -15.901  -4.856
   27    HE2  TYR   3           2HE      TYR   3   4.127 -16.369  -0.614
   28    HH   TYR   3           HH       TYR   3   4.696 -18.075  -3.109
   29    H    LYS   4           H        LYS   4   7.177 -10.169  -3.560
   30    HA   LYS   4           HA       LYS   4   6.998  -7.811  -1.810
   31   1HB   LYS   4          2HB       LYS   4   9.250  -8.316  -2.652
   32   2HB   LYS   4          1HB       LYS   4   8.652  -8.241  -4.302
   33   1HG   LYS   4          2HG       LYS   4   8.201  -5.902  -4.105
   34   2HG   LYS   4          1HG       LYS   4   8.564  -5.931  -2.380
   35   1HD   LYS   4          2HD       LYS   4  10.430  -4.991  -3.605
   36   2HD   LYS   4          1HD       LYS   4  10.893  -6.539  -2.901
   37   1HE   LYS   4          2HE       LYS   4   9.955  -6.231  -5.745
   38   2HE   LYS   4          1HE       LYS   4  11.650  -6.127  -5.274
   39   1HZ   LYS   4          1HZ       LYS   4  10.756  -8.441  -4.123
   40   2HZ   LYS   4          2HZ       LYS   4  11.696  -8.318  -5.523
   41   3HZ   LYS   4          3HZ       LYS   4  10.015  -8.434  -5.645
   42    H    VAL   5           H        VAL   5   5.144  -6.759  -2.131
   43    HA   VAL   5           HA       VAL   5   3.972  -6.712  -4.801
   44    HB   VAL   5           HB       VAL   5   2.822  -5.696  -2.200
   45   1HG1  VAL   5          1HG1      VAL   5   1.757  -5.876  -4.989
   46   2HG1  VAL   5          2HG1      VAL   5   1.665  -4.541  -3.842
   47   3HG1  VAL   5          3HG1      VAL   5   0.666  -5.973  -3.607
   48   1HG2  VAL   5          1HG2      VAL   5   1.312  -7.817  -2.796
   49   2HG2  VAL   5          2HG2      VAL   5   2.757  -7.924  -1.792
   50   3HG2  VAL   5          3HG2      VAL   5   2.838  -8.351  -3.501
   51    H    ILE   6           H        ILE   6   3.913  -5.005  -6.067
   52    HA   ILE   6           HA       ILE   6   5.155  -2.520  -5.131
   53    HB   ILE   6           HB       ILE   6   4.736  -3.644  -7.899
   54   1HG1  ILE   6          2HG1      ILE   6   7.234  -2.855  -6.386
   55   2HG1  ILE   6          1HG1      ILE   6   6.650  -4.501  -6.598
   56   1HG2  ILE   6          1HG2      ILE   6   5.154  -0.859  -7.059
   57   2HG2  ILE   6          2HG2      ILE   6   4.487  -1.510  -8.557
   58   3HG2  ILE   6          3HG2      ILE   6   6.235  -1.433  -8.330
   59   1HD1  ILE   6          1HD1      ILE   6   8.078  -4.513  -8.321
   60   2HD1  ILE   6          2HD1      ILE   6   8.097  -2.754  -8.451
   61   3HD1  ILE   6          3HD1      ILE   6   6.775  -3.676  -9.167
   62    H    LEU   7           H        LEU   7   3.827  -0.955  -4.557
   63    HA   LEU   7           HA       LEU   7   1.101  -0.903  -5.612
   64   1HB   LEU   7          2HB       LEU   7   2.180   0.958  -3.511
   65   2HB   LEU   7          1HB       LEU   7   0.526   0.427  -3.762
   66    HG   LEU   7           HG       LEU   7   2.785  -1.198  -2.611
   67   1HD1  LEU   7          1HD1      LEU   7   1.343  -1.260  -0.628
   68   2HD1  LEU   7          2HD1      LEU   7   0.190  -0.204  -1.444
   69   3HD1  LEU   7          3HD1      LEU   7   1.806   0.387  -1.059
   70   1HD2  LEU   7          1HD2      LEU   7   1.423  -2.600  -4.056
   71   2HD2  LEU   7          2HD2      LEU   7  -0.041  -2.033  -3.253
   72   3HD2  LEU   7          3HD2      LEU   7   1.141  -2.992  -2.361
   73    H    ASN   8           H        ASN   8   1.468  -0.125  -7.691
   74    HA   ASN   8           HA       ASN   8   2.807   2.450  -8.015
   75   1HB   ASN   8          2HB       ASN   8   3.362   0.488  -9.472
   76   2HB   ASN   8          1HB       ASN   8   1.734   0.586 -10.132
   77   1HD2  ASN   8          1HD2      ASN   8   4.741   1.211 -10.889
   78   2HD2  ASN   8          2HD2      ASN   8   4.568   2.636 -11.850
   79    H    GLY   9           H        GLY   9   1.449   4.151  -7.604
   80   1HA   GLY   9          2HA       GLY   9  -1.230   4.029  -8.841
   81   2HA   GLY   9          1HA       GLY   9  -0.861   4.945  -7.394
   82    H    LYS  10           H        LYS  10  -1.966   6.632  -8.676
   83    HA   LYS  10           HA       LYS  10  -0.690   7.748 -10.958
   84   1HB   LYS  10          2HB       LYS  10  -2.848   8.709  -9.099
   85   2HB   LYS  10          1HB       LYS  10  -2.204   9.753 -10.358
   86   1HG   LYS  10          2HG       LYS  10  -3.380   7.040 -10.889
   87   2HG   LYS  10          1HG       LYS  10  -4.305   8.539 -10.950
   88   1HD   LYS  10          2HD       LYS  10  -1.867   7.919 -12.616
   89   2HD   LYS  10          1HD       LYS  10  -3.537   7.811 -13.175
   90   1HE   LYS  10          2HE       LYS  10  -3.825  10.210 -12.689
   91   2HE   LYS  10          1HE       LYS  10  -2.131  10.299 -12.211
   92   1HZ   LYS  10          1HZ       LYS  10  -2.291  11.043 -14.442
   93   2HZ   LYS  10          2HZ       LYS  10  -3.206   9.699 -14.908
   94   3HZ   LYS  10          3HZ       LYS  10  -1.578   9.509 -14.493
   95    H    THR  11           H        THR  11  -1.004   8.955  -7.607
   96    HA   THR  11           HA       THR  11   1.404  10.577  -8.037
   97    HB   THR  11           HB       THR  11   0.386  11.828  -5.997
   98    HG1  THR  11           1HG      THR  11  -1.323  10.008  -6.019
   99   1HG2  THR  11          1HG2      THR  11  -0.185  13.407  -7.435
  100   2HG2  THR  11          2HG2      THR  11  -1.497  12.422  -8.086
  101   3HG2  THR  11          3HG2      THR  11   0.137  12.250  -8.726
  102    H    LEU  12           H        LEU  12   0.844   7.706  -6.945
  103    HA   LEU  12           HA       LEU  12   2.644   8.010  -4.663
  104   1HB   LEU  12          2HB       LEU  12   0.426   7.869  -3.714
  105   2HB   LEU  12          1HB       LEU  12   0.079   6.434  -4.655
  106    HG   LEU  12           HG       LEU  12   1.688   5.153  -3.388
  107   1HD1  LEU  12          1HD1      LEU  12   3.437   6.200  -2.515
  108   2HD1  LEU  12          2HD1      LEU  12   2.371   6.832  -1.259
  109   3HD1  LEU  12          3HD1      LEU  12   2.664   7.766  -2.723
  110   1HD2  LEU  12          1HD2      LEU  12   0.491   6.309  -1.047
  111   2HD2  LEU  12          2HD2      LEU  12   0.136   4.775  -1.843
  112   3HD2  LEU  12          3HD2      LEU  12  -0.684   6.249  -2.361
  113    H    LYS  13           H        LYS  13   4.129   6.440  -4.435
  114    HA   LYS  13           HA       LYS  13   3.904   3.981  -5.984
  115   1HB   LYS  13          2HB       LYS  13   6.264   5.857  -6.255
  116   2HB   LYS  13          1HB       LYS  13   6.132   4.262  -6.983
  117   1HG   LYS  13          2HG       LYS  13   4.229   5.027  -8.315
  118   2HG   LYS  13          1HG       LYS  13   4.371   6.629  -7.592
  119   1HD   LYS  13          2HD       LYS  13   6.622   6.852  -8.530
  120   2HD   LYS  13          1HD       LYS  13   6.481   5.246  -9.248
  121   1HE   LYS  13          2HE       LYS  13   4.742   7.631  -9.873
  122   2HE   LYS  13          1HE       LYS  13   6.035   6.998 -10.892
  123   1HZ   LYS  13          1HZ       LYS  13   3.331   6.060 -10.557
  124   2HZ   LYS  13          2HZ       LYS  13   4.485   4.827 -10.483
  125   3HZ   LYS  13          3HZ       LYS  13   4.405   5.829 -11.844
  126    H    GLY  14           H        GLY  14   5.096   2.262  -5.117
  127   1HA   GLY  14          2HA       GLY  14   7.132   2.570  -3.185
  128   2HA   GLY  14          1HA       GLY  14   5.595   2.361  -2.364
  129    H    GLU  15           H        GLU  15   6.892   0.492  -1.540
  130    HA   GLU  15           HA       GLU  15   6.164  -1.867  -3.085
  131   1HB   GLU  15          2HB       GLU  15   8.957  -1.398  -2.028
  132   2HB   GLU  15          1HB       GLU  15   8.374  -2.908  -2.718
  133   1HG   GLU  15          2HG       GLU  15   7.984  -1.770  -4.852
  134   2HG   GLU  15          1HG       GLU  15   8.604  -0.274  -4.158
  135    H    THR  16           H        THR  16   5.498  -3.523  -1.862
  136    HA   THR  16           HA       THR  16   5.934  -3.389   1.035
  137    HB   THR  16           HB       THR  16   3.762  -2.586   0.961
  138    HG1  THR  16           1HG      THR  16   3.311  -5.360   0.912
  139   1HG2  THR  16          1HG2      THR  16   3.561  -4.034  -1.558
  140   2HG2  THR  16          2HG2      THR  16   2.778  -2.545  -1.035
  141   3HG2  THR  16          3HG2      THR  16   2.108  -4.108  -0.566
  142    H    THR  17           H        THR  17   5.294  -5.525   2.122
  143    HA   THR  17           HA       THR  17   5.667  -7.808   0.337
  144    HB   THR  17           HB       THR  17   7.439  -8.729   1.817
  145    HG1  THR  17           1HG      THR  17   7.387  -6.126   2.933
  146   1HG2  THR  17          1HG2      THR  17   9.265  -7.220   1.115
  147   2HG2  THR  17          2HG2      THR  17   8.049  -6.083   0.532
  148   3HG2  THR  17          3HG2      THR  17   8.181  -7.682  -0.198
  149    H    THR  18           H        THR  18   4.188  -9.256   0.759
  150    HA   THR  18           HA       THR  18   3.128  -9.560   3.504
  151    HB   THR  18           HB       THR  18   1.461  -8.976   1.762
  152    HG1  THR  18           1HG      THR  18   0.928 -10.382   3.538
  153   1HG2  THR  18          1HG2      THR  18   0.818 -10.877   0.193
  154   2HG2  THR  18          2HG2      THR  18   2.458 -11.473   0.452
  155   3HG2  THR  18          3HG2      THR  18   2.201  -9.876  -0.251
  156    H    GLU  19           H        GLU  19   3.112 -11.616   4.433
  157    HA   GLU  19           HA       GLU  19   4.756 -13.632   3.042
  158   1HB   GLU  19          2HB       GLU  19   5.586 -12.751   5.237
  159   2HB   GLU  19          1HB       GLU  19   4.151 -13.415   6.001
  160   1HG   GLU  19          2HG       GLU  19   6.200 -15.042   4.514
  161   2HG   GLU  19          1HG       GLU  19   6.171 -14.816   6.261
  162    H    ALA  20           H        ALA  20   3.547 -15.180   2.090
  163    HA   ALA  20           HA       ALA  20   1.376 -16.369   3.638
  164   1HB   ALA  20          1HB       ALA  20  -0.296 -15.970   2.152
  165   2HB   ALA  20          2HB       ALA  20   0.800 -15.881   0.771
  166   3HB   ALA  20          3HB       ALA  20   0.670 -14.518   1.883
  167    H    VAL  21           H        VAL  21   0.784 -18.444   3.009
  168    HA   VAL  21           HA       VAL  21   2.794 -20.214   2.412
  169    HB   VAL  21           HB       VAL  21  -0.105 -20.707   1.736
  170   1HG1  VAL  21          1HG1      VAL  21   2.049 -22.612   2.643
  171   2HG1  VAL  21          2HG1      VAL  21   1.519 -22.406   0.973
  172   3HG1  VAL  21          3HG1      VAL  21   0.395 -23.022   2.185
  173   1HG2  VAL  21          1HG2      VAL  21  -0.110 -21.660   4.124
  174   2HG2  VAL  21          2HG2      VAL  21  -0.220 -19.910   3.921
  175   3HG2  VAL  21          3HG2      VAL  21   1.316 -20.652   4.375
  176    H    ASP  22           H        ASP  22   0.866 -18.382   0.176
  177    HA   ASP  22           HA       ASP  22   2.572 -19.204  -1.997
  178   1HB   ASP  22          2HB       ASP  22   0.671 -19.910  -3.474
  179   2HB   ASP  22          1HB       ASP  22   1.038 -21.028  -2.164
  180    H    ALA  23           H        ALA  23   1.722 -18.178  -4.136
  181    HA   ALA  23           HA       ALA  23   1.740 -15.412  -3.804
  182   1HB   ALA  23          1HB       ALA  23   2.438 -15.890  -5.899
  183   2HB   ALA  23          2HB       ALA  23   0.739 -15.620  -6.288
  184   3HB   ALA  23          3HB       ALA  23   1.343 -17.262  -6.065
  185    H    ALA  24           H        ALA  24  -0.970 -17.609  -4.368
  186    HA   ALA  24           HA       ALA  24  -2.948 -15.623  -4.667
  187   1HB   ALA  24          1HB       ALA  24  -2.888 -18.524  -4.258
  188   2HB   ALA  24          2HB       ALA  24  -3.932 -17.546  -5.290
  189   3HB   ALA  24          3HB       ALA  24  -4.310 -17.733  -3.578
  190    H    THR  25           H        THR  25  -2.042 -17.559  -1.797
  191    HA   THR  25           HA       THR  25  -3.722 -16.333   0.029
  192    HB   THR  25           HB       THR  25  -1.958 -16.959   1.726
  193    HG1  THR  25           1HG      THR  25  -0.523 -17.353  -0.604
  194   1HG2  THR  25          1HG2      THR  25  -2.932 -18.988  -0.235
  195   2HG2  THR  25          2HG2      THR  25  -3.524 -18.643   1.391
  196   3HG2  THR  25          3HG2      THR  25  -1.963 -19.436   1.169
  197    H    ALA  26           H        ALA  26  -0.478 -15.422  -1.057
  198    HA   ALA  26           HA       ALA  26  -0.162 -13.158   0.580
  199   1HB   ALA  26          1HB       ALA  26   1.270 -14.405  -1.519
  200   2HB   ALA  26          2HB       ALA  26   1.826 -13.136  -0.429
  201   3HB   ALA  26          3HB       ALA  26   1.067 -12.711  -1.965
  202    H    GLU  27           H        GLU  27  -1.313 -13.450  -2.795
  203    HA   GLU  27           HA       GLU  27  -1.970 -10.835  -3.291
  204   1HB   GLU  27          2HB       GLU  27  -2.060 -12.597  -4.981
  205   2HB   GLU  27          1HB       GLU  27  -3.450 -13.311  -4.176
  206   1HG   GLU  27          2HG       GLU  27  -4.752 -11.294  -4.642
  207   2HG   GLU  27          1HG       GLU  27  -3.359 -10.591  -5.460
  208    H    LYS  28           H        LYS  28  -4.014 -13.345  -1.813
  209    HA   LYS  28           HA       LYS  28  -6.287 -11.737  -1.433
  210   1HB   LYS  28          2HB       LYS  28  -5.332 -14.135   0.145
  211   2HB   LYS  28          1HB       LYS  28  -6.941 -13.432   0.263
  212   1HG   LYS  28          2HG       LYS  28  -5.725 -14.677  -2.194
  213   2HG   LYS  28          1HG       LYS  28  -6.959 -15.396  -1.156
  214   1HD   LYS  28          2HD       LYS  28  -7.274 -12.815  -2.690
  215   2HD   LYS  28          1HD       LYS  28  -7.891 -14.386  -3.212
  216   1HE   LYS  28          2HE       LYS  28  -9.263 -14.509  -1.181
  217   2HE   LYS  28          1HE       LYS  28  -8.653 -12.931  -0.680
  218   1HZ   LYS  28          1HZ       LYS  28 -10.485 -13.589  -2.890
  219   2HZ   LYS  28          2HZ       LYS  28  -9.567 -12.171  -2.947
  220   3HZ   LYS  28          3HZ       LYS  28 -10.653 -12.422  -1.677
  221    H    VAL  29           H        VAL  29  -3.520 -12.447   0.645
  222    HA   VAL  29           HA       VAL  29  -4.331 -11.101   2.932
  223    HB   VAL  29           HB       VAL  29  -1.553 -11.460   1.796
  224   1HG1  VAL  29          1HG1      VAL  29  -1.166  -9.754   3.285
  225   2HG1  VAL  29          2HG1      VAL  29  -0.981 -11.163   4.329
  226   3HG1  VAL  29          3HG1      VAL  29  -2.484 -10.241   4.350
  227   1HG2  VAL  29          1HG2      VAL  29  -2.399 -12.941   4.188
  228   2HG2  VAL  29          2HG2      VAL  29  -1.488 -13.482   2.778
  229   3HG2  VAL  29          3HG2      VAL  29  -3.246 -13.369   2.702
  230    H    VAL  30           H        VAL  30  -2.628  -9.883   0.083
  231    HA   VAL  30           HA       VAL  30  -2.339  -7.239   1.059
  232    HB   VAL  30           HB       VAL  30  -2.456  -8.230  -1.795
  233   1HG1  VAL  30          1HG1      VAL  30  -0.915  -5.816  -1.281
  234   2HG1  VAL  30          2HG1      VAL  30  -2.633  -5.615  -0.932
  235   3HG1  VAL  30          3HG1      VAL  30  -2.114  -6.146  -2.531
  236   1HG2  VAL  30          1HG2      VAL  30  -0.262  -8.740  -1.684
  237   2HG2  VAL  30          2HG2      VAL  30  -0.607  -8.909   0.038
  238   3HG2  VAL  30          3HG2      VAL  30   0.099  -7.414  -0.578
  239    H    LYS  31           H        LYS  31  -4.755  -8.817  -1.042
  240    HA   LYS  31           HA       LYS  31  -6.388  -6.696  -1.620
  241   1HB   LYS  31          2HB       LYS  31  -6.992  -9.580  -1.091
  242   2HB   LYS  31          1HB       LYS  31  -8.293  -8.444  -1.434
  243   1HG   LYS  31          2HG       LYS  31  -7.234  -7.872  -3.554
  244   2HG   LYS  31          1HG       LYS  31  -5.941  -9.024  -3.217
  245   1HD   LYS  31          2HD       LYS  31  -7.523 -10.853  -3.224
  246   2HD   LYS  31          1HD       LYS  31  -8.864  -9.725  -3.439
  247   1HE   LYS  31          2HE       LYS  31  -7.921  -9.030  -5.597
  248   2HE   LYS  31          1HE       LYS  31  -6.603 -10.184  -5.384
  249   1HZ   LYS  31          1HZ       LYS  31  -8.860 -10.732  -6.694
  250   2HZ   LYS  31          2HZ       LYS  31  -9.275 -11.288  -5.151
  251   3HZ   LYS  31          3HZ       LYS  31  -7.911 -11.909  -5.934
  252    H    GLN  32           H        GLN  32  -6.496  -8.738   1.261
  253    HA   GLN  32           HA       GLN  32  -8.609  -7.285   2.492
  254   1HB   GLN  32          2HB       GLN  32  -8.102  -9.552   3.163
  255   2HB   GLN  32          1HB       GLN  32  -6.501  -9.072   3.710
  256   1HG   GLN  32          2HG       GLN  32  -7.426  -7.774   5.488
  257   2HG   GLN  32          1HG       GLN  32  -9.060  -8.007   4.875
  258   1HE2  GLN  32          1HE2      GLN  32  -7.837 -10.911   4.315
  259   2HE2  GLN  32          2HE2      GLN  32  -8.145 -11.694   5.817
  260    H    PHE  33           H        PHE  33  -5.128  -7.031   2.494
  261    HA   PHE  33           HA       PHE  33  -4.668  -5.253   4.563
  262   1HB   PHE  33          2HB       PHE  33  -2.936  -6.382   3.154
  263   2HB   PHE  33          1HB       PHE  33  -3.322  -5.270   1.847
  264    HD1  PHE  33           1HD      PHE  33  -2.008  -5.481   5.278
  265    HD2  PHE  33           2HD      PHE  33  -2.334  -3.132   1.731
  266    HE1  PHE  33           1HE      PHE  33  -0.359  -3.887   6.165
  267    HE2  PHE  33           2HE      PHE  33  -0.687  -1.544   2.637
  268    HZ   PHE  33           HZ       PHE  33   0.290  -1.935   4.866
  269    H    PHE  34           H        PHE  34  -5.409  -4.557   1.191
  270    HA   PHE  34           HA       PHE  34  -5.714  -1.717   1.646
  271   1HB   PHE  34          2HB       PHE  34  -6.351  -3.402  -0.779
  272   2HB   PHE  34          1HB       PHE  34  -6.398  -1.638  -0.727
  273    HD1  PHE  34           1HD      PHE  34  -4.080  -0.919   0.789
  274    HD2  PHE  34           2HD      PHE  34  -4.543  -4.014  -2.084
  275    HE1  PHE  34           1HE      PHE  34  -1.666  -0.856   0.343
  276    HE2  PHE  34           2HE      PHE  34  -2.133  -3.955  -2.547
  277    HZ   PHE  34           HZ       PHE  34  -0.693  -2.374  -1.318
  278    H    ASN  35           H        ASN  35  -7.803  -4.498   1.268
  279    HA   ASN  35           HA       ASN  35 -10.292  -3.339   1.005
  280   1HB   ASN  35          2HB       ASN  35  -9.771  -5.801   1.060
  281   2HB   ASN  35          1HB       ASN  35  -9.621  -5.682   2.811
  282   1HD2  ASN  35          1HD2      ASN  35 -11.588  -6.587   0.443
  283   2HD2  ASN  35          2HD2      ASN  35 -13.125  -6.374   1.203
  284    H    ASP  36           H        ASP  36  -8.309  -3.782   3.840
  285    HA   ASP  36           HA       ASP  36 -10.259  -2.450   5.556
  286   1HB   ASP  36          2HB       ASP  36  -7.639  -3.784   6.264
  287   2HB   ASP  36          1HB       ASP  36  -8.790  -3.123   7.419
  288    H    ASN  37           H        ASN  37  -7.231  -1.716   3.978
  289    HA   ASN  37           HA       ASN  37  -6.631   0.515   5.717
  290   1HB   ASN  37          2HB       ASN  37  -5.505  -0.308   3.030
  291   2HB   ASN  37          1HB       ASN  37  -4.964   1.118   3.910
  292   1HD2  ASN  37          1HD2      ASN  37  -3.651  -1.463   3.095
  293   2HD2  ASN  37          2HD2      ASN  37  -2.950  -2.061   4.558
  294    H    GLY  38           H        GLY  38  -7.900   0.017   2.493
  295   1HA   GLY  38          2HA       GLY  38  -8.406   1.941   1.042
  296   2HA   GLY  38          1HA       GLY  38  -9.844   1.265   1.770
  297    H    VAL  39           H        VAL  39 -11.202   2.700   2.459
  298    HA   VAL  39           HA       VAL  39 -10.396   5.433   2.753
  299    HB   VAL  39           HB       VAL  39 -13.126   4.207   2.982
  300   1HG1  VAL  39          1HG1      VAL  39 -12.163   7.039   3.032
  301   2HG1  VAL  39          2HG1      VAL  39 -13.378   6.252   4.041
  302   3HG1  VAL  39          3HG1      VAL  39 -13.750   6.653   2.364
  303   1HG2  VAL  39          1HG2      VAL  39 -12.698   3.855   0.787
  304   2HG2  VAL  39          2HG2      VAL  39 -11.456   5.105   0.717
  305   3HG2  VAL  39          3HG2      VAL  39 -13.161   5.554   0.669
  306    H    ASP  40           H        ASP  40 -12.197   3.279   5.029
  307    HA   ASP  40           HA       ASP  40 -11.817   5.306   7.063
  308   1HB   ASP  40          2HB       ASP  40 -13.340   2.701   7.118
  309   2HB   ASP  40          1HB       ASP  40 -13.318   3.888   8.419
  310    H    GLY  41           H        GLY  41  -9.448   3.721   6.213
  311   1HA   GLY  41          2HA       GLY  41  -8.872   1.863   8.311
  312   2HA   GLY  41          1HA       GLY  41  -7.707   2.547   7.185
  313    H    GLU  42           H        GLU  42  -7.116   2.129   9.897
  314    HA   GLU  42           HA       GLU  42  -7.340   4.705  11.238
  315   1HB   GLU  42          2HB       GLU  42  -5.933   2.161  12.085
  316   2HB   GLU  42          1HB       GLU  42  -6.144   3.591  13.088
  317   1HG   GLU  42          2HG       GLU  42  -8.565   3.297  13.004
  318   2HG   GLU  42          1HG       GLU  42  -8.355   1.865  11.998
  319    H    TRP  43           H        TRP  43  -6.074   6.192  10.201
  320    HA   TRP  43           HA       TRP  43  -3.322   5.465   9.533
  321   1HB   TRP  43          2HB       TRP  43  -4.955   7.891   8.796
  322   2HB   TRP  43          1HB       TRP  43  -3.320   7.560   8.237
  323    HD1  TRP  43           HD       TRP  43  -6.065   4.868   8.343
  324    HE1  TRP  43           1HE      TRP  43  -6.547   4.115   5.932
  325    HE3  TRP  43           3HE      TRP  43  -3.161   8.247   5.874
  326    HZ2  TRP  43           2HZ      TRP  43  -5.773   4.857   3.323
  327    HZ3  TRP  43           3HZ      TRP  43  -3.084   8.163   3.425
  328    HH2  TRP  43           HH       TRP  43  -4.361   6.497   2.175
  329    H    THR  44           H        THR  44  -1.726   5.958  10.861
  330    HA   THR  44           HA       THR  44  -1.992   8.320  12.601
  331    HB   THR  44           HB       THR  44  -0.275   7.235  14.033
  332    HG1  THR  44           1HG      THR  44   0.544   5.904  12.247
  333   1HG2  THR  44          1HG2      THR  44  -2.445   5.219  13.630
  334   2HG2  THR  44          2HG2      THR  44  -2.782   6.808  14.321
  335   3HG2  THR  44          3HG2      THR  44  -1.649   5.719  15.123
  336    H    TYR  45           H        TYR  45  -0.420   9.905  12.473
  337    HA   TYR  45           HA       TYR  45   1.647   9.484  10.412
  338   1HB   TYR  45          2HB       TYR  45  -0.098  11.157   9.840
  339   2HB   TYR  45          1HB       TYR  45   0.370  12.093  11.255
  340    HD1  TYR  45           1HD      TYR  45   2.723  10.358   8.983
  341    HD2  TYR  45           2HD      TYR  45   1.042  14.085  10.159
  342    HE1  TYR  45           1HE      TYR  45   4.408  11.537   7.635
  343    HE2  TYR  45           2HE      TYR  45   2.722  15.274   8.814
  344    HH   TYR  45           HH       TYR  45   4.901  14.925   7.859
  345    H    ASP  46           H        ASP  46   3.747  10.179  10.770
  346    HA   ASP  46           HA       ASP  46   4.361  11.069  13.510
  347   1HB   ASP  46          2HB       ASP  46   4.996   8.715  13.222
  348   2HB   ASP  46          1HB       ASP  46   5.952   9.139  11.806
  349    H    ASP  47           H        ASP  47   4.380  13.239  12.741
  350    HA   ASP  47           HA       ASP  47   5.695  14.298  10.587
  351   1HB   ASP  47          2HB       ASP  47   5.559  15.506  13.358
  352   2HB   ASP  47          1HB       ASP  47   5.881  16.388  11.868
  353    H    ALA  48           H        ALA  48   7.085  13.204  13.612
  354    HA   ALA  48           HA       ALA  48   9.572  14.353  13.582
  355   1HB   ALA  48          1HB       ALA  48   8.350  12.082  14.836
  356   2HB   ALA  48          2HB       ALA  48   9.658  13.110  15.415
  357   3HB   ALA  48          3HB       ALA  48  10.019  11.713  14.402
  358    H    THR  49           H        THR  49   8.443  11.670  11.606
  359    HA   THR  49           HA       THR  49  11.037  11.734  10.206
  360    HB   THR  49           HB       THR  49  10.747   9.328   9.723
  361    HG1  THR  49           1HG      THR  49   8.499   9.601  11.426
  362   1HG2  THR  49          1HG2      THR  49  11.382  10.431  12.258
  363   2HG2  THR  49          2HG2      THR  49  11.973   8.945  11.515
  364   3HG2  THR  49          3HG2      THR  49  10.513   8.917  12.503
  365    H    LYS  50           H        LYS  50   8.203  12.935   9.774
  366    HA   LYS  50           HA       LYS  50   6.766  13.323   8.015
  367   1HB   LYS  50          2HB       LYS  50   9.376  12.808   6.590
  368   2HB   LYS  50          1HB       LYS  50   7.930  13.364   5.763
  369   1HG   LYS  50          2HG       LYS  50   8.523  15.006   8.066
  370   2HG   LYS  50          1HG       LYS  50   9.887  14.932   6.948
  371   1HD   LYS  50          2HD       LYS  50   7.049  15.639   6.197
  372   2HD   LYS  50          1HD       LYS  50   8.358  16.797   6.434
  373   1HE   LYS  50          2HE       LYS  50   9.603  15.791   4.602
  374   2HE   LYS  50          1HE       LYS  50   8.341  14.580   4.387
  375   1HZ   LYS  50          1HZ       LYS  50   7.854  17.492   4.127
  376   2HZ   LYS  50          2HZ       LYS  50   6.828  16.228   3.672
  377   3HZ   LYS  50          3HZ       LYS  50   8.259  16.499   2.819
  378    H    THR  51           H        THR  51   6.775  10.617   9.014
  379    HA   THR  51           HA       THR  51   6.058   9.184   6.546
  380    HB   THR  51           HB       THR  51   7.319   8.061   9.052
  381    HG1  THR  51           1HG      THR  51   8.269   8.398   6.408
  382   1HG2  THR  51          1HG2      THR  51   7.367   6.257   6.851
  383   2HG2  THR  51          2HG2      THR  51   5.699   6.715   7.195
  384   3HG2  THR  51          3HG2      THR  51   6.705   6.024   8.468
  385    H    PHE  52           H        PHE  52   4.204   8.010   6.522
  386    HA   PHE  52           HA       PHE  52   2.414   8.353   8.837
  387   1HB   PHE  52          2HB       PHE  52   1.662   7.725   5.972
  388   2HB   PHE  52          1HB       PHE  52   0.562   8.118   7.286
  389    HD1  PHE  52           1HD      PHE  52  -0.212  10.275   7.468
  390    HD2  PHE  52           2HD      PHE  52   3.467   9.558   5.453
  391    HE1  PHE  52           1HE      PHE  52  -0.097  12.652   6.837
  392    HE2  PHE  52           2HE      PHE  52   3.587  11.932   4.823
  393    HZ   PHE  52           HZ       PHE  52   1.805  13.483   5.514
  394    H    THR  53           H        THR  53   1.441   6.580   9.763
  395    HA   THR  53           HA       THR  53   2.180   3.963   8.641
  396    HB   THR  53           HB       THR  53   1.796   3.191  11.101
  397    HG1  THR  53           1HG      THR  53   2.097   4.712  12.623
  398   1HG2  THR  53          1HG2      THR  53   3.940   2.788  10.607
  399   2HG2  THR  53          2HG2      THR  53   4.223   4.209  11.617
  400   3HG2  THR  53          3HG2      THR  53   4.181   4.370   9.861
  401    H    VAL  54           H        VAL  54   0.612   2.696   8.037
  402    HA   VAL  54           HA       VAL  54  -2.118   3.266   8.987
  403    HB   VAL  54           HB       VAL  54  -1.308   2.004   6.357
  404   1HG1  VAL  54          1HG1      VAL  54  -3.957   2.609   7.621
  405   2HG1  VAL  54          2HG1      VAL  54  -3.403   1.122   6.853
  406   3HG1  VAL  54          3HG1      VAL  54  -3.782   2.533   5.867
  407   1HG2  VAL  54          1HG2      VAL  54  -0.962   4.577   6.870
  408   2HG2  VAL  54          2HG2      VAL  54  -2.690   4.629   6.519
  409   3HG2  VAL  54          3HG2      VAL  54  -1.564   4.015   5.309
  410    H    THR  55           H        THR  55  -2.918   1.766  10.293
  411    HA   THR  55           HA       THR  55  -1.747  -0.918  10.222
  412    HB   THR  55           HB       THR  55  -3.565   0.185  12.358
  413    HG1  THR  55           1HG      THR  55  -1.660   1.462  12.161
  414   1HG2  THR  55          1HG2      THR  55  -3.380  -2.165  12.557
  415   2HG2  THR  55          2HG2      THR  55  -2.294  -1.465  13.756
  416   3HG2  THR  55          3HG2      THR  55  -1.643  -2.119  12.252
  417    H    GLU  56           H        GLU  56  -2.774  -2.279   8.940
  418    HA   GLU  56           HA       GLU  56  -5.013  -2.247   7.604
  419   1HB   GLU  56          2HB       GLU  56  -5.046  -4.589   7.544
  420   2HB   GLU  56          1HB       GLU  56  -3.377  -4.185   7.929
  421   1HG   GLU  56          2HG       GLU  56  -5.506  -5.199   9.793
  422   2HG   GLU  56          1HG       GLU  56  -4.027  -6.013   9.296
  423   1H    MET   1          1HT       MET   1   7.817  19.270  -2.141
  424   2H    MET   1          2HT       MET   1   6.269  18.749  -1.705
  425   3H    MET   1          3HT       MET   1   7.139  17.912  -2.887
  426    HA   MET   1           HA       MET   1   8.880  17.598  -1.030
  427   1HB   MET   1          2HB       MET   1   6.325  18.230   0.453
  428   2HB   MET   1          1HB       MET   1   7.682  17.387   1.186
  429   1HG   MET   1          2HG       MET   1   7.799  20.152   0.005
  430   2HG   MET   1          1HG       MET   1   7.629  19.782   1.722
  431   1HE   MET   1          1HE       MET   1   9.203  18.333   3.002
  432   2HE   MET   1          2HE       MET   1  10.947  18.281   2.757
  433   3HE   MET   1          3HE       MET   1   9.901  17.154   1.892
  434    H    GLN   2           H        GLN   2   9.106  15.473  -0.422
  435    HA   GLN   2           HA       GLN   2   7.021  13.648  -1.394
  436   1HB   GLN   2          2HB       GLN   2   9.188  13.412  -2.509
  437   2HB   GLN   2          1HB       GLN   2   9.979  13.184  -0.956
  438   1HG   GLN   2          2HG       GLN   2   8.707  11.121  -0.618
  439   2HG   GLN   2          1HG       GLN   2   7.938  11.347  -2.189
  440   1HE2  GLN   2          1HE2      GLN   2   8.778  10.128  -3.708
  441   2HE2  GLN   2          2HE2      GLN   2  10.431   9.641  -3.836
  442    H    TYR   3           H        TYR   3   6.308  11.955  -0.103
  443    HA   TYR   3           HA       TYR   3   7.214  12.007   2.699
  444   1HB   TYR   3          2HB       TYR   3   4.371  11.647   1.726
  445   2HB   TYR   3          1HB       TYR   3   4.900  11.541   3.402
  446    HD1  TYR   3           1HD      TYR   3   4.817  13.435   4.741
  447    HD2  TYR   3           2HD      TYR   3   4.877  13.900   0.512
  448    HE1  TYR   3           1HE      TYR   3   4.450  15.850   5.007
  449    HE2  TYR   3           2HE      TYR   3   4.515  16.318   0.767
  450    HH   TYR   3           HH       TYR   3   5.088  18.011   3.269
  451    H    LYS   4           H        LYS   4   7.370  10.045   3.750
  452    HA   LYS   4           HA       LYS   4   7.161   7.692   1.999
  453   1HB   LYS   4          2HB       LYS   4   9.413   8.143   2.878
  454   2HB   LYS   4          1HB       LYS   4   8.786   8.080   4.518
  455   1HG   LYS   4          2HG       LYS   4   8.282   5.754   4.310
  456   2HG   LYS   4          1HG       LYS   4   8.672   5.776   2.590
  457   1HD   LYS   4          2HD       LYS   4  10.495   4.788   3.843
  458   2HD   LYS   4          1HD       LYS   4  11.007   6.324   3.146
  459   1HE   LYS   4          2HE       LYS   4  10.022   6.039   5.977
  460   2HE   LYS   4          1HE       LYS   4  11.720   5.894   5.529
  461   1HZ   LYS   4          1HZ       LYS   4  10.900   8.230   4.367
  462   2HZ   LYS   4          2HZ       LYS   4  11.816   8.084   5.778
  463   3HZ   LYS   4          3HZ       LYS   4  10.136   8.242   5.876
  464    H    VAL   5           H        VAL   5   5.276   6.684   2.294
  465    HA   VAL   5           HA       VAL   5   4.067   6.667   4.947
  466    HB   VAL   5           HB       VAL   5   2.929   5.678   2.329
  467   1HG1  VAL   5          1HG1      VAL   5   1.829   5.886   5.104
  468   2HG1  VAL   5          2HG1      VAL   5   1.721   4.553   3.957
  469   3HG1  VAL   5          3HG1      VAL   5   0.759   6.009   3.707
  470   1HG2  VAL   5          1HG2      VAL   5   1.461   7.837   2.905
  471   2HG2  VAL   5          2HG2      VAL   5   2.923   7.909   1.922
  472   3HG2  VAL   5          3HG2      VAL   5   2.991   8.334   3.631
  473    H    ILE   6           H        ILE   6   3.949   4.962   6.212
  474    HA   ILE   6           HA       ILE   6   5.143   2.446   5.296
  475    HB   ILE   6           HB       ILE   6   4.710   3.581   8.056
  476   1HG1  ILE   6          2HG1      ILE   6   7.209   2.735   6.578
  477   2HG1  ILE   6          1HG1      ILE   6   6.662   4.394   6.785
  478   1HG2  ILE   6          1HG2      ILE   6   5.074   0.788   7.222
  479   2HG2  ILE   6          2HG2      ILE   6   4.403   1.455   8.711
  480   3HG2  ILE   6          3HG2      ILE   6   6.151   1.335   8.508
  481   1HD1  ILE   6          1HD1      ILE   6   8.068   4.370   8.526
  482   2HD1  ILE   6          2HD1      ILE   6   8.042   2.610   8.654
  483   3HD1  ILE   6          3HD1      ILE   6   6.734   3.566   9.354
  484    H    LEU   7           H        LEU   7   3.784   0.915   4.701
  485    HA   LEU   7           HA       LEU   7   1.042   0.930   5.715
  486   1HB   LEU   7          2HB       LEU   7   2.106  -0.956   3.630
  487   2HB   LEU   7          1HB       LEU   7   0.462  -0.386   3.857
  488    HG   LEU   7           HG       LEU   7   2.775   1.183   2.739
  489   1HD1  LEU   7          1HD1      LEU   7   1.365   1.278   0.736
  490   2HD1  LEU   7          2HD1      LEU   7   0.175   0.251   1.535
  491   3HD1  LEU   7          3HD1      LEU   7   1.781  -0.379   1.174
  492   1HD2  LEU   7          1HD2      LEU   7   1.427   2.617   4.166
  493   2HD2  LEU   7          2HD2      LEU   7  -0.038   2.086   3.340
  494   3HD2  LEU   7          3HD2      LEU   7   1.180   3.018   2.466
  495    H    ASN   8           H        ASN   8   1.361   0.144   7.800
  496    HA   ASN   8           HA       ASN   8   2.633  -2.463   8.141
  497   1HB   ASN   8          2HB       ASN   8   3.215  -0.515   9.606
  498   2HB   ASN   8          1HB       ASN   8   1.575  -0.575  10.245
  499   1HD2  ASN   8          1HD2      ASN   8   4.554  -1.271  11.043
  500   2HD2  ASN   8          2HD2      ASN   8   4.334  -2.694  12.002
  501    H    GLY   9           H        GLY   9   1.239  -4.131   7.713
  502   1HA   GLY   9          2HA       GLY   9  -1.453  -3.943   8.911
  503   2HA   GLY   9          1HA       GLY   9  -1.085  -4.870   7.471
  504    H    LYS  10           H        LYS  10  -2.249  -6.528   8.737
  505    HA   LYS  10           HA       LYS  10  -1.032  -7.674  11.037
  506   1HB   LYS  10          2HB       LYS  10  -3.185  -8.585   9.146
  507   2HB   LYS  10          1HB       LYS  10  -2.587  -9.642  10.412
  508   1HG   LYS  10          2HG       LYS  10  -3.707  -6.904  10.929
  509   2HG   LYS  10          1HG       LYS  10  -4.665  -8.381  10.975
  510   1HD   LYS  10          2HD       LYS  10  -2.237  -7.819  12.675
  511   2HD   LYS  10          1HD       LYS  10  -3.912  -7.669  13.211
  512   1HE   LYS  10          2HE       LYS  10  -4.250 -10.061  12.722
  513   2HE   LYS  10          1HE       LYS  10  -2.553 -10.190  12.268
  514   1HZ   LYS  10          1HZ       LYS  10  -2.762 -10.930  14.496
  515   2HZ   LYS  10          2HZ       LYS  10  -3.651  -9.564  14.950
  516   3HZ   LYS  10          3HZ       LYS  10  -2.013  -9.413  14.558
  517    H    THR  11           H        THR  11  -1.329  -8.874   7.680
  518    HA   THR  11           HA       THR  11   1.034 -10.554   8.143
  519    HB   THR  11           HB       THR  11   0.014 -11.780   6.089
  520    HG1  THR  11           1HG      THR  11  -1.652  -9.919   6.087
  521   1HG2  THR  11          1HG2      THR  11  -0.617 -13.344   7.518
  522   2HG2  THR  11          2HG2      THR  11  -1.912 -12.328   8.152
  523   3HG2  THR  11          3HG2      THR  11  -0.283 -12.196   8.814
  524    H    LEU  12           H        LEU  12   0.559  -7.670   7.043
  525    HA   LEU  12           HA       LEU  12   2.382  -8.018   4.788
  526   1HB   LEU  12          2HB       LEU  12   0.182  -7.823   3.807
  527   2HB   LEU  12          1HB       LEU  12  -0.144  -6.380   4.744
  528    HG   LEU  12           HG       LEU  12   1.514  -5.139   3.501
  529   1HD1  LEU  12          1HD1      LEU  12   3.250  -6.228   2.653
  530   2HD1  LEU  12          2HD1      LEU  12   2.187  -6.835   1.380
  531   3HD1  LEU  12          3HD1      LEU  12   2.435  -7.775   2.847
  532   1HD2  LEU  12          1HD2      LEU  12   0.323  -6.264   1.142
  533   2HD2  LEU  12          2HD2      LEU  12  -0.006  -4.724   1.932
  534   3HD2  LEU  12          3HD2      LEU  12  -0.867  -6.176   2.439
  535    H    LYS  13           H        LYS  13   3.909  -6.485   4.581
  536    HA   LYS  13           HA       LYS  13   3.721  -4.022   6.128
  537   1HB   LYS  13          2HB       LYS  13   6.030  -5.955   6.431
  538   2HB   LYS  13          1HB       LYS  13   5.927  -4.356   7.155
  539   1HG   LYS  13          2HG       LYS  13   3.987  -5.075   8.463
  540   2HG   LYS  13          1HG       LYS  13   4.102  -6.680   7.740
  541   1HD   LYS  13          2HD       LYS  13   6.331  -6.957   8.710
  542   2HD   LYS  13          1HD       LYS  13   6.220  -5.349   9.428
  543   1HE   LYS  13          2HE       LYS  13   4.415  -7.691  10.028
  544   2HE   LYS  13          1HE       LYS  13   5.708  -7.088  11.064
  545   1HZ   LYS  13          1HZ       LYS  13   3.033  -6.087  10.691
  546   2HZ   LYS  13          2HZ       LYS  13   4.218  -4.881  10.634
  547   3HZ   LYS  13          3HZ       LYS  13   4.094  -5.880  11.992
  548    H    GLY  14           H        GLY  14   4.967  -2.331   5.277
  549   1HA   GLY  14          2HA       GLY  14   7.020  -2.689   3.373
  550   2HA   GLY  14          1HA       GLY  14   5.500  -2.443   2.532
  551    H    GLU  15           H        GLU  15   6.855  -0.607   1.729
  552    HA   GLU  15           HA       GLU  15   6.163   1.771   3.263
  553   1HB   GLU  15          2HB       GLU  15   8.960   1.234   2.244
  554   2HB   GLU  15          1HB       GLU  15   8.403   2.756   2.925
  555   1HG   GLU  15          2HG       GLU  15   7.955   1.628   5.053
  556   2HG   GLU  15          1HG       GLU  15   8.549   0.118   4.367
  557    H    THR  16           H        THR  16   5.554   3.442   2.029
  558    HA   THR  16           HA       THR  16   6.029   3.296  -0.860
  559    HB   THR  16           HB       THR  16   3.836   2.546  -0.819
  560    HG1  THR  16           1HG      THR  16   3.452   5.331  -0.775
  561   1HG2  THR  16          1HG2      THR  16   3.636   3.999   1.699
  562   2HG2  THR  16          2HG2      THR  16   2.823   2.530   1.163
  563   3HG2  THR  16          3HG2      THR  16   2.198   4.108   0.686
  564    H    THR  17           H        THR  17   5.455   5.448  -1.957
  565    HA   THR  17           HA       THR  17   5.858   7.721  -0.169
  566    HB   THR  17           HB       THR  17   7.673   8.599  -1.621
  567    HG1  THR  17           1HG      THR  17   7.574   5.997  -2.739
  568   1HG2  THR  17          1HG2      THR  17   9.451   7.045  -0.892
  569   2HG2  THR  17          2HG2      THR  17   8.201   5.938  -0.328
  570   3HG2  THR  17          3HG2      THR  17   8.361   7.534   0.405
  571    H    THR  18           H        THR  18   4.422   9.204  -0.608
  572    HA   THR  18           HA       THR  18   3.409   9.532  -3.368
  573    HB   THR  18           HB       THR  18   1.703   8.991  -1.650
  574    HG1  THR  18           1HG      THR  18   1.230  10.407  -3.434
  575   1HG2  THR  18          1HG2      THR  18   1.084  10.907  -0.088
  576   2HG2  THR  18          2HG2      THR  18   2.741  11.463  -0.325
  577   3HG2  THR  18          3HG2      THR  18   2.435   9.872   0.373
  578    H    GLU  19           H        GLU  19   3.455  11.589  -4.298
  579    HA   GLU  19           HA       GLU  19   5.129  13.564  -2.881
  580   1HB   GLU  19          2HB       GLU  19   5.969  12.664  -5.065
  581   2HB   GLU  19          1HB       GLU  19   4.561  13.362  -5.850
  582   1HG   GLU  19          2HG       GLU  19   6.627  14.938  -4.333
  583   2HG   GLU  19          1HG       GLU  19   6.617  14.715  -6.080
  584    H    ALA  20           H        ALA  20   3.945  15.143  -1.946
  585    HA   ALA  20           HA       ALA  20   1.825  16.383  -3.527
  586   1HB   ALA  20          1HB       ALA  20   0.123  16.025  -2.063
  587   2HB   ALA  20          2HB       ALA  20   1.196  15.909  -0.668
  588   3HB   ALA  20          3HB       ALA  20   1.048  14.549  -1.782
  589    H    VAL  21           H        VAL  21   1.273  18.471  -2.906
  590    HA   VAL  21           HA       VAL  21   3.317  20.194  -2.279
  591    HB   VAL  21           HB       VAL  21   0.422  20.757  -1.644
  592   1HG1  VAL  21          1HG1      VAL  21   2.634  22.608  -2.518
  593   2HG1  VAL  21          2HG1      VAL  21   2.075  22.414  -0.857
  594   3HG1  VAL  21          3HG1      VAL  21   0.986  23.058  -2.084
  595   1HG2  VAL  21          1HG2      VAL  21   0.474  21.708  -4.032
  596   2HG2  VAL  21          2HG2      VAL  21   0.320  19.962  -3.832
  597   3HG2  VAL  21          3HG2      VAL  21   1.879  20.666  -4.262
  598    H    ASP  22           H        ASP  22   1.313  18.409  -0.072
  599    HA   ASP  22           HA       ASP  22   3.011  19.190   2.125
  600   1HB   ASP  22          2HB       ASP  22   1.105  19.941   3.577
  601   2HB   ASP  22          1HB       ASP  22   1.517  21.050   2.273
  602    H    ALA  23           H        ALA  23   2.104  18.184   4.252
  603    HA   ALA  23           HA       ALA  23   2.059  15.418   3.920
  604   1HB   ALA  23          1HB       ALA  23   2.741  15.879   6.025
  605   2HB   ALA  23          2HB       ALA  23   1.031  15.651   6.390
  606   3HB   ALA  23          3HB       ALA  23   1.676  17.277   6.177
  607    H    ALA  24           H        ALA  24  -0.604  17.681   4.447
  608    HA   ALA  24           HA       ALA  24  -2.633  15.743   4.718
  609   1HB   ALA  24          1HB       ALA  24  -2.498  18.642   4.310
  610   2HB   ALA  24          2HB       ALA  24  -3.580  17.689   5.326
  611   3HB   ALA  24          3HB       ALA  24  -3.927  17.885   3.609
  612    H    THR  25           H        THR  25  -1.640  17.657   1.860
  613    HA   THR  25           HA       THR  25  -3.323  16.471   0.010
  614    HB   THR  25           HB       THR  25  -1.521  17.055  -1.662
  615    HG1  THR  25           1HG      THR  25  -0.111  17.415   0.690
  616   1HG2  THR  25          1HG2      THR  25  -2.473  19.106   0.288
  617   2HG2  THR  25          2HG2      THR  25  -3.051  18.775  -1.345
  618   3HG2  THR  25          3HG2      THR  25  -1.475  19.530  -1.103
  619    H    ALA  26           H        ALA  26  -0.118  15.482   1.142
  620    HA   ALA  26           HA       ALA  26   0.167  13.212  -0.490
  621   1HB   ALA  26          1HB       ALA  26   1.600  14.424   1.629
  622   2HB   ALA  26          2HB       ALA  26   2.138  13.140   0.548
  623   3HB   ALA  26          3HB       ALA  26   1.348  12.734   2.072
  624    H    GLU  27           H        GLU  27  -1.025  13.531   2.868
  625    HA   GLU  27           HA       GLU  27  -1.754  10.932   3.355
  626   1HB   GLU  27          2HB       GLU  27  -1.823  12.699   5.042
  627   2HB   GLU  27          1HB       GLU  27  -3.186  13.444   4.218
  628   1HG   GLU  27          2HG       GLU  27  -4.541  11.460   4.666
  629   2HG   GLU  27          1HG       GLU  27  -3.177  10.722   5.504
  630    H    LYS  28           H        LYS  28  -3.714  13.492   1.848
  631    HA   LYS  28           HA       LYS  28  -6.021  11.938   1.435
  632   1HB   LYS  28          2HB       LYS  28  -4.985  14.313  -0.127
  633   2HB   LYS  28          1HB       LYS  28  -6.609  13.650  -0.267
  634   1HG   LYS  28          2HG       LYS  28  -5.396  14.864   2.206
  635   2HG   LYS  28          1HG       LYS  28  -6.597  15.613   1.151
  636   1HD   LYS  28          2HD       LYS  28  -6.998  13.041   2.679
  637   2HD   LYS  28          1HD       LYS  28  -7.585  14.626   3.193
  638   1HE   LYS  28          2HE       LYS  28  -8.924  14.782   1.142
  639   2HE   LYS  28          1HE       LYS  28  -8.345  13.191   0.650
  640   1HZ   LYS  28          1HZ       LYS  28 -10.192  13.893   2.834
  641   2HZ   LYS  28          2HZ       LYS  28  -9.309  12.452   2.905
  642   3HZ   LYS  28          3HZ       LYS  28 -10.371  12.730   1.618
  643    H    VAL  29           H        VAL  29  -3.208  12.581  -0.602
  644    HA   VAL  29           HA       VAL  29  -4.019  11.254  -2.901
  645    HB   VAL  29           HB       VAL  29  -1.247  11.547  -1.726
  646   1HG1  VAL  29          1HG1      VAL  29  -0.883   9.831  -3.210
  647   2HG1  VAL  29          2HG1      VAL  29  -0.647  11.236  -4.250
  648   3HG1  VAL  29          3HG1      VAL  29  -2.173  10.352  -4.293
  649   1HG2  VAL  29          1HG2      VAL  29  -2.024  13.048  -4.129
  650   2HG2  VAL  29          2HG2      VAL  29  -1.120  13.567  -2.707
  651   3HG2  VAL  29          3HG2      VAL  29  -2.881  13.498  -2.654
  652    H    VAL  30           H        VAL  30  -2.385   9.996  -0.028
  653    HA   VAL  30           HA       VAL  30  -2.147   7.347  -1.002
  654    HB   VAL  30           HB       VAL  30  -2.279   8.339   1.852
  655   1HG1  VAL  30          1HG1      VAL  30  -0.792   5.888   1.358
  656   2HG1  VAL  30          2HG1      VAL  30  -2.508   5.730   0.985
  657   3HG1  VAL  30          3HG1      VAL  30  -1.999   6.248   2.591
  658   1HG2  VAL  30          1HG2      VAL  30  -0.075   8.797   1.771
  659   2HG2  VAL  30          2HG2      VAL  30  -0.391   8.973   0.044
  660   3HG2  VAL  30          3HG2      VAL  30   0.271   7.463   0.670
  661    H    LYS  31           H        LYS  31  -4.554   8.984   1.065
  662    HA   LYS  31           HA       LYS  31  -6.244   6.902   1.621
  663   1HB   LYS  31          2HB       LYS  31  -6.773   9.800   1.084
  664   2HB   LYS  31          1HB       LYS  31  -8.105   8.696   1.407
  665   1HG   LYS  31          2HG       LYS  31  -7.090   8.098   3.544
  666   2HG   LYS  31          1HG       LYS  31  -5.763   9.219   3.224
  667   1HD   LYS  31          2HD       LYS  31  -7.301  11.086   3.209
  668   2HD   LYS  31          1HD       LYS  31  -8.673   9.991   3.404
  669   1HE   LYS  31          2HE       LYS  31  -7.777   9.273   5.577
  670   2HE   LYS  31          1HE       LYS  31  -6.429  10.395   5.382
  671   1HZ   LYS  31          1HZ       LYS  31  -8.690  10.999   6.660
  672   2HZ   LYS  31          2HZ       LYS  31  -9.071  11.564   5.112
  673   3HZ   LYS  31          3HZ       LYS  31  -7.701  12.153   5.913
  674    H    GLN  32           H        GLN  32  -6.265   8.946  -1.261
  675    HA   GLN  32           HA       GLN  32  -8.393   7.545  -2.522
  676   1HB   GLN  32          2HB       GLN  32  -7.823   9.799  -3.185
  677   2HB   GLN  32          1HB       GLN  32  -6.224   9.279  -3.709
  678   1HG   GLN  32          2HG       GLN  32  -7.156   8.005  -5.502
  679   2HG   GLN  32          1HG       GLN  32  -8.792   8.278  -4.911
  680   1HE2  GLN  32          1HE2      GLN  32  -7.508  11.150  -4.333
  681   2HE2  GLN  32          2HE2      GLN  32  -7.776  11.940  -5.840
  682    H    PHE  33           H        PHE  33  -4.920   7.207  -2.476
  683    HA   PHE  33           HA       PHE  33  -4.473   5.418  -4.538
  684   1HB   PHE  33          2HB       PHE  33  -2.735   6.504  -3.106
  685   2HB   PHE  33          1HB       PHE  33  -3.167   5.403  -1.804
  686    HD1  PHE  33           1HD      PHE  33  -1.798   5.580  -5.217
  687    HD2  PHE  33           2HD      PHE  33  -2.233   3.241  -1.673
  688    HE1  PHE  33           1HE      PHE  33  -0.177   3.945  -6.079
  689    HE2  PHE  33           2HE      PHE  33  -0.612   1.613  -2.555
  690    HZ   PHE  33           HZ       PHE  33   0.406   1.978  -4.770
  691    H    PHE  34           H        PHE  34  -5.279   4.739  -1.177
  692    HA   PHE  34           HA       PHE  34  -5.648   1.908  -1.637
  693   1HB   PHE  34          2HB       PHE  34  -6.277   3.608   0.778
  694   2HB   PHE  34          1HB       PHE  34  -6.364   1.845   0.727
  695    HD1  PHE  34           1HD      PHE  34  -4.045   1.070  -0.757
  696    HD2  PHE  34           2HD      PHE  34  -4.472   4.177   2.109
  697    HE1  PHE  34           1HE      PHE  34  -1.638   0.948  -0.277
  698    HE2  PHE  34           2HE      PHE  34  -2.071   4.058   2.606
  699    HZ   PHE  34           HZ       PHE  34  -0.653   2.443   1.398
  700    H    ASN  35           H        ASN  35  -7.673   4.737  -1.288
  701    HA   ASN  35           HA       ASN  35 -10.191   3.641  -1.060
  702   1HB   ASN  35          2HB       ASN  35  -9.612   6.087  -1.107
  703   2HB   ASN  35          1HB       ASN  35  -9.438   5.966  -2.855
  704   1HD2  ASN  35          1HD2      ASN  35 -11.419   6.919  -0.515
  705   2HD2  ASN  35          2HD2      ASN  35 -12.948   6.742  -1.298
  706    H    ASP  36           H        ASP  36  -8.160   4.035  -3.867
  707    HA   ASP  36           HA       ASP  36 -10.118   2.750  -5.613
  708   1HB   ASP  36          2HB       ASP  36  -7.457   4.022  -6.281
  709   2HB   ASP  36          1HB       ASP  36  -8.605   3.388  -7.454
  710    H    ASN  37           H        ASN  37  -7.130   1.943  -3.991
  711    HA   ASN  37           HA       ASN  37  -6.560  -0.302  -5.721
  712   1HB   ASN  37          2HB       ASN  37  -5.452   0.493  -3.019
  713   2HB   ASN  37          1HB       ASN  37  -4.935  -0.944  -3.891
  714   1HD2  ASN  37          1HD2      ASN  37  -3.571   1.603  -3.056
  715   2HD2  ASN  37          2HD2      ASN  37  -2.834   2.183  -4.509
  716    H    GLY  38           H        GLY  38  -7.863   0.227  -2.515
  717   1HA   GLY  38          2HA       GLY  38  -8.435  -1.684  -1.071
  718   2HA   GLY  38          1HA       GLY  38  -9.846  -0.972  -1.819
  719    H    VAL  39           H        VAL  39 -11.228  -2.374  -2.528
  720    HA   VAL  39           HA       VAL  39 -10.484  -5.126  -2.810
  721    HB   VAL  39           HB       VAL  39 -13.181  -3.835  -3.078
  722   1HG1  VAL  39          1HG1      VAL  39 -12.286  -6.689  -3.117
  723   2HG1  VAL  39          2HG1      VAL  39 -13.467  -5.873  -4.142
  724   3HG1  VAL  39          3HG1      VAL  39 -13.872  -6.265  -2.471
  725   1HG2  VAL  39          1HG2      VAL  39 -12.775  -3.493  -0.878
  726   2HG2  VAL  39          2HG2      VAL  39 -11.565  -4.774  -0.790
  727   3HG2  VAL  39          3HG2      VAL  39 -13.282  -5.180  -0.767
  728    H    ASP  40           H        ASP  40 -12.200  -2.932  -5.112
  729    HA   ASP  40           HA       ASP  40 -11.841  -4.965  -7.141
  730   1HB   ASP  40          2HB       ASP  40 -13.300  -2.326  -7.217
  731   2HB   ASP  40          1HB       ASP  40 -13.290  -3.512  -8.518
  732    H    GLY  41           H        GLY  41  -9.447  -3.437  -6.257
  733   1HA   GLY  41          2HA       GLY  41  -8.797  -1.596  -8.346
  734   2HA   GLY  41          1HA       GLY  41  -7.665  -2.309  -7.206
  735    H    GLU  42           H        GLU  42  -7.025  -1.905  -9.908
  736    HA   GLU  42           HA       GLU  42  -7.292  -4.474 -11.253
  737   1HB   GLU  42          2HB       GLU  42  -5.812  -1.966 -12.078
  738   2HB   GLU  42          1HB       GLU  42  -6.043  -3.389 -13.084
  739   1HG   GLU  42          2HG       GLU  42  -8.458  -3.037 -13.034
  740   2HG   GLU  42          1HG       GLU  42  -8.227  -1.611 -12.025
  741    H    TRP  43           H        TRP  43  -6.078  -5.992 -10.199
  742    HA   TRP  43           HA       TRP  43  -3.318  -5.331  -9.491
  743   1HB   TRP  43          2HB       TRP  43  -5.020  -7.718  -8.777
  744   2HB   TRP  43          1HB       TRP  43  -3.387  -7.425  -8.195
  745    HD1  TRP  43           HD       TRP  43  -6.063  -4.668  -8.339
  746    HE1  TRP  43           1HE      TRP  43  -6.562  -3.905  -5.936
  747    HE3  TRP  43           3HE      TRP  43  -3.278  -8.116  -5.830
  748    HZ2  TRP  43           2HZ      TRP  43  -5.842  -4.664  -3.315
  749    HZ3  TRP  43           3HZ      TRP  43  -3.231  -8.033  -3.381
  750    HH2  TRP  43           HH       TRP  43  -4.486  -6.338  -2.149
  751    H    THR  44           H        THR  44  -1.717  -5.864 -10.797
  752    HA   THR  44           HA       THR  44  -2.015  -8.219 -12.540
  753    HB   THR  44           HB       THR  44  -0.253  -7.176 -13.949
  754    HG1  THR  44           1HG      THR  44   0.574  -5.865 -12.150
  755   1HG2  THR  44          1HG2      THR  44  -2.379  -5.107 -13.576
  756   2HG2  THR  44          2HG2      THR  44  -2.745  -6.687 -14.271
  757   3HG2  THR  44          3HG2      THR  44  -1.575  -5.627 -15.057
  758    H    TYR  45           H        TYR  45  -0.485  -9.842 -12.391
  759    HA   TYR  45           HA       TYR  45   1.561  -9.469 -10.301
  760   1HB   TYR  45          2HB       TYR  45  -0.229 -11.100  -9.753
  761   2HB   TYR  45          1HB       TYR  45   0.234 -12.048 -11.161
  762    HD1  TYR  45           1HD      TYR  45   2.598 -10.370  -8.856
  763    HD2  TYR  45           2HD      TYR  45   0.841 -14.055 -10.057
  764    HE1  TYR  45           1HE      TYR  45   4.234 -11.589  -7.486
  765    HE2  TYR  45           2HE      TYR  45   2.474 -15.284  -8.690
  766    HH   TYR  45           HH       TYR  45   4.647 -14.987  -7.704
  767    H    ASP  46           H        ASP  46   3.649 -10.217 -10.630
  768    HA   ASP  46           HA       ASP  46   4.281 -11.122 -13.360
  769   1HB   ASP  46          2HB       ASP  46   4.968  -8.785 -13.062
  770   2HB   ASP  46          1HB       ASP  46   5.895  -9.230 -11.633
  771    H    ASP  47           H        ASP  47   4.236 -13.291 -12.591
  772    HA   ASP  47           HA       ASP  47   5.495 -14.381 -10.419
  773   1HB   ASP  47          2HB       ASP  47   5.369 -15.587 -13.191
  774   2HB   ASP  47          1HB       ASP  47   5.648 -16.475 -11.695
  775    H    ALA  48           H        ALA  48   6.954 -13.322 -13.424
  776    HA   ALA  48           HA       ALA  48   9.411 -14.530 -13.360
  777   1HB   ALA  48          1HB       ALA  48   8.262 -12.230 -14.628
  778   2HB   ALA  48          2HB       ALA  48   9.554 -13.290 -15.190
  779   3HB   ALA  48          3HB       ALA  48   9.934 -11.902 -14.171
  780    H    THR  49           H        THR  49   8.322 -11.820 -11.399
  781    HA   THR  49           HA       THR  49  10.891 -11.948  -9.961
  782    HB   THR  49           HB       THR  49  10.654  -9.536  -9.484
  783    HG1  THR  49           1HG      THR  49   8.424  -9.753 -11.218
  784   1HG2  THR  49          1HG2      THR  49  11.297 -10.655 -12.009
  785   2HG2  THR  49          2HG2      THR  49  11.913  -9.185 -11.257
  786   3HG2  THR  49          3HG2      THR  49  10.469  -9.119 -12.266
  787    H    LYS  50           H        LYS  50   8.025 -13.081  -9.570
  788    HA   LYS  50           HA       LYS  50   6.553 -13.434  -7.832
  789   1HB   LYS  50          2HB       LYS  50   9.154 -12.983  -6.371
  790   2HB   LYS  50          1HB       LYS  50   7.683 -13.504  -5.565
  791   1HG   LYS  50          2HG       LYS  50   8.265 -15.156  -7.862
  792   2HG   LYS  50          1HG       LYS  50   9.616 -15.118  -6.727
  793   1HD   LYS  50          2HD       LYS  50   6.751 -15.755  -6.015
  794   2HD   LYS  50          1HD       LYS  50   8.039 -16.944  -6.233
  795   1HE   LYS  50          2HE       LYS  50   9.279 -15.964  -4.384
  796   2HE   LYS  50          1HE       LYS  50   8.042 -14.726  -4.186
  797   1HZ   LYS  50          1HZ       LYS  50   7.467 -17.621  -3.941
  798   2HZ   LYS  50          2HZ       LYS  50   6.489 -16.325  -3.471
  799   3HZ   LYS  50          3HZ       LYS  50   7.911 -16.657  -2.623
  800    H    THR  51           H        THR  51   6.640 -10.728  -8.830
  801    HA   THR  51           HA       THR  51   5.925  -9.277  -6.372
  802    HB   THR  51           HB       THR  51   7.245  -8.186  -8.861
  803    HG1  THR  51           1HG      THR  51   8.153  -8.545  -6.204
  804   1HG2  THR  51          1HG2      THR  51   7.309  -6.384  -6.659
  805   2HG2  THR  51          2HG2      THR  51   5.635  -6.800  -7.026
  806   3HG2  THR  51          3HG2      THR  51   6.675  -6.137  -8.286
  807    H    PHE  52           H        PHE  52   4.100  -8.057  -6.374
  808    HA   PHE  52           HA       PHE  52   2.335  -8.357  -8.714
  809   1HB   PHE  52          2HB       PHE  52   1.557  -7.711  -5.861
  810   2HB   PHE  52          1HB       PHE  52   0.466  -8.078  -7.191
  811    HD1  PHE  52           1HD      PHE  52  -0.356 -10.216  -7.383
  812    HD2  PHE  52           2HD      PHE  52   3.310  -9.587  -5.316
  813    HE1  PHE  52           1HE      PHE  52  -0.310 -12.594  -6.750
  814    HE2  PHE  52           2HE      PHE  52   3.365 -11.963  -4.684
  815    HZ   PHE  52           HZ       PHE  52   1.556 -13.471  -5.401
  816    H    THR  53           H        THR  53   1.419  -6.562  -9.654
  817    HA   THR  53           HA       THR  53   2.206  -3.963  -8.521
  818    HB   THR  53           HB       THR  53   1.877  -3.184 -10.985
  819    HG1  THR  53           1HG      THR  53   2.160  -4.711 -12.504
  820   1HG2  THR  53          1HG2      THR  53   4.022  -2.831 -10.461
  821   2HG2  THR  53          2HG2      THR  53   4.285  -4.260 -11.468
  822   3HG2  THR  53          3HG2      THR  53   4.214  -4.419  -9.713
  823    H    VAL  54           H        VAL  54   0.659  -2.660  -7.936
  824    HA   VAL  54           HA       VAL  54  -2.070  -3.163  -8.926
  825    HB   VAL  54           HB       VAL  54  -1.266  -1.920  -6.285
  826   1HG1  VAL  54          1HG1      VAL  54  -3.912  -2.460  -7.588
  827   2HG1  VAL  54          2HG1      VAL  54  -3.332  -0.987  -6.812
  828   3HG1  VAL  54          3HG1      VAL  54  -3.760  -2.389  -5.831
  829   1HG2  VAL  54          1HG2      VAL  54  -0.976  -4.501  -6.792
  830   2HG2  VAL  54          2HG2      VAL  54  -2.709  -4.511  -6.468
  831   3HG2  VAL  54          3HG2      VAL  54  -1.586  -3.925  -5.242
  832    H    THR  55           H        THR  55  -2.813  -1.645 -10.244
  833    HA   THR  55           HA       THR  55  -1.580   1.011 -10.155
  834    HB   THR  55           HB       THR  55  -3.392  -0.049 -12.318
  835    HG1  THR  55           1HG      THR  55  -1.522  -1.372 -12.095
  836   1HG2  THR  55          1HG2      THR  55  -3.149   2.295 -12.512
  837   2HG2  THR  55          2HG2      THR  55  -2.063   1.571 -13.698
  838   3HG2  THR  55          3HG2      THR  55  -1.417   2.209 -12.184
  839    H    GLU  56           H        GLU  56  -2.591   2.397  -8.890
  840    HA   GLU  56           HA       GLU  56  -4.848   2.421  -7.583
  841   1HB   GLU  56          2HB       GLU  56  -4.825   4.763  -7.523
  842   2HB   GLU  56          1HB       GLU  56  -3.161   4.318  -7.887
  843   1HG   GLU  56          2HG       GLU  56  -5.240   5.383  -9.782
  844   2HG   GLU  56          1HG       GLU  56  -3.749   6.162  -9.262
  Start of MODEL   12
    1   1H    MET   1          1HT       MET   1   6.041 -18.632   3.257
    2   2H    MET   1          2HT       MET   1   6.444 -20.067   2.457
    3   3H    MET   1          3HT       MET   1   4.902 -19.395   2.265
    4    HA   MET   1           HA       MET   1   7.470 -18.508   1.145
    5   1HB   MET   1          2HB       MET   1   4.674 -18.913   0.066
    6   2HB   MET   1          1HB       MET   1   6.020 -18.304  -0.886
    7   1HG   MET   1          2HG       MET   1   5.905 -20.999   0.448
    8   2HG   MET   1          1HG       MET   1   5.611 -20.684  -1.262
    9   1HE   MET   1          1HE       MET   1   7.923 -18.393  -1.796
   10   2HE   MET   1          2HE       MET   1   7.386 -19.674  -2.882
   11   3HE   MET   1          3HE       MET   1   9.101 -19.489  -2.515
   12    H    GLN   2           H        GLN   2   7.903 -16.418   0.735
   13    HA   GLN   2           HA       GLN   2   5.936 -14.430   1.651
   14   1HB   GLN   2          2HB       GLN   2   8.039 -14.417   2.911
   15   2HB   GLN   2          1HB       GLN   2   8.944 -14.202   1.419
   16   1HG   GLN   2          2HG       GLN   2   7.864 -12.035   1.078
   17   2HG   GLN   2          1HG       GLN   2   6.972 -12.249   2.583
   18   1HE2  GLN   2          1HE2      GLN   2   7.792 -11.128   4.188
   19   2HE2  GLN   2          2HE2      GLN   2   9.465 -10.791   4.454
   20    H    TYR   3           H        TYR   3   5.496 -12.625   0.370
   21    HA   TYR   3           HA       TYR   3   6.603 -12.684  -2.356
   22   1HB   TYR   3          2HB       TYR   3   3.698 -12.279  -1.607
   23   2HB   TYR   3          1HB       TYR   3   4.361 -12.088  -3.228
   24    HD1  TYR   3           1HD      TYR   3   4.441 -13.919  -4.674
   25    HD2  TYR   3           2HD      TYR   3   3.975 -14.595  -0.499
   26    HE1  TYR   3           1HE      TYR   3   4.064 -16.310  -5.109
   27    HE2  TYR   3           2HE      TYR   3   3.596 -16.987  -0.923
   28    HH   TYR   3           HH       TYR   3   4.137 -18.653  -2.685
   29    H    LYS   4           H        LYS   4   6.805 -10.688  -3.387
   30    HA   LYS   4           HA       LYS   4   6.674  -8.395  -1.555
   31   1HB   LYS   4          2HB       LYS   4   8.900  -8.902  -2.457
   32   2HB   LYS   4          1HB       LYS   4   8.274  -8.752  -4.093
   33   1HG   LYS   4          2HG       LYS   4   7.843  -6.411  -3.772
   34   2HG   LYS   4          1HG       LYS   4   8.288  -6.524  -2.070
   35   1HD   LYS   4          2HD       LYS   4  10.116  -5.558  -3.309
   36   2HD   LYS   4          1HD       LYS   4  10.579  -7.166  -2.753
   37   1HE   LYS   4          2HE       LYS   4   9.500  -6.612  -5.509
   38   2HE   LYS   4          1HE       LYS   4  11.219  -6.590  -5.124
   39   1HZ   LYS   4          1HZ       LYS   4  10.319  -8.968  -4.116
   40   2HZ   LYS   4          2HZ       LYS   4  11.185  -8.754  -5.552
   41   3HZ   LYS   4          3HZ       LYS   4   9.496  -8.817  -5.586
   42    H    VAL   5           H        VAL   5   4.929  -7.183  -1.796
   43    HA   VAL   5           HA       VAL   5   3.645  -7.002  -4.414
   44    HB   VAL   5           HB       VAL   5   2.678  -6.028  -1.719
   45   1HG1  VAL   5          1HG1      VAL   5   1.357  -6.071  -4.424
   46   2HG1  VAL   5          2HG1      VAL   5   1.691  -4.670  -3.407
   47   3HG1  VAL   5          3HG1      VAL   5   0.477  -5.850  -2.911
   48   1HG2  VAL   5          1HG2      VAL   5   2.491  -8.601  -3.111
   49   2HG2  VAL   5          2HG2      VAL   5   0.955  -7.980  -2.505
   50   3HG2  VAL   5          3HG2      VAL   5   2.309  -8.218  -1.399
   51    H    ILE   6           H        ILE   6   3.704  -5.236  -5.617
   52    HA   ILE   6           HA       ILE   6   5.090  -2.872  -4.548
   53    HB   ILE   6           HB       ILE   6   4.824  -3.818  -7.408
   54   1HG1  ILE   6          2HG1      ILE   6   7.193  -3.774  -5.527
   55   2HG1  ILE   6          1HG1      ILE   6   6.341  -5.207  -6.090
   56   1HG2  ILE   6          1HG2      ILE   6   5.653  -1.884  -8.137
   57   2HG2  ILE   6          2HG2      ILE   6   6.826  -1.782  -6.824
   58   3HG2  ILE   6          3HG2      ILE   6   5.171  -1.232  -6.571
   59   1HD1  ILE   6          1HD1      ILE   6   7.036  -4.637  -8.401
   60   2HD1  ILE   6          2HD1      ILE   6   8.381  -4.979  -7.314
   61   3HD1  ILE   6          3HD1      ILE   6   7.995  -3.314  -7.739
   62    H    LEU   7           H        LEU   7   4.010  -1.008  -4.404
   63    HA   LEU   7           HA       LEU   7   1.349  -0.868  -5.643
   64   1HB   LEU   7          2HB       LEU   7   2.323   0.881  -3.398
   65   2HB   LEU   7          1HB       LEU   7   0.670   0.535  -3.871
   66    HG   LEU   7           HG       LEU   7   2.577  -1.375  -2.534
   67   1HD1  LEU   7          1HD1      LEU   7   1.263  -1.147  -0.612
   68   2HD1  LEU   7          2HD1      LEU   7  -0.043  -0.347  -1.490
   69   3HD1  LEU   7          3HD1      LEU   7   1.476   0.501  -1.202
   70   1HD2  LEU   7          1HD2      LEU   7   0.901  -3.027  -2.633
   71   2HD2  LEU   7          2HD2      LEU   7   1.008  -2.367  -4.264
   72   3HD2  LEU   7          3HD2      LEU   7  -0.311  -1.878  -3.203
   73    H    ASN   8           H        ASN   8   1.782  -0.020  -7.622
   74    HA   ASN   8           HA       ASN   8   3.269   2.511  -7.749
   75   1HB   ASN   8          2HB       ASN   8   2.683   0.405  -9.812
   76   2HB   ASN   8          1HB       ASN   8   3.209   2.020 -10.275
   77   1HD2  ASN   8          1HD2      ASN   8   5.243   1.852 -10.885
   78   2HD2  ASN   8          2HD2      ASN   8   6.500   1.059 -10.006
   79    H    GLY   9           H        GLY   9   2.019   4.251  -7.639
   80   1HA   GLY   9          2HA       GLY   9  -0.531   4.208  -9.138
   81   2HA   GLY   9          1HA       GLY   9  -0.315   5.088  -7.631
   82    H    LYS  10           H        LYS  10  -1.143   6.878  -9.012
   83    HA   LYS  10           HA       LYS  10   0.714   7.936 -10.960
   84   1HB   LYS  10          2HB       LYS  10  -1.847   9.090  -9.838
   85   2HB   LYS  10          1HB       LYS  10  -0.920   9.789 -11.158
   86   1HG   LYS  10          2HG       LYS  10  -1.317   7.777 -12.495
   87   2HG   LYS  10          1HG       LYS  10  -2.266   7.095 -11.171
   88   1HD   LYS  10          2HD       LYS  10  -2.892   9.645 -12.661
   89   2HD   LYS  10          1HD       LYS  10  -3.699   8.093 -12.892
   90   1HE   LYS  10          2HE       LYS  10  -3.659   9.709 -10.346
   91   2HE   LYS  10          1HE       LYS  10  -5.014   9.580 -11.467
   92   1HZ   LYS  10          1HZ       LYS  10  -5.018   7.159 -11.022
   93   2HZ   LYS  10          2HZ       LYS  10  -5.375   8.092  -9.656
   94   3HZ   LYS  10          3HZ       LYS  10  -3.843   7.401  -9.828
   95    H    THR  11           H        THR  11  -0.685   9.085  -7.895
   96    HA   THR  11           HA       THR  11   1.546  10.943  -7.578
   97    HB   THR  11           HB       THR  11   0.041  11.756  -5.647
   98    HG1  THR  11           1HG      THR  11  -2.228  11.220  -6.192
   99   1HG2  THR  11          1HG2      THR  11  -0.659  13.372  -6.997
  100   2HG2  THR  11          2HG2      THR  11  -1.606  12.251  -7.975
  101   3HG2  THR  11          3HG2      THR  11   0.112  12.479  -8.307
  102    H    LEU  12           H        LEU  12   0.790   7.846  -6.708
  103    HA   LEU  12           HA       LEU  12   2.535   8.021  -4.366
  104   1HB   LEU  12          2HB       LEU  12   0.256   7.928  -3.524
  105   2HB   LEU  12          1HB       LEU  12  -0.060   6.490  -4.477
  106    HG   LEU  12           HG       LEU  12   1.418   5.186  -3.132
  107   1HD1  LEU  12          1HD1      LEU  12   2.241   6.753  -1.030
  108   2HD1  LEU  12          2HD1      LEU  12   2.462   7.800  -2.428
  109   3HD1  LEU  12          3HD1      LEU  12   3.240   6.225  -2.385
  110   1HD2  LEU  12          1HD2      LEU  12  -0.924   6.263  -2.220
  111   2HD2  LEU  12          2HD2      LEU  12   0.192   6.610  -0.900
  112   3HD2  LEU  12          3HD2      LEU  12  -0.032   4.951  -1.451
  113    H    LYS  13           H        LYS  13   4.017   6.466  -4.199
  114    HA   LYS  13           HA       LYS  13   3.761   4.004  -5.741
  115   1HB   LYS  13          2HB       LYS  13   6.111   5.880  -6.066
  116   2HB   LYS  13          1HB       LYS  13   6.008   4.257  -6.736
  117   1HG   LYS  13          2HG       LYS  13   4.102   4.941  -8.104
  118   2HG   LYS  13          1HG       LYS  13   4.211   6.572  -7.437
  119   1HD   LYS  13          2HD       LYS  13   6.348   5.165  -9.038
  120   2HD   LYS  13          1HD       LYS  13   5.278   6.435  -9.635
  121   1HE   LYS  13          2HE       LYS  13   6.217   7.988  -7.987
  122   2HE   LYS  13          1HE       LYS  13   7.289   6.717  -7.404
  123   1HZ   LYS  13          1HZ       LYS  13   8.575   7.970  -8.871
  124   2HZ   LYS  13          2HZ       LYS  13   7.338   8.099 -10.017
  125   3HZ   LYS  13          3HZ       LYS  13   8.123   6.619  -9.785
  126    H    GLY  14           H        GLY  14   5.049   2.290  -4.942
  127   1HA   GLY  14          2HA       GLY  14   7.081   2.597  -3.025
  128   2HA   GLY  14          1HA       GLY  14   5.558   2.367  -2.183
  129    H    GLU  15           H        GLU  15   6.917   0.507  -1.402
  130    HA   GLU  15           HA       GLU  15   6.251  -1.844  -3.012
  131   1HB   GLU  15          2HB       GLU  15   8.944  -1.387  -1.708
  132   2HB   GLU  15          1HB       GLU  15   8.428  -2.885  -2.466
  133   1HG   GLU  15          2HG       GLU  15   9.783  -1.825  -4.047
  134   2HG   GLU  15          1HG       GLU  15   8.132  -1.546  -4.594
  135    H    THR  16           H        THR  16   5.900  -3.752  -1.802
  136    HA   THR  16           HA       THR  16   6.068  -3.632   1.083
  137    HB   THR  16           HB       THR  16   3.965  -2.673   1.042
  138    HG1  THR  16           1HG      THR  16   3.296  -5.390   0.835
  139   1HG2  THR  16          1HG2      THR  16   2.141  -3.299  -0.470
  140   2HG2  THR  16          2HG2      THR  16   3.236  -4.391  -1.311
  141   3HG2  THR  16          3HG2      THR  16   3.541  -2.657  -1.330
  142    H    THR  17           H        THR  17   5.235  -5.771   2.061
  143    HA   THR  17           HA       THR  17   5.492  -8.006   0.191
  144    HB   THR  17           HB       THR  17   7.151  -9.109   1.683
  145    HG1  THR  17           1HG      THR  17   7.177  -6.559   2.911
  146   1HG2  THR  17          1HG2      THR  17   9.095  -7.590   1.145
  147   2HG2  THR  17          2HG2      THR  17   7.914  -6.506   0.409
  148   3HG2  THR  17          3HG2      THR  17   8.121  -8.141  -0.219
  149    H    THR  18           H        THR  18   3.975  -9.449   0.554
  150    HA   THR  18           HA       THR  18   2.815  -9.711   3.264
  151    HB   THR  18           HB       THR  18   1.254  -8.949   1.453
  152    HG1  THR  18           1HG      THR  18   0.528 -10.178   3.262
  153   1HG2  THR  18          1HG2      THR  18   0.641 -11.375   0.207
  154   2HG2  THR  18          2HG2      THR  18   2.380 -11.150   0.017
  155   3HG2  THR  18          3HG2      THR  18   1.264  -9.904  -0.538
  156    H    GLU  19           H        GLU  19   2.527 -11.793   4.113
  157    HA   GLU  19           HA       GLU  19   4.069 -13.897   2.743
  158   1HB   GLU  19          2HB       GLU  19   4.930 -13.265   4.952
  159   2HB   GLU  19          1HB       GLU  19   3.364 -13.611   5.672
  160   1HG   GLU  19          2HG       GLU  19   3.591 -15.959   5.055
  161   2HG   GLU  19          1HG       GLU  19   5.154 -15.617   4.320
  162    H    ALA  20           H        ALA  20   2.888 -15.438   1.776
  163    HA   ALA  20           HA       ALA  20   0.523 -16.467   3.124
  164   1HB   ALA  20          1HB       ALA  20   0.184 -15.809   0.243
  165   2HB   ALA  20          2HB       ALA  20   0.012 -14.521   1.437
  166   3HB   ALA  20          3HB       ALA  20  -1.024 -15.947   1.522
  167    H    VAL  21           H        VAL  21  -0.112 -18.505   2.462
  168    HA   VAL  21           HA       VAL  21   1.832 -20.348   1.861
  169    HB   VAL  21           HB       VAL  21  -1.089 -20.678   1.169
  170   1HG1  VAL  21          1HG1      VAL  21   0.439 -22.417   0.298
  171   2HG1  VAL  21          2HG1      VAL  21  -0.709 -23.035   1.486
  172   3HG1  VAL  21          3HG1      VAL  21   0.966 -22.739   1.949
  173   1HG2  VAL  21          1HG2      VAL  21  -1.151 -21.729   3.495
  174   2HG2  VAL  21          2HG2      VAL  21  -1.091 -19.969   3.403
  175   3HG2  VAL  21          3HG2      VAL  21   0.369 -20.882   3.787
  176    H    ASP  22           H        ASP  22   0.067 -18.368  -0.367
  177    HA   ASP  22           HA       ASP  22   1.760 -19.219  -2.527
  178   1HB   ASP  22          2HB       ASP  22   0.006 -19.980  -4.044
  179   2HB   ASP  22          1HB       ASP  22   0.050 -20.986  -2.601
  180    H    ALA  23           H        ALA  23   0.928 -18.134  -4.671
  181    HA   ALA  23           HA       ALA  23   1.037 -15.372  -4.275
  182   1HB   ALA  23          1HB       ALA  23   0.639 -17.159  -6.582
  183   2HB   ALA  23          2HB       ALA  23   1.746 -15.801  -6.371
  184   3HB   ALA  23          3HB       ALA  23   0.057 -15.506  -6.779
  185    H    ALA  24           H        ALA  24  -1.733 -17.473  -4.915
  186    HA   ALA  24           HA       ALA  24  -3.643 -15.411  -5.188
  187   1HB   ALA  24          1HB       ALA  24  -3.657 -18.294  -5.035
  188   2HB   ALA  24          2HB       ALA  24  -4.818 -17.208  -5.797
  189   3HB   ALA  24          3HB       ALA  24  -4.981 -17.613  -4.089
  190    H    THR  25           H        THR  25  -2.802 -17.451  -2.371
  191    HA   THR  25           HA       THR  25  -4.463 -16.248  -0.510
  192    HB   THR  25           HB       THR  25  -2.784 -17.020   1.167
  193    HG1  THR  25           1HG      THR  25  -1.259 -17.327  -1.147
  194   1HG2  THR  25          1HG2      THR  25  -4.343 -18.679   0.496
  195   2HG2  THR  25          2HG2      THR  25  -2.745 -19.427   0.539
  196   3HG2  THR  25          3HG2      THR  25  -3.466 -18.973  -1.005
  197    H    ALA  26           H        ALA  26  -1.166 -15.414  -1.519
  198    HA   ALA  26           HA       ALA  26  -0.775 -13.215   0.176
  199   1HB   ALA  26          1HB       ALA  26   0.357 -12.963  -2.528
  200   2HB   ALA  26          2HB       ALA  26   0.741 -14.472  -1.703
  201   3HB   ALA  26          3HB       ALA  26   1.158 -12.930  -0.956
  202    H    GLU  27           H        GLU  27  -1.981 -13.382  -3.174
  203    HA   GLU  27           HA       GLU  27  -2.570 -10.718  -3.563
  204   1HB   GLU  27          2HB       GLU  27  -2.687 -12.195  -5.411
  205   2HB   GLU  27          1HB       GLU  27  -3.862 -13.224  -4.608
  206   1HG   GLU  27          2HG       GLU  27  -4.507 -10.388  -5.309
  207   2HG   GLU  27          1HG       GLU  27  -4.656 -11.684  -6.493
  208    H    LYS  28           H        LYS  28  -4.609 -13.260  -2.146
  209    HA   LYS  28           HA       LYS  28  -6.863 -11.620  -1.690
  210   1HB   LYS  28          2HB       LYS  28  -5.964 -14.144  -0.287
  211   2HB   LYS  28          1HB       LYS  28  -7.546 -13.402  -0.093
  212   1HG   LYS  28          2HG       LYS  28  -6.409 -14.532  -2.641
  213   2HG   LYS  28          1HG       LYS  28  -7.665 -15.259  -1.636
  214   1HD   LYS  28          2HD       LYS  28  -9.106 -13.318  -2.061
  215   2HD   LYS  28          1HD       LYS  28  -7.853 -12.621  -3.087
  216   1HE   LYS  28          2HE       LYS  28  -8.016 -14.526  -4.599
  217   2HE   LYS  28          1HE       LYS  28  -9.237 -15.260  -3.560
  218   1HZ   LYS  28          1HZ       LYS  28 -10.708 -13.417  -4.014
  219   2HZ   LYS  28          2HZ       LYS  28 -10.212 -14.118  -5.471
  220   3HZ   LYS  28          3HZ       LYS  28  -9.529 -12.656  -4.961
  221    H    VAL  29           H        VAL  29  -4.206 -12.645   0.441
  222    HA   VAL  29           HA       VAL  29  -4.997 -11.319   2.751
  223    HB   VAL  29           HB       VAL  29  -2.167 -11.742   1.768
  224   1HG1  VAL  29          1HG1      VAL  29  -1.722 -10.402   3.525
  225   2HG1  VAL  29          2HG1      VAL  29  -2.005 -11.874   4.453
  226   3HG1  VAL  29          3HG1      VAL  29  -3.292 -10.683   4.276
  227   1HG2  VAL  29          1HG2      VAL  29  -2.280 -13.891   2.399
  228   2HG2  VAL  29          2HG2      VAL  29  -4.027 -13.676   2.277
  229   3HG2  VAL  29          3HG2      VAL  29  -3.225 -13.517   3.840
  230    H    VAL  30           H        VAL  30  -3.178 -10.174  -0.035
  231    HA   VAL  30           HA       VAL  30  -2.561  -7.601   0.951
  232    HB   VAL  30           HB       VAL  30  -3.017  -8.461  -1.914
  233   1HG1  VAL  30          1HG1      VAL  30  -1.367  -6.139  -0.951
  234   2HG1  VAL  30          2HG1      VAL  30  -3.059  -5.974  -1.417
  235   3HG1  VAL  30          3HG1      VAL  30  -1.867  -6.513  -2.600
  236   1HG2  VAL  30          1HG2      VAL  30  -1.126  -9.425  -0.209
  237   2HG2  VAL  30          2HG2      VAL  30  -0.281  -8.067  -0.951
  238   3HG2  VAL  30          3HG2      VAL  30  -0.957  -9.342  -1.963
  239    H    LYS  31           H        LYS  31  -5.309  -8.841  -0.972
  240    HA   LYS  31           HA       LYS  31  -6.694  -6.507  -1.418
  241   1HB   LYS  31          2HB       LYS  31  -7.876  -9.184  -0.663
  242   2HB   LYS  31          1HB       LYS  31  -8.772  -7.855  -1.380
  243   1HG   LYS  31          2HG       LYS  31  -6.573  -9.458  -2.647
  244   2HG   LYS  31          1HG       LYS  31  -8.281  -9.456  -3.075
  245   1HD   LYS  31          2HD       LYS  31  -7.390  -6.780  -3.209
  246   2HD   LYS  31          1HD       LYS  31  -6.177  -7.773  -4.022
  247   1HE   LYS  31          2HE       LYS  31  -9.137  -7.856  -4.593
  248   2HE   LYS  31          1HE       LYS  31  -7.954  -6.960  -5.542
  249   1HZ   LYS  31          1HZ       LYS  31  -8.125  -8.918  -6.704
  250   2HZ   LYS  31          2HZ       LYS  31  -8.331  -9.867  -5.320
  251   3HZ   LYS  31          3HZ       LYS  31  -6.802  -9.257  -5.706
  252    H    GLN  32           H        GLN  32  -6.854  -8.601   1.430
  253    HA   GLN  32           HA       GLN  32  -8.710  -7.091   2.889
  254   1HB   GLN  32          2HB       GLN  32  -8.039  -9.387   3.498
  255   2HB   GLN  32          1HB       GLN  32  -6.444  -8.798   3.943
  256   1HG   GLN  32          2HG       GLN  32  -7.744  -9.119   5.925
  257   2HG   GLN  32          1HG       GLN  32  -7.472  -7.398   5.685
  258   1HE2  GLN  32          1HE2      GLN  32  -9.764  -8.545   3.491
  259   2HE2  GLN  32          2HE2      GLN  32 -11.182  -8.079   4.354
  260    H    PHE  33           H        PHE  33  -5.209  -6.879   2.639
  261    HA   PHE  33           HA       PHE  33  -4.618  -5.069   4.642
  262   1HB   PHE  33          2HB       PHE  33  -3.011  -6.256   3.070
  263   2HB   PHE  33          1HB       PHE  33  -3.398  -5.029   1.872
  264    HD1  PHE  33           1HD      PHE  33  -2.250  -5.310   5.400
  265    HD2  PHE  33           2HD      PHE  33  -2.027  -3.180   1.712
  266    HE1  PHE  33           1HE      PHE  33  -0.504  -3.854   6.340
  267    HE2  PHE  33           2HE      PHE  33  -0.278  -1.729   2.658
  268    HZ   PHE  33           HZ       PHE  33   0.483  -2.072   4.977
  269    H    PHE  34           H        PHE  34  -5.082  -4.234   1.250
  270    HA   PHE  34           HA       PHE  34  -5.469  -1.464   1.748
  271   1HB   PHE  34          2HB       PHE  34  -6.143  -3.077  -0.716
  272   2HB   PHE  34          1HB       PHE  34  -6.059  -1.314  -0.633
  273    HD1  PHE  34           1HD      PHE  34  -3.745  -0.706   0.850
  274    HD2  PHE  34           2HD      PHE  34  -4.344  -3.890  -1.901
  275    HE1  PHE  34           1HE      PHE  34  -1.323  -0.813   0.459
  276    HE2  PHE  34           2HE      PHE  34  -1.919  -4.000  -2.307
  277    HZ   PHE  34           HZ       PHE  34  -0.414  -2.461  -1.114
  278    H    ASN  35           H        ASN  35  -7.689  -4.150   1.247
  279    HA   ASN  35           HA       ASN  35 -10.105  -2.832   0.974
  280   1HB   ASN  35          2HB       ASN  35  -9.890  -5.271   0.869
  281   2HB   ASN  35          1HB       ASN  35  -9.494  -5.327   2.583
  282   1HD2  ASN  35          1HD2      ASN  35 -11.789  -6.131   0.615
  283   2HD2  ASN  35          2HD2      ASN  35 -13.203  -5.790   1.545
  284    H    ASP  36           H        ASP  36  -8.181  -3.465   3.812
  285    HA   ASP  36           HA       ASP  36 -10.094  -2.143   5.577
  286   1HB   ASP  36          2HB       ASP  36  -7.529  -3.627   6.170
  287   2HB   ASP  36          1HB       ASP  36  -8.547  -2.878   7.398
  288    H    ASN  37           H        ASN  37  -7.067  -1.465   3.996
  289    HA   ASN  37           HA       ASN  37  -6.404   0.726   5.773
  290   1HB   ASN  37          2HB       ASN  37  -5.215  -0.062   3.101
  291   2HB   ASN  37          1HB       ASN  37  -4.587   1.205   4.148
  292   1HD2  ASN  37          1HD2      ASN  37  -3.560  -1.464   3.129
  293   2HD2  ASN  37          2HD2      ASN  37  -2.970  -2.245   4.554
  294    H    GLY  38           H        GLY  38  -7.647   0.279   2.523
  295   1HA   GLY  38          2HA       GLY  38  -7.875   2.326   1.100
  296   2HA   GLY  38          1HA       GLY  38  -9.380   1.601   1.602
  297    H    VAL  39           H        VAL  39 -10.836   2.899   2.371
  298    HA   VAL  39           HA       VAL  39 -10.271   5.663   2.701
  299    HB   VAL  39           HB       VAL  39 -12.822   4.122   3.064
  300   1HG1  VAL  39          1HG1      VAL  39 -13.630   6.640   2.553
  301   2HG1  VAL  39          2HG1      VAL  39 -12.172   6.967   3.491
  302   3HG1  VAL  39          3HG1      VAL  39 -13.463   5.982   4.181
  303   1HG2  VAL  39          1HG2      VAL  39 -12.937   4.122   0.853
  304   2HG2  VAL  39          2HG2      VAL  39 -11.373   4.930   0.763
  305   3HG2  VAL  39          3HG2      VAL  39 -12.855   5.884   0.845
  306    H    ASP  40           H        ASP  40 -11.683   3.316   5.034
  307    HA   ASP  40           HA       ASP  40 -11.253   5.281   7.130
  308   1HB   ASP  40          2HB       ASP  40 -12.605   2.580   7.201
  309   2HB   ASP  40          1HB       ASP  40 -12.543   3.721   8.543
  310    H    GLY  41           H        GLY  41  -8.983   3.760   5.871
  311   1HA   GLY  41          2HA       GLY  41  -8.031   1.828   7.692
  312   2HA   GLY  41          1HA       GLY  41  -7.041   2.743   6.570
  313    H    GLU  42           H        GLU  42  -6.735   1.931   9.465
  314    HA   GLU  42           HA       GLU  42  -6.626   4.498  10.829
  315   1HB   GLU  42          2HB       GLU  42  -5.816   1.734  11.754
  316   2HB   GLU  42          1HB       GLU  42  -5.828   3.174  12.762
  317   1HG   GLU  42          2HG       GLU  42  -8.225   1.910  11.452
  318   2HG   GLU  42          1HG       GLU  42  -7.790   1.801  13.158
  319    H    TRP  43           H        TRP  43  -5.005   5.765  10.110
  320    HA   TRP  43           HA       TRP  43  -2.304   4.572  10.007
  321   1HB   TRP  43          2HB       TRP  43  -3.038   7.052   8.484
  322   2HB   TRP  43          1HB       TRP  43  -1.685   5.967   8.228
  323    HD1  TRP  43           HD       TRP  43  -4.160   3.461   8.278
  324    HE1  TRP  43           1HE      TRP  43  -5.246   3.061   5.967
  325    HE3  TRP  43           3HE      TRP  43  -2.717   7.767   5.949
  326    HZ2  TRP  43           2HZ      TRP  43  -5.446   4.398   3.494
  327    HZ3  TRP  43           3HZ      TRP  43  -3.381   8.127   3.615
  328    HH2  TRP  43           HH       TRP  43  -4.720   6.478   2.409
  329    H    THR  44           H        THR  44  -0.577   5.806  10.815
  330    HA   THR  44           HA       THR  44  -1.354   8.153  12.420
  331    HB   THR  44           HB       THR  44   0.478   7.550  13.975
  332    HG1  THR  44           1HG      THR  44   1.779   5.958  13.565
  333   1HG2  THR  44          1HG2      THR  44  -0.719   6.093  15.215
  334   2HG2  THR  44          2HG2      THR  44  -1.058   5.032  13.850
  335   3HG2  THR  44          3HG2      THR  44  -1.968   6.528  14.051
  336    H    TYR  45           H        TYR  45   0.088   9.924  12.437
  337    HA   TYR  45           HA       TYR  45   2.048   9.861  10.238
  338   1HB   TYR  45          2HB       TYR  45   0.143  11.394   9.900
  339   2HB   TYR  45          1HB       TYR  45   0.567  12.237  11.385
  340    HD1  TYR  45           1HD      TYR  45   2.960  11.001   8.839
  341    HD2  TYR  45           2HD      TYR  45   1.003  14.387  10.513
  342    HE1  TYR  45           1HE      TYR  45   4.446  12.484   7.562
  343    HE2  TYR  45           2HE      TYR  45   2.486  15.880   9.240
  344    HH   TYR  45           HH       TYR  45   3.902  15.881   7.327
  345    H    ASP  46           H        ASP  46   4.094  10.666  10.516
  346    HA   ASP  46           HA       ASP  46   4.847  11.449  13.253
  347   1HB   ASP  46          2HB       ASP  46   5.642   9.179  12.765
  348   2HB   ASP  46          1HB       ASP  46   6.448   9.764  11.312
  349    H    ASP  47           H        ASP  47   4.657  13.647  12.662
  350    HA   ASP  47           HA       ASP  47   5.653  14.977  10.501
  351   1HB   ASP  47          2HB       ASP  47   5.783  15.954  13.362
  352   2HB   ASP  47          1HB       ASP  47   5.820  16.964  11.921
  353    H    ALA  48           H        ALA  48   7.468  13.903  13.329
  354    HA   ALA  48           HA       ALA  48   9.844  15.228  13.015
  355   1HB   ALA  48          1HB       ALA  48  10.838  13.607  14.363
  356   2HB   ALA  48          2HB       ALA  48   9.803  12.322  13.740
  357   3HB   ALA  48          3HB       ALA  48   9.133  13.552  14.813
  358    H    THR  49           H        THR  49   8.668  12.512  11.126
  359    HA   THR  49           HA       THR  49  11.054  12.782   9.420
  360    HB   THR  49           HB       THR  49  10.934  10.354   8.961
  361    HG1  THR  49           1HG      THR  49   8.696  10.137   9.568
  362   1HG2  THR  49          1HG2      THR  49  11.226  11.076  11.864
  363   2HG2  THR  49          2HG2      THR  49  12.500  10.990  10.647
  364   3HG2  THR  49          3HG2      THR  49  11.677   9.520  11.170
  365    H    LYS  50           H        LYS  50   8.017  13.605   9.417
  366    HA   LYS  50           HA       LYS  50   6.324  13.806   7.882
  367   1HB   LYS  50          2HB       LYS  50   8.692  13.649   6.015
  368   2HB   LYS  50          1HB       LYS  50   7.080  14.174   5.546
  369   1HG   LYS  50          2HG       LYS  50   7.632  15.774   7.707
  370   2HG   LYS  50          1HG       LYS  50   9.201  15.626   6.908
  371   1HD   LYS  50          2HD       LYS  50   8.154  16.290   4.782
  372   2HD   LYS  50          1HD       LYS  50   6.614  16.482   5.624
  373   1HE   LYS  50          2HE       LYS  50   7.734  18.633   5.319
  374   2HE   LYS  50          1HE       LYS  50   7.584  18.223   7.026
  375   1HZ   LYS  50          1HZ       LYS  50   9.854  17.675   7.151
  376   2HZ   LYS  50          2HZ       LYS  50   9.796  19.130   6.292
  377   3HZ   LYS  50          3HZ       LYS  50  10.043  17.673   5.469
  378    H    THR  51           H        THR  51   6.894  11.132   8.771
  379    HA   THR  51           HA       THR  51   6.130   9.602   6.375
  380    HB   THR  51           HB       THR  51   7.605   8.639   8.831
  381    HG1  THR  51           1HG      THR  51   8.771   9.934   7.225
  382   1HG2  THR  51          1HG2      THR  51   7.030   6.585   8.266
  383   2HG2  THR  51          2HG2      THR  51   7.899   6.808   6.749
  384   3HG2  THR  51          3HG2      THR  51   6.174   7.163   6.837
  385    H    PHE  52           H        PHE  52   4.417   8.243   6.468
  386    HA   PHE  52           HA       PHE  52   2.752   8.360   8.901
  387   1HB   PHE  52          2HB       PHE  52   1.815   7.824   6.075
  388   2HB   PHE  52          1HB       PHE  52   0.811   8.130   7.485
  389    HD1  PHE  52           1HD      PHE  52  -0.174  10.188   7.581
  390    HD2  PHE  52           2HD      PHE  52   3.605   9.820   5.656
  391    HE1  PHE  52           1HE      PHE  52  -0.243  12.577   6.990
  392    HE2  PHE  52           2HE      PHE  52   3.547  12.209   5.076
  393    HZ   PHE  52           HZ       PHE  52   1.621  13.589   5.742
  394    H    THR  53           H        THR  53   1.744   6.422   9.608
  395    HA   THR  53           HA       THR  53   2.702   3.980   8.279
  396    HB   THR  53           HB       THR  53   2.494   2.967  10.670
  397    HG1  THR  53           1HG      THR  53   1.658   4.864  11.626
  398   1HG2  THR  53          1HG2      THR  53   4.629   2.803   9.976
  399   2HG2  THR  53          2HG2      THR  53   4.854   4.053  11.202
  400   3HG2  THR  53          3HG2      THR  53   4.727   4.499   9.499
  401    H    VAL  54           H        VAL  54   1.221   2.573   7.690
  402    HA   VAL  54           HA       VAL  54  -1.546   3.004   8.588
  403    HB   VAL  54           HB       VAL  54  -0.542   1.531   6.137
  404   1HG1  VAL  54          1HG1      VAL  54  -3.152   2.003   5.664
  405   2HG1  VAL  54          2HG1      VAL  54  -3.191   1.758   7.410
  406   3HG1  VAL  54          3HG1      VAL  54  -2.536   0.504   6.358
  407   1HG2  VAL  54          1HG2      VAL  54  -0.701   3.428   4.967
  408   2HG2  VAL  54          2HG2      VAL  54  -0.663   4.246   6.529
  409   3HG2  VAL  54          3HG2      VAL  54  -2.208   3.894   5.755
  410    H    THR  55           H        THR  55  -1.916   1.758  10.327
  411    HA   THR  55           HA       THR  55  -0.878  -0.977  10.350
  412    HB   THR  55           HB       THR  55  -2.154   0.549  12.618
  413    HG1  THR  55           1HG      THR  55   0.557   0.245  11.861
  414   1HG2  THR  55          1HG2      THR  55  -0.527  -1.978  12.551
  415   2HG2  THR  55          2HG2      THR  55  -2.208  -1.800  13.056
  416   3HG2  THR  55          3HG2      THR  55  -0.916  -1.080  14.019
  417    H    GLU  56           H        GLU  56  -2.154  -2.571   9.724
  418    HA   GLU  56           HA       GLU  56  -4.957  -2.202   9.333
  419   1HB   GLU  56          2HB       GLU  56  -3.635  -3.653   7.870
  420   2HB   GLU  56          1HB       GLU  56  -3.271  -4.710   9.226
  421   1HG   GLU  56          2HG       GLU  56  -5.646  -5.257   9.432
  422   2HG   GLU  56          1HG       GLU  56  -6.001  -4.207   8.062
  423   1H    MET   1          1HT       MET   1   6.537  18.531  -3.079
  424   2H    MET   1          2HT       MET   1   6.962  19.955  -2.272
  425   3H    MET   1          3HT       MET   1   5.404  19.323  -2.103
  426    HA   MET   1           HA       MET   1   7.933  18.373  -0.948
  427   1HB   MET   1          2HB       MET   1   5.133  18.847   0.093
  428   2HB   MET   1          1HB       MET   1   6.449  18.205   1.064
  429   1HG   MET   1          2HG       MET   1   6.419  20.901  -0.271
  430   2HG   MET   1          1HG       MET   1   6.093  20.594   1.434
  431   1HE   MET   1          1HE       MET   1   8.341  18.248   2.001
  432   2HE   MET   1          2HE       MET   1   7.821  19.542   3.078
  433   3HE   MET   1          3HE       MET   1   9.536  19.316   2.736
  434    H    GLN   2           H        GLN   2   8.308  16.273  -0.530
  435    HA   GLN   2           HA       GLN   2   6.307  14.334  -1.475
  436   1HB   GLN   2          2HB       GLN   2   8.426  14.269  -2.706
  437   2HB   GLN   2          1HB       GLN   2   9.305  14.034  -1.201
  438   1HG   GLN   2          2HG       GLN   2   8.170  11.892  -0.875
  439   2HG   GLN   2          1HG       GLN   2   7.304  12.128  -2.393
  440   1HE2  GLN   2          1HE2      GLN   2   8.118  10.987  -3.988
  441   2HE2  GLN   2          2HE2      GLN   2   9.786  10.609  -4.229
  442    H    TYR   3           H        TYR   3   5.805  12.539  -0.200
  443    HA   TYR   3           HA       TYR   3   6.874  12.572   2.541
  444   1HB   TYR   3          2HB       TYR   3   3.974  12.238   1.751
  445   2HB   TYR   3          1HB       TYR   3   4.606  12.032   3.381
  446    HD1  TYR   3           1HD      TYR   3   4.712  13.861   4.827
  447    HD2  TYR   3           2HD      TYR   3   4.319  14.547   0.647
  448    HE1  TYR   3           1HE      TYR   3   4.386  16.259   5.259
  449    HE2  TYR   3           2HE      TYR   3   3.995  16.947   1.067
  450    HH   TYR   3           HH       TYR   3   4.551  18.600   2.836
  451    H    LYS   4           H        LYS   4   7.015  10.574   3.574
  452    HA   LYS   4           HA       LYS   4   6.853   8.284   1.740
  453   1HB   LYS   4          2HB       LYS   4   9.079   8.737   2.673
  454   2HB   LYS   4          1HB       LYS   4   8.426   8.601   4.300
  455   1HG   LYS   4          2HG       LYS   4   7.942   6.272   3.973
  456   2HG   LYS   4          1HG       LYS   4   8.414   6.374   2.277
  457   1HD   LYS   4          2HD       LYS   4  10.201   5.364   3.541
  458   2HD   LYS   4          1HD       LYS   4  10.711   6.959   2.994
  459   1HE   LYS   4          2HE       LYS   4   9.579   6.433   5.733
  460   2HE   LYS   4          1HE       LYS   4  11.302   6.370   5.373
  461   1HZ   LYS   4          1HZ       LYS   4  10.475   8.768   4.351
  462   2HZ   LYS   4          2HZ       LYS   4  11.315   8.533   5.800
  463   3HZ   LYS   4          3HZ       LYS   4   9.627   8.638   5.810
  464    H    VAL   5           H        VAL   5   5.077   7.115   1.956
  465    HA   VAL   5           HA       VAL   5   3.751   6.964   4.555
  466    HB   VAL   5           HB       VAL   5   2.799   6.016   1.846
  467   1HG1  VAL   5          1HG1      VAL   5   1.441   6.090   4.534
  468   2HG1  VAL   5          2HG1      VAL   5   1.755   4.680   3.521
  469   3HG1  VAL   5          3HG1      VAL   5   0.578   5.890   3.008
  470   1HG2  VAL   5          1HG2      VAL   5   2.656   8.590   3.237
  471   2HG2  VAL   5          2HG2      VAL   5   1.114   8.008   2.610
  472   3HG2  VAL   5          3HG2      VAL   5   2.488   8.213   1.522
  473    H    ILE   6           H        ILE   6   3.751   5.198   5.758
  474    HA   ILE   6           HA       ILE   6   5.093   2.802   4.710
  475    HB   ILE   6           HB       ILE   6   4.812   3.753   7.565
  476   1HG1  ILE   6          2HG1      ILE   6   7.205   3.651   5.717
  477   2HG1  ILE   6          1HG1      ILE   6   6.380   5.104   6.270
  478   1HG2  ILE   6          1HG2      ILE   6   5.582   1.801   8.305
  479   2HG2  ILE   6          2HG2      ILE   6   6.771   1.670   7.008
  480   3HG2  ILE   6          3HG2      ILE   6   5.106   1.161   6.732
  481   1HD1  ILE   6          1HD1      ILE   6   7.027   4.519   8.590
  482   2HD1  ILE   6          2HD1      ILE   6   8.396   4.828   7.522
  483   3HD1  ILE   6          3HD1      ILE   6   7.963   3.172   7.942
  484    H    LEU   7           H        LEU   7   3.971   0.964   4.549
  485    HA   LEU   7           HA       LEU   7   1.290   0.889   5.752
  486   1HB   LEU   7          2HB       LEU   7   2.253  -0.883   3.519
  487   2HB   LEU   7          1HB       LEU   7   0.603  -0.497   3.970
  488    HG   LEU   7           HG       LEU   7   2.574   1.365   2.660
  489   1HD1  LEU   7          1HD1      LEU   7   1.281   1.169   0.720
  490   2HD1  LEU   7          2HD1      LEU   7  -0.054   0.401   1.579
  491   3HD1  LEU   7          3HD1      LEU   7   1.447  -0.483   1.312
  492   1HD2  LEU   7          1HD2      LEU   7   0.937   3.056   2.736
  493   2HD2  LEU   7          2HD2      LEU   7   1.006   2.396   4.368
  494   3HD2  LEU   7          3HD2      LEU   7  -0.311   1.938   3.288
  495    H    ASN   8           H        ASN   8   1.673   0.031   7.736
  496    HA   ASN   8           HA       ASN   8   3.098  -2.535   7.884
  497   1HB   ASN   8          2HB       ASN   8   2.534  -0.416   9.938
  498   2HB   ASN   8          1HB       ASN   8   3.014  -2.043  10.408
  499   1HD2  ASN   8          1HD2      ASN   8   5.042  -1.926  11.048
  500   2HD2  ASN   8          2HD2      ASN   8   6.331  -1.163  10.186
  501    H    GLY   9           H        GLY   9   1.806  -4.244   7.756
  502   1HA   GLY   9          2HA       GLY   9  -0.762  -4.140   9.219
  503   2HA   GLY   9          1HA       GLY   9  -0.548  -5.025   7.715
  504    H    LYS  10           H        LYS  10  -1.437  -6.795   9.084
  505    HA   LYS  10           HA       LYS  10   0.365  -7.897  11.058
  506   1HB   LYS  10          2HB       LYS  10  -2.206  -8.988   9.898
  507   2HB   LYS  10          1HB       LYS  10  -1.314  -9.710  11.232
  508   1HG   LYS  10          2HG       LYS  10  -1.683  -7.686  12.562
  509   2HG   LYS  10          1HG       LYS  10  -2.596  -6.984  11.227
  510   1HD   LYS  10          2HD       LYS  10  -3.305  -9.517  12.707
  511   2HD   LYS  10          1HD       LYS  10  -4.077  -7.945  12.927
  512   1HE   LYS  10          2HE       LYS  10  -4.040  -9.564  10.381
  513   2HE   LYS  10          1HE       LYS  10  -5.407  -9.401  11.483
  514   1HZ   LYS  10          1HZ       LYS  10  -5.346  -6.980  11.039
  515   2HZ   LYS  10          2HZ       LYS  10  -5.706  -7.904   9.669
  516   3HZ   LYS  10          3HZ       LYS  10  -4.159  -7.251   9.862
  517    H    THR  11           H        THR  11  -1.015  -9.011   7.974
  518    HA   THR  11           HA       THR  11   1.172 -10.924   7.686
  519    HB   THR  11           HB       THR  11  -0.325 -11.699   5.735
  520    HG1  THR  11           1HG      THR  11  -2.587 -11.108   6.247
  521   1HG2  THR  11          1HG2      THR  11  -1.082 -13.299   7.075
  522   2HG2  THR  11          2HG2      THR  11  -2.015 -12.155   8.039
  523   3HG2  THR  11          3HG2      THR  11  -0.309 -12.423   8.395
  524    H    LEU  12           H        LEU  12   0.505  -7.809   6.806
  525    HA   LEU  12           HA       LEU  12   2.278  -8.027   4.490
  526   1HB   LEU  12          2HB       LEU  12   0.012  -7.877   3.616
  527   2HB   LEU  12          1HB       LEU  12  -0.281  -6.433   4.564
  528    HG   LEU  12           HG       LEU  12   1.248  -5.166   3.239
  529   1HD1  LEU  12          1HD1      LEU  12   2.061  -6.753   1.149
  530   2HD1  LEU  12          2HD1      LEU  12   2.237  -7.806   2.550
  531   3HD1  LEU  12          3HD1      LEU  12   3.053  -6.249   2.518
  532   1HD2  LEU  12          1HD2      LEU  12  -1.107  -6.186   2.295
  533   2HD2  LEU  12          2HD2      LEU  12   0.020  -6.561   0.990
  534   3HD2  LEU  12          3HD2      LEU  12  -0.173  -4.895   1.539
  535    H    LYS  13           H        LYS  13   3.799  -6.507   4.344
  536    HA   LYS  13           HA       LYS  13   3.581  -4.040   5.883
  537   1HB   LYS  13          2HB       LYS  13   5.880  -5.974   6.240
  538   2HB   LYS  13          1HB       LYS  13   5.807  -4.349   6.908
  539   1HG   LYS  13          2HG       LYS  13   3.865  -4.985   8.250
  540   2HG   LYS  13          1HG       LYS  13   3.944  -6.618   7.583
  541   1HD   LYS  13          2HD       LYS  13   6.093  -5.263   9.217
  542   2HD   LYS  13          1HD       LYS  13   4.982  -6.507   9.797
  543   1HE   LYS  13          2HE       LYS  13   5.907  -8.083   8.163
  544   2HE   LYS  13          1HE       LYS  13   7.020  -6.838   7.594
  545   1HZ   LYS  13          1HZ       LYS  13   8.254  -8.121   9.080
  546   2HZ   LYS  13          2HZ       LYS  13   6.998  -8.219  10.208
  547   3HZ   LYS  13          3HZ       LYS  13   7.821  -6.760   9.987
  548    H    GLY  14           H        GLY  14   4.921  -2.357   5.102
  549   1HA   GLY  14          2HA       GLY  14   6.971  -2.715   3.213
  550   2HA   GLY  14          1HA       GLY  14   5.468  -2.448   2.350
  551    H    GLU  15           H        GLU  15   6.882  -0.622   1.588
  552    HA   GLU  15           HA       GLU  15   6.252   1.746   3.190
  553   1HB   GLU  15          2HB       GLU  15   8.950   1.222   1.924
  554   2HB   GLU  15          1HB       GLU  15   8.459   2.733   2.676
  555   1HG   GLU  15          2HG       GLU  15   9.767   1.639   4.274
  556   2HG   GLU  15          1HG       GLU  15   8.101   1.401   4.798
  557    H    THR  16           H        THR  16   5.963   3.661   1.975
  558    HA   THR  16           HA       THR  16   6.170   3.536  -0.907
  559    HB   THR  16           HB       THR  16   4.042   2.628  -0.896
  560    HG1  THR  16           1HG      THR  16   3.439   5.362  -0.698
  561   1HG2  THR  16          1HG2      THR  16   2.214   3.299   0.590
  562   2HG2  THR  16          2HG2      THR  16   3.324   4.365   1.447
  563   3HG2  THR  16          3HG2      THR  16   3.585   2.624   1.471
  564    H    THR  17           H        THR  17   5.402   5.694  -1.897
  565    HA   THR  17           HA       THR  17   5.686   7.923  -0.022
  566    HB   THR  17           HB       THR  17   7.393   8.985  -1.490
  567    HG1  THR  17           1HG      THR  17   7.375   6.434  -2.720
  568   1HG2  THR  17          1HG2      THR  17   9.291   7.420  -0.925
  569   2HG2  THR  17          2HG2      THR  17   8.074   6.364  -0.206
  570   3HG2  THR  17          3HG2      THR  17   8.312   7.993   0.425
  571    H    THR  18           H        THR  18   4.210   9.402  -0.407
  572    HA   THR  18           HA       THR  18   3.096   9.692  -3.133
  573    HB   THR  18           HB       THR  18   1.491   8.968  -1.344
  574    HG1  THR  18           1HG      THR  18   0.820  10.215  -3.162
  575   1HG2  THR  18          1HG2      THR  18   0.921  11.408  -0.106
  576   2HG2  THR  18          2HG2      THR  18   2.651  11.142   0.108
  577   3HG2  THR  18          3HG2      THR  18   1.497   9.922   0.648
  578    H    GLU  19           H        GLU  19   2.870  11.780  -3.985
  579    HA   GLU  19           HA       GLU  19   4.443  13.845  -2.594
  580   1HB   GLU  19          2HB       GLU  19   5.320  13.193  -4.791
  581   2HB   GLU  19          1HB       GLU  19   3.773  13.577  -5.532
  582   1HG   GLU  19          2HG       GLU  19   4.048  15.919  -4.913
  583   2HG   GLU  19          1HG       GLU  19   5.593  15.539  -4.154
  584    H    ALA  20           H        ALA  20   3.286  15.415  -1.643
  585    HA   ALA  20           HA       ALA  20   0.966  16.501  -3.025
  586   1HB   ALA  20          1HB       ALA  20   0.570  15.853  -0.148
  587   2HB   ALA  20          2HB       ALA  20   0.384  14.569  -1.344
  588   3HB   ALA  20          3HB       ALA  20  -0.615  16.019  -1.444
  589    H    VAL  21           H        VAL  21   0.372  18.554  -2.371
  590    HA   VAL  21           HA       VAL  21   2.351  20.350  -1.743
  591    HB   VAL  21           HB       VAL  21  -0.570  20.751  -1.092
  592   1HG1  VAL  21          1HG1      VAL  21   0.987  22.451  -0.199
  593   2HG1  VAL  21          2HG1      VAL  21  -0.129  23.097  -1.402
  594   3HG1  VAL  21          3HG1      VAL  21   1.547  22.762  -1.843
  595   1HG2  VAL  21          1HG2      VAL  21  -0.572  21.804  -3.418
  596   2HG2  VAL  21          2HG2      VAL  21  -0.558  20.041  -3.326
  597   3HG2  VAL  21          3HG2      VAL  21   0.928  20.918  -3.688
  598    H    ASP  22           H        ASP  22   0.509  18.414   0.461
  599    HA   ASP  22           HA       ASP  22   2.191  19.225   2.646
  600   1HB   ASP  22          2HB       ASP  22   0.436  20.027   4.136
  601   2HB   ASP  22          1HB       ASP  22   0.524  21.031   2.695
  602    H    ALA  23           H        ALA  23   1.302  18.159   4.776
  603    HA   ALA  23           HA       ALA  23   1.351  15.395   4.381
  604   1HB   ALA  23          1HB       ALA  23   0.962  17.192   6.682
  605   2HB   ALA  23          2HB       ALA  23   2.040  15.809   6.487
  606   3HB   ALA  23          3HB       ALA  23   0.338  15.554   6.872
  607    H    ALA  24           H        ALA  24  -1.378  17.563   4.983
  608    HA   ALA  24           HA       ALA  24  -3.340  15.548   5.228
  609   1HB   ALA  24          1HB       ALA  24  -3.282  18.431   5.075
  610   2HB   ALA  24          2HB       ALA  24  -4.480  17.374   5.821
  611   3HB   ALA  24          3HB       ALA  24  -4.609  17.783   4.111
  612    H    THR  25           H        THR  25  -2.410  17.567   2.423
  613    HA   THR  25           HA       THR  25  -4.074  16.404   0.538
  614    HB   THR  25           HB       THR  25  -2.353  17.134  -1.114
  615    HG1  THR  25           1HG      THR  25  -0.852  17.405   1.222
  616   1HG2  THR  25          1HG2      THR  25  -3.881  18.833  -0.465
  617   2HG2  THR  25          2HG2      THR  25  -2.266  19.541  -0.485
  618   3HG2  THR  25          3HG2      THR  25  -3.019  19.104   1.049
  619    H    ALA  26           H        ALA  26  -0.812  15.491   1.594
  620    HA   ALA  26           HA       ALA  26  -0.451  13.282  -0.095
  621   1HB   ALA  26          1HB       ALA  26   0.637  13.004   2.625
  622   2HB   ALA  26          2HB       ALA  26   1.068  14.503   1.805
  623   3HB   ALA  26          3HB       ALA  26   1.458  12.950   1.065
  624    H    GLU  27           H        GLU  27  -1.700  13.479   3.238
  625    HA   GLU  27           HA       GLU  27  -2.359  10.831   3.619
  626   1HB   GLU  27          2HB       GLU  27  -2.467  12.310   5.462
  627   2HB   GLU  27          1HB       GLU  27  -3.603  13.367   4.644
  628   1HG   GLU  27          2HG       GLU  27  -4.326  10.547   5.336
  629   2HG   GLU  27          1HG       GLU  27  -4.462  11.848   6.518
  630    H    LYS  28           H        LYS  28  -4.315  13.421   2.173
  631    HA   LYS  28           HA       LYS  28  -6.601  11.838   1.685
  632   1HB   LYS  28          2HB       LYS  28  -5.622  14.338   0.294
  633   2HB   LYS  28          1HB       LYS  28  -7.220  13.634   0.078
  634   1HG   LYS  28          2HG       LYS  28  -6.090  14.738   2.641
  635   2HG   LYS  28          1HG       LYS  28  -7.315  15.492   1.619
  636   1HD   LYS  28          2HD       LYS  28  -8.808  13.588   2.022
  637   2HD   LYS  28          1HD       LYS  28  -7.587  12.860   3.069
  638   1HE   LYS  28          2HE       LYS  28  -7.725  14.770   4.578
  639   2HE   LYS  28          1HE       LYS  28  -8.914  15.533   3.521
  640   1HZ   LYS  28          1HZ       LYS  28 -10.434  13.726   3.953
  641   2HZ   LYS  28          2HZ       LYS  28  -9.942  14.416   5.418
  642   3HZ   LYS  28          3HZ       LYS  28  -9.288  12.938   4.918
  643    H    VAL  29           H        VAL  29  -3.891  12.797  -0.410
  644    HA   VAL  29           HA       VAL  29  -4.681  11.488  -2.730
  645    HB   VAL  29           HB       VAL  29  -1.855  11.844  -1.707
  646   1HG1  VAL  29          1HG1      VAL  29  -1.418  10.492  -3.458
  647   2HG1  VAL  29          2HG1      VAL  29  -1.652  11.970  -4.389
  648   3HG1  VAL  29          3HG1      VAL  29  -2.972  10.811  -4.230
  649   1HG2  VAL  29          1HG2      VAL  29  -1.908  13.993  -2.339
  650   2HG2  VAL  29          2HG2      VAL  29  -3.661  13.821  -2.242
  651   3HG2  VAL  29          3HG2      VAL  29  -2.841  13.643  -3.793
  652    H    VAL  30           H        VAL  30  -2.930  10.300   0.082
  653    HA   VAL  30           HA       VAL  30  -2.363   7.715  -0.897
  654    HB   VAL  30           HB       VAL  30  -2.838   8.586   1.963
  655   1HG1  VAL  30          1HG1      VAL  30  -1.231   6.223   1.022
  656   2HG1  VAL  30          2HG1      VAL  30  -2.933   6.101   1.464
  657   3HG1  VAL  30          3HG1      VAL  30  -1.746   6.610   2.663
  658   1HG2  VAL  30          1HG2      VAL  30  -0.900   9.502   0.285
  659   2HG2  VAL  30          2HG2      VAL  30  -0.099   8.123   1.038
  660   3HG2  VAL  30          3HG2      VAL  30  -0.756   9.417   2.040
  661    H    LYS  31           H        LYS  31  -5.106   9.019   0.988
  662    HA   LYS  31           HA       LYS  31  -6.554   6.720   1.414
  663   1HB   LYS  31          2HB       LYS  31  -7.660   9.427   0.643
  664   2HB   LYS  31          1HB       LYS  31  -8.597   8.118   1.347
  665   1HG   LYS  31          2HG       LYS  31  -6.378   9.668   2.645
  666   2HG   LYS  31          1HG       LYS  31  -8.090   9.708   3.049
  667   1HD   LYS  31          2HD       LYS  31  -7.268   7.010   3.194
  668   2HD   LYS  31          1HD       LYS  31  -6.043   7.975   4.025
  669   1HE   LYS  31          2HE       LYS  31  -9.008   8.130   4.554
  670   2HE   LYS  31          1HE       LYS  31  -7.859   7.205   5.521
  671   1HZ   LYS  31          1HZ       LYS  31  -7.999   9.166   6.680
  672   2HZ   LYS  31          2HZ       LYS  31  -8.163  10.122   5.293
  673   3HZ   LYS  31          3HZ       LYS  31  -6.655   9.474   5.700
  674    H    GLN  32           H        GLN  32  -6.622   8.818  -1.436
  675    HA   GLN  32           HA       GLN  32  -8.493   7.353  -2.921
  676   1HB   GLN  32          2HB       GLN  32  -7.759   9.631  -3.521
  677   2HB   GLN  32          1HB       GLN  32  -6.172   9.003  -3.943
  678   1HG   GLN  32          2HG       GLN  32  -7.435   9.357  -5.942
  679   2HG   GLN  32          1HG       GLN  32  -7.208   7.628  -5.698
  680   1HE2  GLN  32          1HE2      GLN  32  -9.504   8.832  -3.538
  681   2HE2  GLN  32          2HE2      GLN  32 -10.919   8.400  -4.420
  682    H    PHE  33           H        PHE  33  -5.003   7.056  -2.621
  683    HA   PHE  33           HA       PHE  33  -4.428   5.231  -4.617
  684   1HB   PHE  33          2HB       PHE  33  -2.815   6.378  -3.023
  685   2HB   PHE  33          1HB       PHE  33  -3.249   5.162  -1.829
  686    HD1  PHE  33           1HD      PHE  33  -2.044   5.415  -5.342
  687    HD2  PHE  33           2HD      PHE  33  -1.923   3.281  -1.651
  688    HE1  PHE  33           1HE      PHE  33  -0.320   3.916  -6.257
  689    HE2  PHE  33           2HE      PHE  33  -0.199   1.789  -2.572
  690    HZ   PHE  33           HZ       PHE  33   0.604   2.112  -4.880
  691    H    PHE  34           H        PHE  34  -4.959   4.409  -1.231
  692    HA   PHE  34           HA       PHE  34  -5.407   1.649  -1.734
  693   1HB   PHE  34          2HB       PHE  34  -6.076   3.279   0.718
  694   2HB   PHE  34          1HB       PHE  34  -6.034   1.516   0.638
  695    HD1  PHE  34           1HD      PHE  34  -3.715   0.849  -0.813
  696    HD2  PHE  34           2HD      PHE  34  -4.274   4.048   1.931
  697    HE1  PHE  34           1HE      PHE  34  -1.297   0.897  -0.389
  698    HE2  PHE  34           2HE      PHE  34  -1.853   4.098   2.370
  699    HZ   PHE  34           HZ       PHE  34  -0.369   2.524   1.198
  700    H    ASN  35           H        ASN  35  -7.566   4.389  -1.265
  701    HA   ASN  35           HA       ASN  35 -10.019   3.129  -1.027
  702   1HB   ASN  35          2HB       ASN  35  -9.746   5.562  -0.918
  703   2HB   ASN  35          1HB       ASN  35  -9.323   5.609  -2.627
  704   1HD2  ASN  35          1HD2      ASN  35 -11.626   6.469  -0.691
  705   2HD2  ASN  35          2HD2      ASN  35 -13.034   6.162  -1.642
  706    H    ASP  36           H        ASP  36  -8.038   3.715  -3.837
  707    HA   ASP  36           HA       ASP  36  -9.958   2.440  -5.630
  708   1HB   ASP  36          2HB       ASP  36  -7.351   3.860  -6.186
  709   2HB   ASP  36          1HB       ASP  36  -8.369   3.136  -7.428
  710    H    ASN  37           H        ASN  37  -6.972   1.688  -4.006
  711    HA   ASN  37           HA       ASN  37  -6.337  -0.518  -5.774
  712   1HB   ASN  37          2HB       ASN  37  -5.167   0.240  -3.085
  713   2HB   ASN  37          1HB       ASN  37  -4.556  -1.041  -4.123
  714   1HD2  ASN  37          1HD2      ASN  37  -3.479   1.603  -3.090
  715   2HD2  ASN  37          2HD2      ASN  37  -2.852   2.369  -4.507
  716    H    GLY  38           H        GLY  38  -7.616  -0.040  -2.541
  717   1HA   GLY  38          2HA       GLY  38  -7.912  -2.082  -1.121
  718   2HA   GLY  38          1HA       GLY  38  -9.391  -1.320  -1.646
  719    H    VAL  39           H        VAL  39 -10.869  -2.583  -2.435
  720    HA   VAL  39           HA       VAL  39 -10.366  -5.360  -2.758
  721    HB   VAL  39           HB       VAL  39 -12.874  -3.756  -3.156
  722   1HG1  VAL  39          1HG1      VAL  39 -13.750  -6.255  -2.658
  723   2HG1  VAL  39          2HG1      VAL  39 -12.288  -6.618  -3.574
  724   3HG1  VAL  39          3HG1      VAL  39 -13.544  -5.601  -4.282
  725   1HG2  VAL  39          1HG2      VAL  39 -13.020  -3.754  -0.947
  726   2HG2  VAL  39          2HG2      VAL  39 -11.477  -4.599  -0.835
  727   3HG2  VAL  39          3HG2      VAL  39 -12.980  -5.517  -0.938
  728    H    ASP  40           H        ASP  40 -11.689  -2.979  -5.110
  729    HA   ASP  40           HA       ASP  40 -11.277  -4.955  -7.200
  730   1HB   ASP  40          2HB       ASP  40 -12.561  -2.222  -7.291
  731   2HB   ASP  40          1HB       ASP  40 -12.508  -3.364  -8.630
  732    H    GLY  41           H        GLY  41  -8.988  -3.489  -5.909
  733   1HA   GLY  41          2HA       GLY  41  -7.965  -1.580  -7.715
  734   2HA   GLY  41          1HA       GLY  41  -7.013  -2.520  -6.580
  735    H    GLU  42           H        GLU  42  -6.646  -1.715  -9.470
  736    HA   GLU  42           HA       GLU  42  -6.580  -4.285 -10.833
  737   1HB   GLU  42          2HB       GLU  42  -5.690  -1.542 -11.745
  738   2HB   GLU  42          1HB       GLU  42  -5.722  -2.982 -12.754
  739   1HG   GLU  42          2HG       GLU  42  -8.107  -1.659 -11.479
  740   2HG   GLU  42          1HG       GLU  42  -7.644  -1.561 -13.178
  741    H    TRP  43           H        TRP  43  -5.001  -5.592 -10.092
  742    HA   TRP  43           HA       TRP  43  -2.273  -4.465  -9.951
  743   1HB   TRP  43          2HB       TRP  43  -3.089  -6.925  -8.438
  744   2HB   TRP  43          1HB       TRP  43  -1.713  -5.874  -8.162
  745    HD1  TRP  43           HD       TRP  43  -4.126  -3.308  -8.247
  746    HE1  TRP  43           1HE      TRP  43  -5.235  -2.882  -5.953
  747    HE3  TRP  43           3HE      TRP  43  -2.821  -7.647  -5.898
  748    HZ2  TRP  43           2HZ      TRP  43  -5.501  -4.213  -3.482
  749    HZ3  TRP  43           3HZ      TRP  43  -3.526  -7.990  -3.574
  750    HH2  TRP  43           HH       TRP  43  -4.841  -6.309  -2.387
  751    H    THR  44           H        THR  44  -0.564  -5.740 -10.734
  752    HA   THR  44           HA       THR  44  -1.376  -8.067 -12.350
  753    HB   THR  44           HB       THR  44   0.491  -7.509 -13.880
  754    HG1  THR  44           1HG      THR  44   1.826  -5.950 -13.450
  755   1HG2  THR  44          1HG2      THR  44  -0.651  -6.024 -15.136
  756   2HG2  THR  44          2HG2      THR  44  -0.985  -4.954 -13.774
  757   3HG2  THR  44          3HG2      THR  44  -1.929  -6.430 -13.989
  758    H    TYR  45           H        TYR  45   0.022  -9.872 -12.346
  759    HA   TYR  45           HA       TYR  45   1.952  -9.858 -10.120
  760   1HB   TYR  45          2HB       TYR  45   0.007 -11.343  -9.808
  761   2HB   TYR  45          1HB       TYR  45   0.430 -12.196 -11.289
  762    HD1  TYR  45           1HD      TYR  45   2.817 -11.018  -8.709
  763    HD2  TYR  45           2HD      TYR  45   0.802 -14.356 -10.410
  764    HE1  TYR  45           1HE      TYR  45   4.247 -12.537  -7.411
  765    HE2  TYR  45           2HE      TYR  45   2.230 -15.884  -9.117
  766    HH   TYR  45           HH       TYR  45   3.617 -15.920  -7.184
  767    H    ASP  46           H        ASP  46   3.981 -10.711 -10.369
  768    HA   ASP  46           HA       ASP  46   4.755 -11.513 -13.097
  769   1HB   ASP  46          2HB       ASP  46   5.597  -9.264 -12.595
  770   2HB   ASP  46          1HB       ASP  46   6.368  -9.868 -11.132
  771    H    ASP  47           H        ASP  47   4.501 -13.706 -12.508
  772    HA   ASP  47           HA       ASP  47   5.435 -15.061 -10.334
  773   1HB   ASP  47          2HB       ASP  47   5.582 -16.039 -13.192
  774   2HB   ASP  47          1HB       ASP  47   5.574 -17.050 -11.751
  775    H    ALA  48           H        ALA  48   7.315 -14.028 -13.135
  776    HA   ALA  48           HA       ALA  48   9.652 -15.412 -12.787
  777   1HB   ALA  48          1HB       ALA  48  10.705 -13.817 -14.120
  778   2HB   ALA  48          2HB       ALA  48   9.694 -12.507 -13.512
  779   3HB   ALA  48          3HB       ALA  48   9.010 -13.719 -14.594
  780    H    THR  49           H        THR  49   8.517 -12.667 -10.915
  781    HA   THR  49           HA       THR  49  10.872 -12.994  -9.176
  782    HB   THR  49           HB       THR  49  10.805 -10.564  -8.717
  783    HG1  THR  49           1HG      THR  49   8.581 -10.295  -9.357
  784   1HG2  THR  49          1HG2      THR  49  11.119 -11.295 -11.617
  785   2HG2  THR  49          2HG2      THR  49  12.378 -11.238 -10.382
  786   3HG2  THR  49          3HG2      THR  49  11.599  -9.750 -10.915
  787    H    LYS  50           H        LYS  50   7.817 -13.744  -9.215
  788    HA   LYS  50           HA       LYS  50   6.098 -13.905  -7.704
  789   1HB   LYS  50          2HB       LYS  50   8.441 -13.805  -5.804
  790   2HB   LYS  50          1HB       LYS  50   6.812 -14.290  -5.359
  791   1HG   LYS  50          2HG       LYS  50   7.355 -15.904  -7.510
  792   2HG   LYS  50          1HG       LYS  50   8.915 -15.794  -6.690
  793   1HD   LYS  50          2HD       LYS  50   7.823 -16.432  -4.580
  794   2HD   LYS  50          1HD       LYS  50   6.291 -16.586  -5.443
  795   1HE   LYS  50          2HE       LYS  50   7.353 -18.764  -5.123
  796   2HE   LYS  50          1HE       LYS  50   7.238 -18.350  -6.832
  797   1HZ   LYS  50          1HZ       LYS  50   9.521 -17.857  -6.923
  798   2HZ   LYS  50          2HZ       LYS  50   9.416 -19.312  -6.066
  799   3HZ   LYS  50          3HZ       LYS  50   9.687 -17.861  -5.240
  800    H    THR  51           H        THR  51   6.747 -11.245  -8.584
  801    HA   THR  51           HA       THR  51   5.985  -9.696  -6.200
  802    HB   THR  51           HB       THR  51   7.518  -8.770  -8.636
  803    HG1  THR  51           1HG      THR  51   8.628 -10.092  -7.011
  804   1HG2  THR  51          1HG2      THR  51   6.984  -6.703  -8.077
  805   2HG2  THR  51          2HG2      THR  51   7.825  -6.946  -6.546
  806   3HG2  THR  51          3HG2      THR  51   6.094  -7.260  -6.662
  807    H    PHE  52           H        PHE  52   4.307  -8.296  -6.316
  808    HA   PHE  52           HA       PHE  52   2.674  -8.373  -8.774
  809   1HB   PHE  52          2HB       PHE  52   1.710  -7.814  -5.960
  810   2HB   PHE  52          1HB       PHE  52   0.720  -8.096  -7.384
  811    HD1  PHE  52           1HD      PHE  52  -0.314 -10.129  -7.494
  812    HD2  PHE  52           2HD      PHE  52   3.445  -9.854  -5.515
  813    HE1  PHE  52           1HE      PHE  52  -0.450 -12.515  -6.906
  814    HE2  PHE  52           2HE      PHE  52   3.320 -12.239  -4.937
  815    HZ   PHE  52           HZ       PHE  52   1.372 -13.574  -5.632
  816    H    THR  53           H        THR  53   1.724  -6.410  -9.494
  817    HA   THR  53           HA       THR  53   2.721  -3.992  -8.152
  818    HB   THR  53           HB       THR  53   2.572  -2.977 -10.544
  819    HG1  THR  53           1HG      THR  53   1.703  -4.853 -11.513
  820   1HG2  THR  53          1HG2      THR  53   4.700  -2.863  -9.820
  821   2HG2  THR  53          2HG2      THR  53   4.911  -4.120 -11.043
  822   3HG2  THR  53          3HG2      THR  53   4.750  -4.561  -9.343
  823    H    VAL  54           H        VAL  54   1.267  -2.552  -7.583
  824    HA   VAL  54           HA       VAL  54  -1.497  -2.915  -8.520
  825    HB   VAL  54           HB       VAL  54  -0.492  -1.466  -6.057
  826   1HG1  VAL  54          1HG1      VAL  54  -3.120  -1.874  -5.620
  827   2HG1  VAL  54          2HG1      VAL  54  -3.128  -1.628  -7.366
  828   3HG1  VAL  54          3HG1      VAL  54  -2.457  -0.390  -6.304
  829   1HG2  VAL  54          1HG2      VAL  54  -0.714  -3.358  -4.888
  830   2HG2  VAL  54          2HG2      VAL  54  -0.674  -4.177  -6.449
  831   3HG2  VAL  54          3HG2      VAL  54  -2.221  -3.787  -5.697
  832    H    THR  55           H        THR  55  -1.811  -1.661 -10.264
  833    HA   THR  55           HA       THR  55  -0.707   1.048 -10.272
  834    HB   THR  55           HB       THR  55  -1.988  -0.446 -12.558
  835    HG1  THR  55           1HG      THR  55   0.718  -0.209 -11.762
  836   1HG2  THR  55          1HG2      THR  55  -0.301   2.043 -12.467
  837   2HG2  THR  55          2HG2      THR  55  -1.979   1.903 -12.996
  838   3HG2  THR  55          3HG2      THR  55  -0.692   1.152 -13.940
  839    H    GLU  56           H        GLU  56  -1.954   2.674  -9.664
  840    HA   GLU  56           HA       GLU  56  -4.770   2.373  -9.311
  841   1HB   GLU  56          2HB       GLU  56  -3.433   3.790  -7.830
  842   2HB   GLU  56          1HB       GLU  56  -3.026   4.840  -9.181
  843   1HG   GLU  56          2HG       GLU  56  -5.383   5.444  -9.420
  844   2HG   GLU  56          1HG       GLU  56  -5.782   4.401  -8.056
  Start of MODEL   13
    1   1H    MET   1          1HT       MET   1   6.352 -19.999   1.731
    2   2H    MET   1          2HT       MET   1   5.116 -18.857   1.555
    3   3H    MET   1          3HT       MET   1   6.146 -18.786   2.894
    4    HA   MET   1           HA       MET   1   8.021 -18.268   1.493
    5   1HB   MET   1          2HB       MET   1   7.209 -19.549  -0.457
    6   2HB   MET   1          1HB       MET   1   5.959 -18.343  -0.725
    7   1HG   MET   1          2HG       MET   1   7.787 -18.016  -2.261
    8   2HG   MET   1          1HG       MET   1   7.678 -16.658  -1.144
    9   1HE   MET   1          1HE       MET   1   9.818 -16.756  -2.832
   10   2HE   MET   1          2HE       MET   1  11.389 -17.341  -2.281
   11   3HE   MET   1          3HE       MET   1  10.660 -15.927  -1.522
   12    H    GLN   2           H        GLN   2   8.455 -16.084   0.694
   13    HA   GLN   2           HA       GLN   2   6.470 -14.180   1.708
   14   1HB   GLN   2          2HB       GLN   2   8.686 -14.067   2.753
   15   2HB   GLN   2          1HB       GLN   2   9.428 -13.827   1.177
   16   1HG   GLN   2          2HG       GLN   2   8.243 -11.707   0.937
   17   2HG   GLN   2          1HG       GLN   2   7.493 -11.949   2.515
   18   1HE2  GLN   2          1HE2      GLN   2   9.864 -10.345   0.979
   19   2HE2  GLN   2          2HE2      GLN   2  10.972 -10.108   2.283
   20    H    TYR   3           H        TYR   3   5.699 -12.529   0.446
   21    HA   TYR   3           HA       TYR   3   6.574 -12.507  -2.363
   22   1HB   TYR   3          2HB       TYR   3   3.746 -12.317  -1.310
   23   2HB   TYR   3          1HB       TYR   3   4.205 -12.019  -2.987
   24    HD1  TYR   3           1HD      TYR   3   4.162 -13.782  -4.494
   25    HD2  TYR   3           2HD      TYR   3   4.484 -14.641  -0.340
   26    HE1  TYR   3           1HE      TYR   3   3.997 -16.186  -4.986
   27    HE2  TYR   3           2HE      TYR   3   4.316 -17.049  -0.818
   28    HH   TYR   3           HH       TYR   3   3.397 -18.251  -3.892
   29    H    LYS   4           H        LYS   4   6.699 -10.535  -3.382
   30    HA   LYS   4           HA       LYS   4   6.518  -8.213  -1.581
   31   1HB   LYS   4          2HB       LYS   4   8.774  -8.728  -2.384
   32   2HB   LYS   4          1HB       LYS   4   8.215  -8.623  -4.047
   33   1HG   LYS   4          2HG       LYS   4   7.716  -6.256  -3.742
   34   2HG   LYS   4          1HG       LYS   4   8.249  -6.357  -2.061
   35   1HD   LYS   4          2HD       LYS   4  10.491  -6.996  -2.815
   36   2HD   LYS   4          1HD       LYS   4   9.957  -6.891  -4.493
   37   1HE   LYS   4          2HE       LYS   4   9.476  -4.513  -4.188
   38   2HE   LYS   4          1HE       LYS   4  10.002  -4.619  -2.509
   39   1HZ   LYS   4          1HZ       LYS   4  12.204  -4.960  -3.146
   40   2HZ   LYS   4          2HZ       LYS   4  11.664  -3.759  -4.206
   41   3HZ   LYS   4          3HZ       LYS   4  11.796  -5.358  -4.740
   42    H    VAL   5           H        VAL   5   4.744  -7.034  -1.911
   43    HA   VAL   5           HA       VAL   5   3.614  -6.900  -4.604
   44    HB   VAL   5           HB       VAL   5   2.467  -5.882  -1.998
   45   1HG1  VAL   5          1HG1      VAL   5   1.449  -4.575  -3.621
   46   2HG1  VAL   5          2HG1      VAL   5   0.335  -5.931  -3.459
   47   3HG1  VAL   5          3HG1      VAL   5   1.461  -5.873  -4.815
   48   1HG2  VAL   5          1HG2      VAL   5   2.150  -8.082  -1.654
   49   2HG2  VAL   5          2HG2      VAL   5   2.390  -8.487  -3.354
   50   3HG2  VAL   5          3HG2      VAL   5   0.831  -7.877  -2.804
   51    H    ILE   6           H        ILE   6   3.610  -5.118  -5.813
   52    HA   ILE   6           HA       ILE   6   5.024  -2.763  -4.768
   53    HB   ILE   6           HB       ILE   6   4.668  -3.727  -7.608
   54   1HG1  ILE   6          2HG1      ILE   6   7.127  -3.454  -5.868
   55   2HG1  ILE   6          1HG1      ILE   6   6.329  -4.967  -6.283
   56   1HG2  ILE   6          1HG2      ILE   6   6.533  -1.743  -7.729
   57   2HG2  ILE   6          2HG2      ILE   6   5.395  -1.099  -6.546
   58   3HG2  ILE   6          3HG2      ILE   6   4.830  -1.562  -8.153
   59   1HD1  ILE   6          1HD1      ILE   6   7.590  -3.093  -8.269
   60   2HD1  ILE   6          2HD1      ILE   6   6.907  -4.685  -8.600
   61   3HD1  ILE   6          3HD1      ILE   6   8.357  -4.535  -7.608
   62    H    LEU   7           H        LEU   7   3.883  -0.990  -4.408
   63    HA   LEU   7           HA       LEU   7   1.215  -0.760  -5.601
   64   1HB   LEU   7          2HB       LEU   7   2.340   0.915  -3.363
   65   2HB   LEU   7          1HB       LEU   7   0.659   0.679  -3.800
   66    HG   LEU   7           HG       LEU   7   2.479  -1.363  -2.546
   67   1HD1  LEU   7          1HD1      LEU   7   1.457   0.550  -1.175
   68   2HD1  LEU   7          2HD1      LEU   7   1.242  -1.101  -0.596
   69   3HD1  LEU   7          3HD1      LEU   7  -0.079  -0.278  -1.428
   70   1HD2  LEU   7          1HD2      LEU   7   0.759  -2.942  -2.689
   71   2HD2  LEU   7          2HD2      LEU   7   0.802  -2.202  -4.287
   72   3HD2  LEU   7          3HD2      LEU   7  -0.441  -1.728  -3.130
   73    H    ASN   8           H        ASN   8   1.901  -0.066  -7.622
   74    HA   ASN   8           HA       ASN   8   3.449   2.388  -7.835
   75   1HB   ASN   8          2HB       ASN   8   3.905   0.429  -9.303
   76   2HB   ASN   8          1HB       ASN   8   2.313   0.639 -10.024
   77   1HD2  ASN   8          1HD2      ASN   8   5.400   1.085 -10.633
   78   2HD2  ASN   8          2HD2      ASN   8   5.352   2.511 -11.610
   79    H    GLY   9           H        GLY   9   2.244   4.141  -7.357
   80   1HA   GLY   9          2HA       GLY   9  -0.254   4.513  -8.893
   81   2HA   GLY   9          1HA       GLY   9  -0.011   5.155  -7.275
   82    H    LYS  10           H        LYS  10  -0.716   6.623  -9.662
   83    HA   LYS  10           HA       LYS  10   1.381   7.936 -10.882
   84   1HB   LYS  10          2HB       LYS  10  -1.393   8.879 -10.192
   85   2HB   LYS  10          1HB       LYS  10  -0.270   9.875 -11.101
   86   1HG   LYS  10          2HG       LYS  10  -1.779   8.748 -12.601
   87   2HG   LYS  10          1HG       LYS  10  -0.142   8.135 -12.827
   88   1HD   LYS  10          2HD       LYS  10  -0.661   6.154 -11.550
   89   2HD   LYS  10          1HD       LYS  10  -2.260   6.786 -11.157
   90   1HE   LYS  10          2HE       LYS  10  -2.381   5.136 -12.950
   91   2HE   LYS  10          1HE       LYS  10  -2.869   6.732 -13.519
   92   1HZ   LYS  10          1HZ       LYS  10  -0.259   5.396 -13.986
   93   2HZ   LYS  10          2HZ       LYS  10  -0.590   7.000 -14.408
   94   3HZ   LYS  10          3HZ       LYS  10  -1.449   5.740 -15.139
   95    H    THR  11           H        THR  11  -0.389   8.982  -7.979
   96    HA   THR  11           HA       THR  11   1.657  10.984  -7.436
   97    HB   THR  11           HB       THR  11  -0.015  11.575  -5.565
   98    HG1  THR  11           1HG      THR  11  -1.786  10.096  -7.189
   99   1HG2  THR  11          1HG2      THR  11  -0.320  12.023  -8.458
  100   2HG2  THR  11          2HG2      THR  11  -0.190  13.179  -7.134
  101   3HG2  THR  11          3HG2      THR  11  -1.728  12.377  -7.457
  102    H    LEU  12           H        LEU  12   0.964   7.812  -6.595
  103    HA   LEU  12           HA       LEU  12   2.705   8.033  -4.247
  104   1HB   LEU  12          2HB       LEU  12   0.431   7.832  -3.410
  105   2HB   LEU  12          1HB       LEU  12   0.155   6.426  -4.417
  106    HG   LEU  12           HG       LEU  12   1.572   5.074  -3.100
  107   1HD1  LEU  12          1HD1      LEU  12   2.604   6.426  -1.009
  108   2HD1  LEU  12          2HD1      LEU  12   2.696   7.657  -2.267
  109   3HD1  LEU  12          3HD1      LEU  12   3.480   6.101  -2.503
  110   1HD2  LEU  12          1HD2      LEU  12  -0.693   6.154  -2.106
  111   2HD2  LEU  12          2HD2      LEU  12   0.456   6.572  -0.837
  112   3HD2  LEU  12          3HD2      LEU  12   0.235   4.886  -1.307
  113    H    LYS  13           H        LYS  13   4.272   6.522  -4.140
  114    HA   LYS  13           HA       LYS  13   4.054   4.100  -5.755
  115   1HB   LYS  13          2HB       LYS  13   6.328   6.073  -6.023
  116   2HB   LYS  13          1HB       LYS  13   6.327   4.454  -6.705
  117   1HG   LYS  13          2HG       LYS  13   4.395   5.035  -8.086
  118   2HG   LYS  13          1HG       LYS  13   4.402   6.662  -7.403
  119   1HD   LYS  13          2HD       LYS  13   6.662   5.414  -8.965
  120   2HD   LYS  13          1HD       LYS  13   5.494   6.569  -9.607
  121   1HE   LYS  13          2HE       LYS  13   7.425   7.073  -7.345
  122   2HE   LYS  13          1HE       LYS  13   7.596   7.661  -8.998
  123   1HZ   LYS  13          1HZ       LYS  13   5.074   8.425  -8.088
  124   2HZ   LYS  13          2HZ       LYS  13   6.397   9.418  -8.435
  125   3HZ   LYS  13          3HZ       LYS  13   6.178   8.819  -6.868
  126    H    GLY  14           H        GLY  14   5.219   2.363  -4.952
  127   1HA   GLY  14          2HA       GLY  14   7.314   2.568  -3.082
  128   2HA   GLY  14          1HA       GLY  14   5.801   2.385  -2.212
  129    H    GLU  15           H        GLU  15   6.968   0.440  -1.452
  130    HA   GLU  15           HA       GLU  15   6.139  -1.847  -3.041
  131   1HB   GLU  15          2HB       GLU  15   8.982  -1.514  -2.067
  132   2HB   GLU  15          1HB       GLU  15   8.321  -2.970  -2.797
  133   1HG   GLU  15          2HG       GLU  15   7.969  -1.806  -4.886
  134   2HG   GLU  15          1HG       GLU  15   8.524  -0.297  -4.164
  135    H    THR  16           H        THR  16   5.660  -3.630  -1.896
  136    HA   THR  16           HA       THR  16   6.106  -3.562   0.984
  137    HB   THR  16           HB       THR  16   3.941  -2.596   0.747
  138    HG1  THR  16           1HG      THR  16   4.257  -4.300   2.277
  139   1HG2  THR  16          1HG2      THR  16   3.527  -4.676  -1.287
  140   2HG2  THR  16          2HG2      THR  16   2.952  -3.012  -1.233
  141   3HG2  THR  16          3HG2      THR  16   2.147  -4.257  -0.276
  142    H    THR  17           H        THR  17   5.378  -5.674   2.003
  143    HA   THR  17           HA       THR  17   5.646  -7.940   0.173
  144    HB   THR  17           HB       THR  17   7.398  -8.965   1.584
  145    HG1  THR  17           1HG      THR  17   8.433  -7.683   3.117
  146   1HG2  THR  17          1HG2      THR  17   9.254  -7.730   0.809
  147   2HG2  THR  17          2HG2      THR  17   8.304  -6.248   0.688
  148   3HG2  THR  17          3HG2      THR  17   7.996  -7.587  -0.419
  149    H    THR  18           H        THR  18   4.172  -9.389   0.596
  150    HA   THR  18           HA       THR  18   3.115  -9.662   3.348
  151    HB   THR  18           HB       THR  18   1.443  -8.966   1.647
  152    HG1  THR  18           1HG      THR  18   0.847 -10.336   3.411
  153   1HG2  THR  18          1HG2      THR  18   2.338 -10.022  -0.340
  154   2HG2  THR  18          2HG2      THR  18   0.681 -10.552  -0.041
  155   3HG2  THR  18          3HG2      THR  18   2.033 -11.615   0.352
  156    H    GLU  19           H        GLU  19   2.913 -11.765   4.206
  157    HA   GLU  19           HA       GLU  19   4.487 -13.808   2.779
  158   1HB   GLU  19          2HB       GLU  19   5.371 -13.077   4.982
  159   2HB   GLU  19          1HB       GLU  19   3.877 -13.613   5.738
  160   1HG   GLU  19          2HG       GLU  19   5.603 -15.487   4.160
  161   2HG   GLU  19          1HG       GLU  19   5.909 -15.150   5.861
  162    H    ALA  20           H        ALA  20   3.359 -15.443   1.905
  163    HA   ALA  20           HA       ALA  20   1.056 -16.505   3.324
  164   1HB   ALA  20          1HB       ALA  20  -0.545 -16.082   1.743
  165   2HB   ALA  20          2HB       ALA  20   0.631 -15.910   0.439
  166   3HB   ALA  20          3HB       ALA  20   0.430 -14.617   1.621
  167    H    VAL  21           H        VAL  21   0.426 -18.561   2.678
  168    HA   VAL  21           HA       VAL  21   2.398 -20.384   2.106
  169    HB   VAL  21           HB       VAL  21  -0.514 -20.764   1.408
  170   1HG1  VAL  21          1HG1      VAL  21   1.542 -22.802   2.242
  171   2HG1  VAL  21          2HG1      VAL  21   1.075 -22.485   0.571
  172   3HG1  VAL  21          3HG1      VAL  21  -0.113 -23.106   1.716
  173   1HG2  VAL  21          1HG2      VAL  21  -0.582 -20.059   3.622
  174   2HG2  VAL  21          2HG2      VAL  21   0.938 -20.857   4.025
  175   3HG2  VAL  21          3HG2      VAL  21  -0.517 -21.816   3.759
  176    H    ASP  22           H        ASP  22   0.568 -18.483  -0.150
  177    HA   ASP  22           HA       ASP  22   2.309 -19.295  -2.287
  178   1HB   ASP  22          2HB       ASP  22   0.598 -20.127  -3.818
  179   2HB   ASP  22          1HB       ASP  22   0.676 -21.125  -2.371
  180    H    ALA  23           H        ALA  23   1.484 -18.252  -4.445
  181    HA   ALA  23           HA       ALA  23   1.520 -15.496  -4.083
  182   1HB   ALA  23          1HB       ALA  23   2.108 -16.876  -6.165
  183   2HB   ALA  23          2HB       ALA  23   1.370 -15.291  -6.400
  184   3HB   ALA  23          3HB       ALA  23   0.393 -16.751  -6.559
  185    H    ALA  24           H        ALA  24  -1.232 -17.638  -4.673
  186    HA   ALA  24           HA       ALA  24  -3.158 -15.593  -4.959
  187   1HB   ALA  24          1HB       ALA  24  -4.006 -17.598  -5.676
  188   2HB   ALA  24          2HB       ALA  24  -4.699 -17.551  -4.054
  189   3HB   ALA  24          3HB       ALA  24  -3.253 -18.512  -4.368
  190    H    THR  25           H        THR  25  -2.338 -17.604  -2.110
  191    HA   THR  25           HA       THR  25  -3.977 -16.362  -0.265
  192    HB   THR  25           HB       THR  25  -2.259 -17.071   1.422
  193    HG1  THR  25           1HG      THR  25  -0.784 -17.451  -0.905
  194   1HG2  THR  25          1HG2      THR  25  -2.161 -19.542   0.171
  195   2HG2  THR  25          2HG2      THR  25  -3.655 -18.797  -0.395
  196   3HG2  THR  25          3HG2      THR  25  -3.361 -18.980   1.333
  197    H    ALA  26           H        ALA  26  -0.692 -15.524  -1.314
  198    HA   ALA  26           HA       ALA  26  -0.327 -13.287   0.346
  199   1HB   ALA  26          1HB       ALA  26   0.923 -14.351  -2.102
  200   2HB   ALA  26          2HB       ALA  26   1.664 -13.735  -0.624
  201   3HB   ALA  26          3HB       ALA  26   1.095 -12.613  -1.859
  202    H    GLU  27           H        GLU  27  -1.455 -13.508  -3.037
  203    HA   GLU  27           HA       GLU  27  -2.042 -10.854  -3.470
  204   1HB   GLU  27          2HB       GLU  27  -2.093 -12.584  -5.216
  205   2HB   GLU  27          1HB       GLU  27  -3.543 -13.267  -4.495
  206   1HG   GLU  27          2HG       GLU  27  -3.448 -10.428  -5.453
  207   2HG   GLU  27          1HG       GLU  27  -3.803 -11.767  -6.544
  208    H    LYS  28           H        LYS  28  -4.103 -13.379  -2.075
  209    HA   LYS  28           HA       LYS  28  -6.399 -11.797  -1.709
  210   1HB   LYS  28          2HB       LYS  28  -5.441 -14.243  -0.215
  211   2HB   LYS  28          1HB       LYS  28  -7.042 -13.538  -0.034
  212   1HG   LYS  28          2HG       LYS  28  -5.890 -14.679  -2.571
  213   2HG   LYS  28          1HG       LYS  28  -7.087 -15.450  -1.529
  214   1HD   LYS  28          2HD       LYS  28  -8.635 -13.599  -1.954
  215   2HD   LYS  28          1HD       LYS  28  -7.438 -12.845  -3.008
  216   1HE   LYS  28          2HE       LYS  28  -9.111 -14.051  -4.309
  217   2HE   LYS  28          1HE       LYS  28  -7.520 -14.786  -4.492
  218   1HZ   LYS  28          1HZ       LYS  28  -8.343 -16.698  -3.784
  219   2HZ   LYS  28          2HZ       LYS  28  -9.882 -16.007  -3.669
  220   3HZ   LYS  28          3HZ       LYS  28  -8.850 -15.996  -2.329
  221    H    VAL  29           H        VAL  29  -3.708 -12.561   0.474
  222    HA   VAL  29           HA       VAL  29  -4.663 -11.209   2.730
  223    HB   VAL  29           HB       VAL  29  -1.779 -11.546   1.876
  224   1HG1  VAL  29          1HG1      VAL  29  -2.565 -11.437   4.727
  225   2HG1  VAL  29          2HG1      VAL  29  -2.582  -9.919   3.831
  226   3HG1  VAL  29          3HG1      VAL  29  -1.099 -10.866   3.931
  227   1HG2  VAL  29          1HG2      VAL  29  -1.852 -13.686   2.513
  228   2HG2  VAL  29          2HG2      VAL  29  -3.605 -13.534   2.402
  229   3HG2  VAL  29          3HG2      VAL  29  -2.798 -13.315   3.955
  230    H    VAL  30           H        VAL  30  -2.875 -10.086  -0.077
  231    HA   VAL  30           HA       VAL  30  -2.376  -7.459   0.852
  232    HB   VAL  30           HB       VAL  30  -2.694  -8.451  -1.987
  233   1HG1  VAL  30          1HG1      VAL  30  -1.741  -6.473  -2.750
  234   2HG1  VAL  30          2HG1      VAL  30  -1.091  -6.061  -1.165
  235   3HG1  VAL  30          3HG1      VAL  30  -2.820  -5.914  -1.473
  236   1HG2  VAL  30          1HG2      VAL  30  -0.557  -9.170  -1.969
  237   2HG2  VAL  30          2HG2      VAL  30  -0.852  -9.321  -0.238
  238   3HG2  VAL  30          3HG2      VAL  30  -0.026  -7.896  -0.870
  239    H    LYS  31           H        LYS  31  -4.978  -8.876  -1.163
  240    HA   LYS  31           HA       LYS  31  -6.475  -6.625  -1.682
  241   1HB   LYS  31          2HB       LYS  31  -7.549  -9.353  -0.950
  242   2HB   LYS  31          1HB       LYS  31  -8.465  -8.084  -1.742
  243   1HG   LYS  31          2HG       LYS  31  -6.092  -9.543  -2.864
  244   2HG   LYS  31          1HG       LYS  31  -7.776  -9.743  -3.333
  245   1HD   LYS  31          2HD       LYS  31  -6.313  -7.141  -3.577
  246   2HD   LYS  31          1HD       LYS  31  -6.343  -8.337  -4.867
  247   1HE   LYS  31          2HE       LYS  31  -8.062  -6.829  -5.382
  248   2HE   LYS  31          1HE       LYS  31  -8.875  -8.225  -4.677
  249   1HZ   LYS  31          1HZ       LYS  31  -9.736  -6.923  -3.131
  250   2HZ   LYS  31          2HZ       LYS  31  -9.012  -5.577  -3.859
  251   3HZ   LYS  31          3HZ       LYS  31  -8.201  -6.409  -2.636
  252    H    GLN  32           H        GLN  32  -6.709  -8.754   1.144
  253    HA   GLN  32           HA       GLN  32  -8.692  -7.332   2.512
  254   1HB   GLN  32          2HB       GLN  32  -7.816  -9.639   3.070
  255   2HB   GLN  32          1HB       GLN  32  -6.424  -8.853   3.804
  256   1HG   GLN  32          2HG       GLN  32  -7.986  -9.423   5.516
  257   2HG   GLN  32          1HG       GLN  32  -7.940  -7.672   5.344
  258   1HE2  GLN  32          1HE2      GLN  32  -9.606  -9.024   2.751
  259   2HE2  GLN  32          2HE2      GLN  32 -11.209  -8.820   3.352
  260    H    PHE  33           H        PHE  33  -5.206  -6.963   2.422
  261    HA   PHE  33           HA       PHE  33  -4.758  -5.176   4.477
  262   1HB   PHE  33          2HB       PHE  33  -3.072  -6.266   2.905
  263   2HB   PHE  33          1HB       PHE  33  -3.459  -5.000   1.749
  264    HD1  PHE  33           1HD      PHE  33  -2.630  -5.215   5.377
  265    HD2  PHE  33           2HD      PHE  33  -1.935  -3.300   1.631
  266    HE1  PHE  33           1HE      PHE  33  -0.973  -3.735   6.437
  267    HE2  PHE  33           2HE      PHE  33  -0.273  -1.834   2.689
  268    HZ   PHE  33           HZ       PHE  33   0.211  -2.053   5.097
  269    H    PHE  34           H        PHE  34  -5.079  -4.227   1.097
  270    HA   PHE  34           HA       PHE  34  -5.636  -1.503   1.641
  271   1HB   PHE  34          2HB       PHE  34  -6.226  -3.073  -0.872
  272   2HB   PHE  34          1HB       PHE  34  -6.121  -1.313  -0.738
  273    HD1  PHE  34           1HD      PHE  34  -3.852  -0.708   0.742
  274    HD2  PHE  34           2HD      PHE  34  -4.402  -3.947  -1.943
  275    HE1  PHE  34           1HE      PHE  34  -1.421  -0.832   0.413
  276    HE2  PHE  34           2HE      PHE  34  -1.968  -4.077  -2.295
  277    HZ   PHE  34           HZ       PHE  34  -0.482  -2.518  -1.103
  278    H    ASN  35           H        ASN  35  -7.689  -4.290   1.068
  279    HA   ASN  35           HA       ASN  35 -10.169  -3.094   0.745
  280   1HB   ASN  35          2HB       ASN  35  -9.764  -5.523   0.598
  281   2HB   ASN  35          1HB       ASN  35  -9.479  -5.582   2.334
  282   1HD2  ASN  35          1HD2      ASN  35 -11.574  -6.487   0.197
  283   2HD2  ASN  35          2HD2      ASN  35 -13.068  -6.258   1.036
  284    H    ASP  36           H        ASP  36  -8.286  -3.714   3.618
  285    HA   ASP  36           HA       ASP  36 -10.302  -2.523   5.363
  286   1HB   ASP  36          2HB       ASP  36  -7.669  -3.852   6.033
  287   2HB   ASP  36          1HB       ASP  36  -8.845  -3.273   7.210
  288    H    ASN  37           H        ASN  37  -7.229  -1.692   3.924
  289    HA   ASN  37           HA       ASN  37  -6.699   0.471   5.769
  290   1HB   ASN  37          2HB       ASN  37  -5.474  -0.144   3.068
  291   2HB   ASN  37          1HB       ASN  37  -4.905   1.098   4.175
  292   1HD2  ASN  37          1HD2      ASN  37  -3.847  -1.539   3.026
  293   2HD2  ASN  37          2HD2      ASN  37  -3.188  -2.327   4.413
  294    H    GLY  38           H        GLY  38  -7.921   0.070   2.524
  295   1HA   GLY  38          2HA       GLY  38  -8.272   2.087   1.107
  296   2HA   GLY  38          1HA       GLY  38  -9.756   1.383   1.710
  297    H    VAL  39           H        VAL  39 -11.145   2.735   2.522
  298    HA   VAL  39           HA       VAL  39 -10.455   5.478   2.859
  299    HB   VAL  39           HB       VAL  39 -13.076   4.061   3.206
  300   1HG1  VAL  39          1HG1      VAL  39 -12.308   6.932   3.495
  301   2HG1  VAL  39          2HG1      VAL  39 -13.453   5.975   4.436
  302   3HG1  VAL  39          3HG1      VAL  39 -13.886   6.523   2.817
  303   1HG2  VAL  39          1HG2      VAL  39 -11.582   4.748   0.923
  304   2HG2  VAL  39          2HG2      VAL  39 -12.928   5.884   1.009
  305   3HG2  VAL  39          3HG2      VAL  39 -13.241   4.151   0.996
  306    H    ASP  40           H        ASP  40 -11.961   3.179   5.198
  307    HA   ASP  40           HA       ASP  40 -11.476   5.140   7.280
  308   1HB   ASP  40          2HB       ASP  40 -12.906   2.483   7.362
  309   2HB   ASP  40          1HB       ASP  40 -12.813   3.624   8.699
  310    H    GLY  41           H        GLY  41  -9.192   3.576   6.103
  311   1HA   GLY  41          2HA       GLY  41  -8.344   1.644   7.984
  312   2HA   GLY  41          1HA       GLY  41  -7.301   2.508   6.866
  313    H    GLU  42           H        GLU  42  -7.038   1.749   9.771
  314    HA   GLU  42           HA       GLU  42  -7.018   4.257  11.201
  315   1HB   GLU  42          2HB       GLU  42  -5.860   1.560  11.939
  316   2HB   GLU  42          1HB       GLU  42  -5.982   2.942  13.021
  317   1HG   GLU  42          2HG       GLU  42  -8.292   1.485  11.756
  318   2HG   GLU  42          1HG       GLU  42  -7.751   1.320  13.424
  319    H    TRP  43           H        TRP  43  -5.611   5.676  10.236
  320    HA   TRP  43           HA       TRP  43  -2.824   4.787   9.896
  321   1HB   TRP  43          2HB       TRP  43  -4.112   7.254   8.735
  322   2HB   TRP  43          1HB       TRP  43  -2.534   6.598   8.339
  323    HD1  TRP  43           HD       TRP  43  -5.073   3.855   8.416
  324    HE1  TRP  43           1HE      TRP  43  -5.784   3.263   6.016
  325    HE3  TRP  43           3HE      TRP  43  -2.997   7.819   5.975
  326    HZ2  TRP  43           2HZ      TRP  43  -5.495   4.350   3.426
  327    HZ3  TRP  43           3HZ      TRP  43  -3.252   7.970   3.543
  328    HH2  TRP  43           HH       TRP  43  -4.472   6.268   2.288
  329    H    THR  44           H        THR  44  -1.200   5.729  10.995
  330    HA   THR  44           HA       THR  44  -1.844   8.053  12.689
  331    HB   THR  44           HB       THR  44   0.047   7.312  14.128
  332    HG1  THR  44           1HG      THR  44   0.018   4.993  12.499
  333   1HG2  THR  44          1HG2      THR  44  -2.474   6.266  14.127
  334   2HG2  THR  44          2HG2      THR  44  -1.259   6.024  15.381
  335   3HG2  THR  44          3HG2      THR  44  -1.459   4.824  14.104
  336    H    TYR  45           H        TYR  45  -0.456   9.845  12.583
  337    HA   TYR  45           HA       TYR  45   1.480   9.729  10.366
  338   1HB   TYR  45          2HB       TYR  45  -0.400  11.235   9.961
  339   2HB   TYR  45          1HB       TYR  45  -0.048  12.100  11.453
  340    HD1  TYR  45           1HD      TYR  45   2.239  10.919   8.751
  341    HD2  TYR  45           2HD      TYR  45   0.582  14.243  10.826
  342    HE1  TYR  45           1HE      TYR  45   3.733  12.430   7.512
  343    HE2  TYR  45           2HE      TYR  45   2.072  15.762   9.594
  344    HH   TYR  45           HH       TYR  45   4.297  15.599   8.408
  345    H    ASP  46           H        ASP  46   3.492  10.608  10.535
  346    HA   ASP  46           HA       ASP  46   4.350  11.499  13.209
  347   1HB   ASP  46          2HB       ASP  46   5.179   9.226  12.767
  348   2HB   ASP  46          1HB       ASP  46   5.908   9.778  11.261
  349    H    ASP  47           H        ASP  47   3.987  13.656  12.435
  350    HA   ASP  47           HA       ASP  47   4.896  14.872  10.176
  351   1HB   ASP  47          2HB       ASP  47   4.931  16.028  12.970
  352   2HB   ASP  47          1HB       ASP  47   5.016  16.967  11.483
  353    H    ALA  48           H        ALA  48   6.821  14.064  13.017
  354    HA   ALA  48           HA       ALA  48   9.101  15.519  12.594
  355   1HB   ALA  48          1HB       ALA  48   9.264  12.650  13.440
  356   2HB   ALA  48          2HB       ALA  48   8.527  13.876  14.472
  357   3HB   ALA  48          3HB       ALA  48  10.217  14.027  13.992
  358    H    THR  49           H        THR  49   8.054  12.673  10.833
  359    HA   THR  49           HA       THR  49  10.389  13.012   9.068
  360    HB   THR  49           HB       THR  49  10.418  10.567   8.711
  361    HG1  THR  49           1HG      THR  49   8.448  10.587  10.745
  362   1HG2  THR  49          1HG2      THR  49  10.574  10.755  11.654
  363   2HG2  THR  49          2HG2      THR  49  11.619  11.823  10.716
  364   3HG2  THR  49          3HG2      THR  49  11.715  10.075  10.494
  365    H    LYS  50           H        LYS  50   7.310  13.647   9.105
  366    HA   LYS  50           HA       LYS  50   5.570  13.668   7.621
  367   1HB   LYS  50          2HB       LYS  50   7.991  13.788   5.851
  368   2HB   LYS  50          1HB       LYS  50   6.383  13.741   5.147
  369   1HG   LYS  50          2HG       LYS  50   6.944  16.007   5.256
  370   2HG   LYS  50          1HG       LYS  50   5.841  15.742   6.605
  371   1HD   LYS  50          2HD       LYS  50   7.639  17.093   7.391
  372   2HD   LYS  50          1HD       LYS  50   7.843  15.482   8.081
  373   1HE   LYS  50          2HE       LYS  50   9.493  14.949   6.364
  374   2HE   LYS  50          1HE       LYS  50   9.274  16.545   5.646
  375   1HZ   LYS  50          1HZ       LYS  50  10.281  17.575   7.457
  376   2HZ   LYS  50          2HZ       LYS  50  11.241  16.206   7.202
  377   3HZ   LYS  50          3HZ       LYS  50  10.113  16.225   8.462
  378    H    THR  51           H        THR  51   6.340  11.084   8.604
  379    HA   THR  51           HA       THR  51   5.599   9.404   6.309
  380    HB   THR  51           HB       THR  51   7.181   8.654   8.772
  381    HG1  THR  51           1HG      THR  51   7.894   9.124   6.081
  382   1HG2  THR  51          1HG2      THR  51   7.320   6.800   6.571
  383   2HG2  THR  51          2HG2      THR  51   5.677   6.952   7.192
  384   3HG2  THR  51          3HG2      THR  51   6.993   6.507   8.279
  385    H    PHE  52           H        PHE  52   3.847   8.141   6.446
  386    HA   PHE  52           HA       PHE  52   2.303   8.226   8.956
  387   1HB   PHE  52          2HB       PHE  52   1.293   7.628   6.164
  388   2HB   PHE  52          1HB       PHE  52   0.316   7.869   7.606
  389    HD1  PHE  52           1HD      PHE  52  -0.702   9.907   7.856
  390    HD2  PHE  52           2HD      PHE  52   2.924   9.678   5.638
  391    HE1  PHE  52           1HE      PHE  52  -0.878  12.304   7.322
  392    HE2  PHE  52           2HE      PHE  52   2.755  12.074   5.107
  393    HZ   PHE  52           HZ       PHE  52   0.853  13.390   5.950
  394    H    THR  53           H        THR  53   1.349   6.270   9.738
  395    HA   THR  53           HA       THR  53   2.451   3.840   8.495
  396    HB   THR  53           HB       THR  53   2.265   2.909  10.921
  397    HG1  THR  53           1HG      THR  53   2.445   5.697  11.382
  398   1HG2  THR  53          1HG2      THR  53   4.524   4.365  11.374
  399   2HG2  THR  53          2HG2      THR  53   4.396   4.398   9.615
  400   3HG2  THR  53          3HG2      THR  53   4.437   2.853  10.469
  401    H    VAL  54           H        VAL  54   0.936   2.717   7.581
  402    HA   VAL  54           HA       VAL  54  -1.808   2.786   8.570
  403    HB   VAL  54           HB       VAL  54  -0.678   1.444   6.098
  404   1HG1  VAL  54          1HG1      VAL  54  -3.086   0.947   7.392
  405   2HG1  VAL  54          2HG1      VAL  54  -2.675   0.531   5.729
  406   3HG1  VAL  54          3HG1      VAL  54  -3.511   2.043   6.077
  407   1HG2  VAL  54          1HG2      VAL  54  -0.508   3.594   5.439
  408   2HG2  VAL  54          2HG2      VAL  54  -1.642   4.172   6.660
  409   3HG2  VAL  54          3HG2      VAL  54  -2.245   3.430   5.178
  410    H    THR  55           H        THR  55  -2.195   1.441  10.220
  411    HA   THR  55           HA       THR  55  -0.910  -1.195  10.220
  412    HB   THR  55           HB       THR  55  -2.309   0.219  12.490
  413    HG1  THR  55           1HG      THR  55  -0.523   1.316  12.519
  414   1HG2  THR  55          1HG2      THR  55  -1.142  -1.374  13.924
  415   2HG2  THR  55          2HG2      THR  55  -0.529  -2.206  12.494
  416   3HG2  THR  55          3HG2      THR  55  -2.262  -2.180  12.824
  417    H    GLU  56           H        GLU  56  -2.050  -2.899   9.592
  418    HA   GLU  56           HA       GLU  56  -4.777  -2.809   8.960
  419   1HB   GLU  56          2HB       GLU  56  -3.236  -4.442   7.984
  420   2HB   GLU  56          1HB       GLU  56  -3.040  -5.212   9.553
  421   1HG   GLU  56          2HG       GLU  56  -4.547  -6.478   8.138
  422   2HG   GLU  56          1HG       GLU  56  -5.390  -5.844   9.550
  423   1H    MET   1          1HT       MET   1   6.860  19.890  -1.547
  424   2H    MET   1          2HT       MET   1   5.594  18.780  -1.389
  425   3H    MET   1          3HT       MET   1   6.641  18.686  -2.714
  426    HA   MET   1           HA       MET   1   8.483  18.120  -1.286
  427   1HB   MET   1          2HB       MET   1   7.674  19.422   0.653
  428   2HB   MET   1          1HB       MET   1   6.393  18.246   0.902
  429   1HG   MET   1          2HG       MET   1   8.190  17.876   2.464
  430   2HG   MET   1          1HG       MET   1   8.064  16.519   1.346
  431   1HE   MET   1          1HE       MET   1  10.183  16.566   3.062
  432   2HE   MET   1          2HE       MET   1  11.775  17.113   2.533
  433   3HE   MET   1          3HE       MET   1  11.022  15.716   1.764
  434    H    GLN   2           H        GLN   2   8.853  15.927  -0.482
  435    HA   GLN   2           HA       GLN   2   6.836  14.072  -1.525
  436   1HB   GLN   2          2HB       GLN   2   9.063  13.904  -2.538
  437   2HB   GLN   2          1HB       GLN   2   9.777  13.646  -0.952
  438   1HG   GLN   2          2HG       GLN   2   8.537  11.555  -0.730
  439   2HG   GLN   2          1HG       GLN   2   7.816  11.814  -2.317
  440   1HE2  GLN   2          1HE2      GLN   2  10.125  10.155  -0.748
  441   2HE2  GLN   2          2HE2      GLN   2  11.245   9.891  -2.036
  442    H    TYR   3           H        TYR   3   6.007  12.441  -0.273
  443    HA   TYR   3           HA       TYR   3   6.843  12.396   2.548
  444   1HB   TYR   3          2HB       TYR   3   4.025  12.275   1.455
  445   2HB   TYR   3          1HB       TYR   3   4.453  11.967   3.138
  446    HD1  TYR   3           1HD      TYR   3   4.431  13.730   4.644
  447    HD2  TYR   3           2HD      TYR   3   4.833  14.580   0.496
  448    HE1  TYR   3           1HE      TYR   3   4.317  16.137   5.135
  449    HE2  TYR   3           2HE      TYR   3   4.716  16.991   0.972
  450    HH   TYR   3           HH       TYR   3   3.783  18.217   4.032
  451    H    LYS   4           H        LYS   4   6.903  10.423   3.567
  452    HA   LYS   4           HA       LYS   4   6.693   8.105   1.763
  453   1HB   LYS   4          2HB       LYS   4   8.949   8.565   2.598
  454   2HB   LYS   4          1HB       LYS   4   8.364   8.473   4.252
  455   1HG   LYS   4          2HG       LYS   4   7.814   6.120   3.940
  456   2HG   LYS   4          1HG       LYS   4   8.373   6.208   2.268
  457   1HD   LYS   4          2HD       LYS   4  10.617   6.792   3.053
  458   2HD   LYS   4          1HD       LYS   4  10.057   6.700   4.723
  459   1HE   LYS   4          2HE       LYS   4   9.523   4.334   4.413
  460   2HE   LYS   4          1HE       LYS   4  10.074   4.428   2.741
  461   1HZ   LYS   4          1HZ       LYS   4  12.275   4.714   3.408
  462   2HZ   LYS   4          2HZ       LYS   4  11.691   3.527   4.461
  463   3HZ   LYS   4          3HZ       LYS   4  11.854   5.123   4.996
  464    H    VAL   5           H        VAL   5   4.886   6.970   2.068
  465    HA   VAL   5           HA       VAL   5   3.716   6.863   4.744
  466    HB   VAL   5           HB       VAL   5   2.581   5.872   2.122
  467   1HG1  VAL   5          1HG1      VAL   5   1.509   4.591   3.732
  468   2HG1  VAL   5          2HG1      VAL   5   0.431   5.974   3.553
  469   3HG1  VAL   5          3HG1      VAL   5   1.535   5.889   4.925
  470   1HG2  VAL   5          1HG2      VAL   5   2.323   8.081   1.776
  471   2HG2  VAL   5          2HG2      VAL   5   2.549   8.480   3.478
  472   3HG2  VAL   5          3HG2      VAL   5   0.982   7.907   2.906
  473    H    ILE   6           H        ILE   6   3.650   5.083   5.955
  474    HA   ILE   6           HA       ILE   6   5.021   2.693   4.930
  475    HB   ILE   6           HB       ILE   6   4.651   3.667   7.765
  476   1HG1  ILE   6          2HG1      ILE   6   7.126   3.333   6.058
  477   2HG1  ILE   6          1HG1      ILE   6   6.357   4.865   6.463
  478   1HG2  ILE   6          1HG2      ILE   6   6.464   1.638   7.910
  479   2HG2  ILE   6          2HG2      ILE   6   5.325   1.021   6.712
  480   3HG2  ILE   6          3HG2      ILE   6   4.751   1.497   8.310
  481   1HD1  ILE   6          1HD1      ILE   6   7.545   2.961   8.465
  482   2HD1  ILE   6          2HD1      ILE   6   6.897   4.569   8.787
  483   3HD1  ILE   6          3HD1      ILE   6   8.357   4.384   7.815
  484    H    LEU   7           H        LEU   7   3.844   0.950   4.552
  485    HA   LEU   7           HA       LEU   7   1.153   0.783   5.707
  486   1HB   LEU   7          2HB       LEU   7   2.267  -0.919   3.486
  487   2HB   LEU   7          1HB       LEU   7   0.587  -0.641   3.900
  488    HG   LEU   7           HG       LEU   7   2.475   1.356   2.672
  489   1HD1  LEU   7          1HD1      LEU   7   1.426  -0.533   1.286
  490   2HD1  LEU   7          2HD1      LEU   7   1.259   1.123   0.703
  491   3HD1  LEU   7          3HD1      LEU   7  -0.092   0.332   1.517
  492   1HD2  LEU   7          1HD2      LEU   7   0.792   2.976   2.788
  493   2HD2  LEU   7          2HD2      LEU   7   0.794   2.236   4.387
  494   3HD2  LEU   7          3HD2      LEU   7  -0.445   1.792   3.214
  495    H    ASN   8           H        ASN   8   1.795   0.073   7.736
  496    HA   ASN   8           HA       ASN   8   3.280  -2.418   7.972
  497   1HB   ASN   8          2HB       ASN   8   3.761  -0.470   9.447
  498   2HB   ASN   8          1HB       ASN   8   2.154  -0.641  10.144
  499   1HD2  ASN   8          1HD2      ASN   8   5.221  -1.161  10.797
  500   2HD2  ASN   8          2HD2      ASN   8   5.124  -2.585  11.774
  501    H    GLY   9           H        GLY   9   2.041  -4.142   7.478
  502   1HA   GLY   9          2HA       GLY   9  -0.489  -4.452   8.978
  503   2HA   GLY   9          1HA       GLY   9  -0.240  -5.099   7.365
  504    H    LYS  10           H        LYS  10  -1.012  -6.549   9.741
  505    HA   LYS  10           HA       LYS  10   1.034  -7.913  10.989
  506   1HB   LYS  10          2HB       LYS  10  -1.752  -8.788  10.256
  507   2HB   LYS  10          1HB       LYS  10  -0.666  -9.812  11.182
  508   1HG   LYS  10          2HG       LYS  10  -2.168  -8.649  12.661
  509   2HG   LYS  10          1HG       LYS  10  -0.519  -8.075  12.911
  510   1HD   LYS  10          2HD       LYS  10  -0.973  -6.082  11.628
  511   2HD   LYS  10          1HD       LYS  10  -2.583  -6.675  11.211
  512   1HE   LYS  10          2HE       LYS  10  -2.688  -5.023  13.002
  513   2HE   LYS  10          1HE       LYS  10  -3.223  -6.606  13.565
  514   1HZ   LYS  10          1HZ       LYS  10  -0.588  -5.334  14.069
  515   2HZ   LYS  10          2HZ       LYS  10  -0.964  -6.930  14.485
  516   3HZ   LYS  10          3HZ       LYS  10  -1.802  -5.649  15.204
  517    H    THR  11           H        THR  11  -0.720  -8.918   8.060
  518    HA   THR  11           HA       THR  11   1.284 -10.967   7.545
  519    HB   THR  11           HB       THR  11  -0.374 -11.519   5.651
  520    HG1  THR  11           1HG      THR  11  -2.132  -9.997   7.249
  521   1HG2  THR  11          1HG2      THR  11  -0.731 -11.957   8.540
  522   2HG2  THR  11          2HG2      THR  11  -0.611 -13.117   7.217
  523   3HG2  THR  11          3HG2      THR  11  -2.132 -12.278   7.519
  524    H    LEU  12           H        LEU  12   0.681  -7.780   6.695
  525    HA   LEU  12           HA       LEU  12   2.449  -8.042   4.373
  526   1HB   LEU  12          2HB       LEU  12   0.193  -7.788   3.502
  527   2HB   LEU  12          1HB       LEU  12  -0.063  -6.375   4.507
  528    HG   LEU  12           HG       LEU  12   1.406  -5.057   3.211
  529   1HD1  LEU  12          1HD1      LEU  12   2.432  -6.434   1.133
  530   2HD1  LEU  12          2HD1      LEU  12   2.477  -7.666   2.393
  531   3HD1  LEU  12          3HD1      LEU  12   3.296  -6.128   2.640
  532   1HD2  LEU  12          1HD2      LEU  12  -0.872  -6.083   2.185
  533   2HD2  LEU  12          2HD2      LEU  12   0.285  -6.528   0.931
  534   3HD2  LEU  12          3HD2      LEU  12   0.098  -4.839   1.398
  535    H    LYS  13           H        LYS  13   4.052  -6.570   4.288
  536    HA   LYS  13           HA       LYS  13   3.871  -4.143   5.901
  537   1HB   LYS  13          2HB       LYS  13   6.094  -6.173   6.199
  538   2HB   LYS  13          1HB       LYS  13   6.121  -4.553   6.883
  539   1HG   LYS  13          2HG       LYS  13   4.157  -5.087   8.234
  540   2HG   LYS  13          1HG       LYS  13   4.134  -6.714   7.552
  541   1HD   LYS  13          2HD       LYS  13   6.401  -5.520   9.147
  542   2HD   LYS  13          1HD       LYS  13   5.196  -6.647   9.772
  543   1HE   LYS  13          2HE       LYS  13   7.146  -7.198   7.538
  544   2HE   LYS  13          1HE       LYS  13   7.279  -7.790   9.192
  545   1HZ   LYS  13          1HZ       LYS  13   4.751  -8.493   8.246
  546   2HZ   LYS  13          2HZ       LYS  13   6.046  -9.516   8.611
  547   3HZ   LYS  13          3HZ       LYS  13   5.865  -8.914   7.041
  548    H    GLY  14           H        GLY  14   5.090  -2.437   5.114
  549   1HA   GLY  14          2HA       GLY  14   7.206  -2.692   3.274
  550   2HA   GLY  14          1HA       GLY  14   5.710  -2.472   2.382
  551    H    GLU  15           H        GLU  15   6.935  -0.557   1.640
  552    HA   GLU  15           HA       GLU  15   6.138   1.749   3.218
  553   1HB   GLU  15          2HB       GLU  15   8.985   1.349   2.284
  554   2HB   GLU  15          1HB       GLU  15   8.349   2.821   3.006
  555   1HG   GLU  15          2HG       GLU  15   7.941   1.665   5.088
  556   2HG   GLU  15          1HG       GLU  15   8.469   0.142   4.374
  557    H    THR  16           H        THR  16   5.719   3.546   2.065
  558    HA   THR  16           HA       THR  16   6.204   3.464  -0.809
  559    HB   THR  16           HB       THR  16   4.013   2.552  -0.602
  560    HG1  THR  16           1HG      THR  16   4.392   4.247  -2.127
  561   1HG2  THR  16          1HG2      THR  16   3.621   4.642   1.426
  562   2HG2  THR  16          2HG2      THR  16   3.007   2.992   1.365
  563   3HG2  THR  16          3HG2      THR  16   2.246   4.255   0.396
  564    H    THR  17           H        THR  17   5.542   5.594  -1.836
  565    HA   THR  17           HA       THR  17   5.838   7.853  -0.003
  566    HB   THR  17           HB       THR  17   7.634   8.835  -1.389
  567    HG1  THR  17           1HG      THR  17   8.660   7.528  -2.907
  568   1HG2  THR  17          1HG2      THR  17   9.450   7.555  -0.586
  569   2HG2  THR  17          2HG2      THR  17   8.463   6.097  -0.479
  570   3HG2  THR  17          3HG2      THR  17   8.172   7.442   0.623
  571    H    THR  18           H        THR  18   4.409   9.337  -0.445
  572    HA   THR  18           HA       THR  18   3.395   9.635  -3.213
  573    HB   THR  18           HB       THR  18   1.682   8.981  -1.536
  574    HG1  THR  18           1HG      THR  18   1.146  10.364  -3.306
  575   1HG2  THR  18          1HG2      THR  18   2.575  10.015   0.464
  576   2HG2  THR  18          2HG2      THR  18   0.937  10.586   0.142
  577   3HG2  THR  18          3HG2      THR  18   2.320  11.615  -0.232
  578    H    GLU  19           H        GLU  19   3.258  11.742  -4.073
  579    HA   GLU  19           HA       GLU  19   4.861  13.748  -2.624
  580   1HB   GLU  19          2HB       GLU  19   5.757  12.995  -4.815
  581   2HB   GLU  19          1HB       GLU  19   4.288  13.567  -5.592
  582   1HG   GLU  19          2HG       GLU  19   6.035  15.399  -3.987
  583   2HG   GLU  19          1HG       GLU  19   6.358  15.055  -5.685
  584    H    ALA  20           H        ALA  20   3.760  15.410  -1.764
  585    HA   ALA  20           HA       ALA  20   1.502  16.527  -3.217
  586   1HB   ALA  20          1HB       ALA  20  -0.130  16.142  -1.657
  587   2HB   ALA  20          2HB       ALA  20   1.023  15.941  -0.338
  588   3HB   ALA  20          3HB       ALA  20   0.807  14.654  -1.522
  589    H    VAL  21           H        VAL  21   0.915  18.598  -2.579
  590    HA   VAL  21           HA       VAL  21   2.922  20.373  -1.979
  591    HB   VAL  21           HB       VAL  21   0.010  20.823  -1.322
  592   1HG1  VAL  21          1HG1      VAL  21   2.127  22.811  -2.125
  593   2HG1  VAL  21          2HG1      VAL  21   1.628  22.505  -0.461
  594   3HG1  VAL  21          3HG1      VAL  21   0.472  23.154  -1.624
  595   1HG2  VAL  21          1HG2      VAL  21  -0.044  20.119  -3.537
  596   2HG2  VAL  21          2HG2      VAL  21   1.502  20.880  -3.918
  597   3HG2  VAL  21          3HG2      VAL  21   0.067  21.876  -3.673
  598    H    ASP  22           H        ASP  22   1.014  18.516   0.250
  599    HA   ASP  22           HA       ASP  22   2.744  19.286   2.413
  600   1HB   ASP  22          2HB       ASP  22   1.034  20.159   3.920
  601   2HB   ASP  22          1HB       ASP  22   1.155  21.154   2.473
  602    H    ALA  23           H        ALA  23   1.865  18.263   4.558
  603    HA   ALA  23           HA       ALA  23   1.838  15.508   4.196
  604   1HB   ALA  23          1HB       ALA  23   2.429  16.874   6.286
  605   2HB   ALA  23          2HB       ALA  23   1.650  15.308   6.511
  606   3HB   ALA  23          3HB       ALA  23   0.706  16.790   6.656
  607    H    ALA  24           H        ALA  24  -0.869  17.716   4.747
  608    HA   ALA  24           HA       ALA  24  -2.848  15.718   5.005
  609   1HB   ALA  24          1HB       ALA  24  -3.657  17.744   5.711
  610   2HB   ALA  24          2HB       ALA  24  -4.327  17.713   4.079
  611   3HB   ALA  24          3HB       ALA  24  -2.864  18.638   4.414
  612    H    THR  25           H        THR  25  -1.940  17.709   2.169
  613    HA   THR  25           HA       THR  25  -3.581  16.506   0.300
  614    HB   THR  25           HB       THR  25  -1.824  17.173  -1.362
  615    HG1  THR  25           1HG      THR  25  -0.373  17.516   0.987
  616   1HG2  THR  25          1HG2      THR  25  -1.683  19.642  -0.107
  617   2HG2  THR  25          2HG2      THR  25  -3.203  18.934   0.437
  618   3HG2  THR  25          3HG2      THR  25  -2.881  19.110  -1.288
  619    H    ALA  26           H        ALA  26  -0.333  15.589   1.396
  620    HA   ALA  26           HA       ALA  26   0.000  13.344  -0.260
  621   1HB   ALA  26          1HB       ALA  26   1.241  14.377   2.206
  622   2HB   ALA  26          2HB       ALA  26   1.987  13.743   0.740
  623   3HB   ALA  26          3HB       ALA  26   1.374  12.635   1.966
  624    H    GLU  27           H        GLU  27  -1.170  13.593   3.108
  625    HA   GLU  27           HA       GLU  27  -1.826  10.953   3.532
  626   1HB   GLU  27          2HB       GLU  27  -1.860  12.685   5.278
  627   2HB   GLU  27          1HB       GLU  27  -3.283  13.401   4.538
  628   1HG   GLU  27          2HG       GLU  27  -3.271  10.562   5.494
  629   2HG   GLU  27          1HG       GLU  27  -3.607  11.908   6.581
  630    H    LYS  28           H        LYS  28  -3.806  13.528   2.109
  631    HA   LYS  28           HA       LYS  28  -6.133  12.002   1.710
  632   1HB   LYS  28          2HB       LYS  28  -5.096  14.424   0.230
  633   2HB   LYS  28          1HB       LYS  28  -6.711  13.759   0.027
  634   1HG   LYS  28          2HG       LYS  28  -5.566  14.871   2.580
  635   2HG   LYS  28          1HG       LYS  28  -6.731  15.671   1.521
  636   1HD   LYS  28          2HD       LYS  28  -8.329  13.859   1.924
  637   2HD   LYS  28          1HD       LYS  28  -7.166  13.075   2.995
  638   1HE   LYS  28          2HE       LYS  28  -8.827  14.321   4.273
  639   2HE   LYS  28          1HE       LYS  28  -7.221  15.016   4.478
  640   1HZ   LYS  28          1HZ       LYS  28  -7.987  16.949   3.759
  641   2HZ   LYS  28          2HZ       LYS  28  -9.541  16.296   3.622
  642   3HZ   LYS  28          3HZ       LYS  28  -8.490  16.260   2.297
  643    H    VAL  29           H        VAL  29  -3.395  12.701  -0.434
  644    HA   VAL  29           HA       VAL  29  -4.349  11.371  -2.704
  645    HB   VAL  29           HB       VAL  29  -1.469  11.639  -1.809
  646   1HG1  VAL  29          1HG1      VAL  29  -2.220  11.548  -4.671
  647   2HG1  VAL  29          2HG1      VAL  29  -2.286  10.033  -3.775
  648   3HG1  VAL  29          3HG1      VAL  29  -0.779  10.943  -3.854
  649   1HG2  VAL  29          1HG2      VAL  29  -1.482  13.780  -2.447
  650   2HG2  VAL  29          2HG2      VAL  29  -3.241  13.670  -2.360
  651   3HG2  VAL  29          3HG2      VAL  29  -2.418  13.431  -3.901
  652    H    VAL  30           H        VAL  30  -2.630  10.207   0.128
  653    HA   VAL  30           HA       VAL  30  -2.181   7.568  -0.795
  654    HB   VAL  30           HB       VAL  30  -2.516   8.567   2.040
  655   1HG1  VAL  30          1HG1      VAL  30  -1.622   6.566   2.815
  656   2HG1  VAL  30          2HG1      VAL  30  -0.960   6.139   1.238
  657   3HG1  VAL  30          3HG1      VAL  30  -2.696   6.033   1.523
  658   1HG2  VAL  30          1HG2      VAL  30  -0.361   9.233   2.053
  659   2HG2  VAL  30          2HG2      VAL  30  -0.628   9.391   0.316
  660   3HG2  VAL  30          3HG2      VAL  30   0.154   7.947   0.961
  661    H    LYS  31           H        LYS  31  -4.777   9.048   1.183
  662    HA   LYS  31           HA       LYS  31  -6.334   6.834   1.681
  663   1HB   LYS  31          2HB       LYS  31  -7.332   9.587   0.934
  664   2HB   LYS  31          1HB       LYS  31  -8.291   8.340   1.714
  665   1HG   LYS  31          2HG       LYS  31  -5.897   9.741   2.868
  666   2HG   LYS  31          1HG       LYS  31  -7.582   9.982   3.314
  667   1HD   LYS  31          2HD       LYS  31  -6.187   7.345   3.577
  668   2HD   LYS  31          1HD       LYS  31  -6.206   8.542   4.867
  669   1HE   LYS  31          2HE       LYS  31  -7.968   7.077   5.358
  670   2HE   LYS  31          1HE       LYS  31  -8.737   8.492   4.642
  671   1HZ   LYS  31          1HZ       LYS  31  -9.608   7.211   3.084
  672   2HZ   LYS  31          2HZ       LYS  31  -8.930   5.848   3.823
  673   3HZ   LYS  31          3HZ       LYS  31  -8.080   6.658   2.611
  674    H    GLN  32           H        GLN  32  -6.477   8.967  -1.148
  675    HA   GLN  32           HA       GLN  32  -8.474   7.594  -2.543
  676   1HB   GLN  32          2HB       GLN  32  -7.535   9.878  -3.089
  677   2HB   GLN  32          1HB       GLN  32  -6.152   9.058  -3.803
  678   1HG   GLN  32          2HG       GLN  32  -7.676   9.666  -5.538
  679   2HG   GLN  32          1HG       GLN  32  -7.675   7.914  -5.365
  680   1HE2  GLN  32          1HE2      GLN  32  -9.343   9.306  -2.795
  681   2HE2  GLN  32          2HE2      GLN  32 -10.942   9.141  -3.418
  682    H    PHE  33           H        PHE  33  -5.001   7.140  -2.406
  683    HA   PHE  33           HA       PHE  33  -4.568   5.342  -4.453
  684   1HB   PHE  33          2HB       PHE  33  -2.878   6.390  -2.857
  685   2HB   PHE  33          1HB       PHE  33  -3.312   5.135  -1.708
  686    HD1  PHE  33           1HD      PHE  33  -2.427   5.329  -5.324
  687    HD2  PHE  33           2HD      PHE  33  -1.832   3.398  -1.569
  688    HE1  PHE  33           1HE      PHE  33  -0.791   3.810  -6.359
  689    HE2  PHE  33           2HE      PHE  33  -0.190   1.893  -2.604
  690    HZ   PHE  33           HZ       PHE  33   0.332   2.099  -5.003
  691    H    PHE  34           H        PHE  34  -4.958   4.401  -1.079
  692    HA   PHE  34           HA       PHE  34  -5.574   1.692  -1.630
  693   1HB   PHE  34          2HB       PHE  34  -6.161   3.275   0.874
  694   2HB   PHE  34          1HB       PHE  34  -6.098   1.515   0.742
  695    HD1  PHE  34           1HD      PHE  34  -3.824   0.854  -0.706
  696    HD2  PHE  34           2HD      PHE  34  -4.332   4.105   1.971
  697    HE1  PHE  34           1HE      PHE  34  -1.395   0.919  -0.343
  698    HE2  PHE  34           2HE      PHE  34  -1.900   4.177   2.358
  699    HZ   PHE  34           HZ       PHE  34  -0.437   2.582   1.186
  700    H    ASN  35           H        ASN  35  -7.565   4.527  -1.086
  701    HA   ASN  35           HA       ASN  35 -10.079   3.392  -0.798
  702   1HB   ASN  35          2HB       ASN  35  -9.617   5.811  -0.646
  703   2HB   ASN  35          1HB       ASN  35  -9.306   5.862  -2.378
  704   1HD2  ASN  35          1HD2      ASN  35 -11.409   6.817  -0.269
  705   2HD2  ASN  35          2HD2      ASN  35 -12.896   6.625  -1.129
  706    H    ASP  36           H        ASP  36  -8.141   3.966  -3.645
  707    HA   ASP  36           HA       ASP  36 -10.160   2.825  -5.418
  708   1HB   ASP  36          2HB       ASP  36  -7.489   4.088  -6.053
  709   2HB   ASP  36          1HB       ASP  36  -8.661   3.540  -7.246
  710    H    ASN  37           H        ASN  37  -7.130   1.919  -3.937
  711    HA   ASN  37           HA       ASN  37  -6.627  -0.256  -5.773
  712   1HB   ASN  37          2HB       ASN  37  -5.425   0.331  -3.055
  713   2HB   ASN  37          1HB       ASN  37  -4.870  -0.926  -4.154
  714   1HD2  ASN  37          1HD2      ASN  37  -3.764   1.687  -2.992
  715   2HD2  ASN  37          2HD2      ASN  37  -3.067   2.456  -4.371
  716    H    GLY  38           H        GLY  38  -7.884   0.174  -2.546
  717   1HA   GLY  38          2HA       GLY  38  -8.303  -1.833  -1.135
  718   2HA   GLY  38          1HA       GLY  38  -9.761  -1.095  -1.758
  719    H    VAL  39           H        VAL  39 -11.172  -2.413  -2.591
  720    HA   VAL  39           HA       VAL  39 -10.544  -5.171  -2.919
  721    HB   VAL  39           HB       VAL  39 -13.122  -3.689  -3.303
  722   1HG1  VAL  39          1HG1      VAL  39 -12.423  -6.578  -3.582
  723   2HG1  VAL  39          2HG1      VAL  39 -13.530  -5.592  -4.539
  724   3HG1  VAL  39          3HG1      VAL  39 -13.998  -6.131  -2.926
  725   1HG2  VAL  39          1HG2      VAL  39 -11.680  -4.412  -0.999
  726   2HG2  VAL  39          2HG2      VAL  39 -13.052  -5.517  -1.103
  727   3HG2  VAL  39          3HG2      VAL  39 -13.321  -3.775  -1.095
  728    H    ASP  40           H        ASP  40 -11.960  -2.834  -5.278
  729    HA   ASP  40           HA       ASP  40 -11.494  -4.807  -7.352
  730   1HB   ASP  40          2HB       ASP  40 -12.858  -2.116  -7.454
  731   2HB   ASP  40          1HB       ASP  40 -12.773  -3.260  -8.791
  732    H    GLY  41           H        GLY  41  -9.190  -3.300  -6.143
  733   1HA   GLY  41          2HA       GLY  41  -8.268  -1.389  -8.012
  734   2HA   GLY  41          1HA       GLY  41  -7.262  -2.277  -6.879
  735    H    GLU  42           H        GLU  42  -6.940  -1.526  -9.780
  736    HA   GLU  42           HA       GLU  42  -6.960  -4.035 -11.211
  737   1HB   GLU  42          2HB       GLU  42  -5.727  -1.367 -11.931
  738   2HB   GLU  42          1HB       GLU  42  -5.867  -2.744 -13.016
  739   1HG   GLU  42          2HG       GLU  42  -8.159  -1.233 -11.781
  740   2HG   GLU  42          1HG       GLU  42  -7.591  -1.081 -13.443
  741    H    TRP  43           H        TRP  43  -5.602  -5.487 -10.225
  742    HA   TRP  43           HA       TRP  43  -2.799  -4.666  -9.847
  743   1HB   TRP  43          2HB       TRP  43  -4.164  -7.100  -8.706
  744   2HB   TRP  43          1HB       TRP  43  -2.576  -6.482  -8.286
  745    HD1  TRP  43           HD       TRP  43  -5.046  -3.679  -8.398
  746    HE1  TRP  43           1HE      TRP  43  -5.777  -3.071  -6.008
  747    HE3  TRP  43           3HE      TRP  43  -3.101  -7.692  -5.929
  748    HZ2  TRP  43           2HZ      TRP  43  -5.551  -4.164  -3.415
  749    HZ3  TRP  43           3HZ      TRP  43  -3.395  -7.836  -3.499
  750    HH2  TRP  43           HH       TRP  43  -4.592  -6.105  -2.262
  751    H    THR  44           H        THR  44  -1.182  -5.648 -10.922
  752    HA   THR  44           HA       THR  44  -1.860  -7.955 -12.626
  753    HB   THR  44           HB       THR  44   0.070  -7.261 -14.038
  754    HG1  THR  44           1HG      THR  44   0.073  -4.942 -12.410
  755   1HG2  THR  44          1HG2      THR  44  -2.426  -6.154 -14.073
  756   2HG2  THR  44          2HG2      THR  44  -1.187  -5.942 -15.310
  757   3HG2  THR  44          3HG2      THR  44  -1.376  -4.737 -14.036
  758    H    TYR  45           H        TYR  45  -0.518  -9.781 -12.502
  759    HA   TYR  45           HA       TYR  45   1.388  -9.711 -10.258
  760   1HB   TYR  45          2HB       TYR  45  -0.533 -11.171  -9.880
  761   2HB   TYR  45          1HB       TYR  45  -0.181 -12.046 -11.367
  762    HD1  TYR  45           1HD      TYR  45   2.095 -10.920  -8.631
  763    HD2  TYR  45           2HD      TYR  45   0.390 -14.204 -10.731
  764    HE1  TYR  45           1HE      TYR  45   3.535 -12.466  -7.372
  765    HE2  TYR  45           2HE      TYR  45   1.824 -15.758  -9.478
  766    HH   TYR  45           HH       TYR  45   4.036 -15.647  -8.260
  767    H    ASP  46           H        ASP  46   3.382 -10.639 -10.399
  768    HA   ASP  46           HA       ASP  46   4.255 -11.550 -13.058
  769   1HB   ASP  46          2HB       ASP  46   5.132  -9.298 -12.605
  770   2HB   ASP  46          1HB       ASP  46   5.827  -9.868 -11.090
  771    H    ASP  47           H        ASP  47   3.829 -13.700 -12.291
  772    HA   ASP  47           HA       ASP  47   4.676 -14.936 -10.019
  773   1HB   ASP  47          2HB       ASP  47   4.724 -16.093 -12.812
  774   2HB   ASP  47          1HB       ASP  47   4.765 -17.033 -11.323
  775    H    ALA  48           H        ALA  48   6.660 -14.175 -12.831
  776    HA   ALA  48           HA       ALA  48   8.898 -15.685 -12.378
  777   1HB   ALA  48          1HB       ALA  48   9.141 -12.821 -13.222
  778   2HB   ALA  48          2HB       ALA  48   8.390 -14.029 -14.264
  779   3HB   ALA  48          3HB       ALA  48  10.070 -14.221 -13.759
  780    H    THR  49           H        THR  49   7.897 -12.815 -10.632
  781    HA   THR  49           HA       THR  49  10.196 -13.210  -8.834
  782    HB   THR  49           HB       THR  49  10.282 -10.766  -8.475
  783    HG1  THR  49           1HG      THR  49   8.340 -10.738 -10.538
  784   1HG2  THR  49          1HG2      THR  49  10.475 -10.959 -11.417
  785   2HG2  THR  49          2HG2      THR  49  11.478 -12.051 -10.464
  786   3HG2  THR  49          3HG2      THR  49  11.614 -10.307 -10.240
  787    H    LYS  50           H        LYS  50   7.103 -13.769  -8.914
  788    HA   LYS  50           HA       LYS  50   5.343 -13.748  -7.454
  789   1HB   LYS  50          2HB       LYS  50   7.736 -13.927  -5.651
  790   2HB   LYS  50          1HB       LYS  50   6.120 -13.839  -4.970
  791   1HG   LYS  50          2HG       LYS  50   6.628 -16.120  -5.071
  792   2HG   LYS  50          1HG       LYS  50   5.549 -15.828  -6.436
  793   1HD   LYS  50          2HD       LYS  50   7.326 -17.224  -7.197
  794   2HD   LYS  50          1HD       LYS  50   7.577 -15.617  -7.883
  795   1HE   LYS  50          2HE       LYS  50   9.217 -15.124  -6.142
  796   2HE   LYS  50          1HE       LYS  50   8.948 -16.714  -5.428
  797   1HZ   LYS  50          1HZ       LYS  50   9.955 -17.768  -7.226
  798   2HZ   LYS  50          2HZ       LYS  50  10.944 -16.424  -6.957
  799   3HZ   LYS  50          3HZ       LYS  50   9.834 -16.415  -8.232
  800    H    THR  51           H        THR  51   6.189 -11.184  -8.427
  801    HA   THR  51           HA       THR  51   5.456  -9.487  -6.141
  802    HB   THR  51           HB       THR  51   7.093  -8.776  -8.582
  803    HG1  THR  51           1HG      THR  51   7.755  -9.261  -5.882
  804   1HG2  THR  51          1HG2      THR  51   7.244  -6.924  -6.379
  805   2HG2  THR  51          2HG2      THR  51   5.607  -7.037  -7.024
  806   3HG2  THR  51          3HG2      THR  51   6.950  -6.624  -8.092
  807    H    PHE  52           H        PHE  52   3.739  -8.181  -6.303
  808    HA   PHE  52           HA       PHE  52   2.228  -8.228  -8.835
  809   1HB   PHE  52          2HB       PHE  52   1.196  -7.606  -6.057
  810   2HB   PHE  52          1HB       PHE  52   0.231  -7.822  -7.514
  811    HD1  PHE  52           1HD      PHE  52  -0.830  -9.835  -7.776
  812    HD2  PHE  52           2HD      PHE  52   2.768  -9.694  -5.510
  813    HE1  PHE  52           1HE      PHE  52  -1.074 -12.227  -7.246
  814    HE2  PHE  52           2HE      PHE  52   2.532 -12.086  -4.981
  815    HZ   PHE  52           HZ       PHE  52   0.611 -13.354  -5.850
  816    H    THR  53           H        THR  53   1.334  -6.251  -9.631
  817    HA   THR  53           HA       THR  53   2.477  -3.847  -8.371
  818    HB   THR  53           HB       THR  53   2.348  -2.912 -10.798
  819    HG1  THR  53           1HG      THR  53   2.467  -5.703 -11.259
  820   1HG2  THR  53          1HG2      THR  53   4.576  -4.423 -11.221
  821   2HG2  THR  53          2HG2      THR  53   4.423  -4.452  -9.465
  822   3HG2  THR  53          3HG2      THR  53   4.515  -2.909 -10.316
  823    H    VAL  54           H        VAL  54   0.978  -2.688  -7.478
  824    HA   VAL  54           HA       VAL  54  -1.754  -2.691  -8.507
  825    HB   VAL  54           HB       VAL  54  -0.626  -1.376  -6.018
  826   1HG1  VAL  54          1HG1      VAL  54  -3.004  -0.820  -7.346
  827   2HG1  VAL  54          2HG1      VAL  54  -2.607  -0.413  -5.677
  828   3HG1  VAL  54          3HG1      VAL  54  -3.473  -1.907  -6.038
  829   1HG2  VAL  54          1HG2      VAL  54  -0.518  -3.529  -5.357
  830   2HG2  VAL  54          2HG2      VAL  54  -1.650  -4.079  -6.594
  831   3HG2  VAL  54          3HG2      VAL  54  -2.254  -3.323  -5.120
  832    H    THR  55           H        THR  55  -2.086  -1.336 -10.161
  833    HA   THR  55           HA       THR  55  -0.737   1.267 -10.142
  834    HB   THR  55           HB       THR  55  -2.137  -0.113 -12.432
  835    HG1  THR  55           1HG      THR  55  -0.377  -1.252 -12.437
  836   1HG2  THR  55          1HG2      THR  55  -0.913   1.451 -13.850
  837   2HG2  THR  55          2HG2      THR  55  -0.300   2.269 -12.411
  838   3HG2  THR  55          3HG2      THR  55  -2.028   2.284 -12.766
  839    H    GLU  56           H        GLU  56  -1.844   2.999  -9.532
  840    HA   GLU  56           HA       GLU  56  -4.580   2.976  -8.937
  841   1HB   GLU  56          2HB       GLU  56  -3.013   4.572  -7.938
  842   2HB   GLU  56          1HB       GLU  56  -2.777   5.336  -9.503
  843   1HG   GLU  56          2HG       GLU  56  -4.274   6.639  -8.111
  844   2HG   GLU  56          1HG       GLU  56  -5.111   6.023  -9.535
  Start of MODEL   14
    1   1H    MET   1          1HT       MET   1   5.265 -18.598   2.406
    2   2H    MET   1          2HT       MET   1   5.924 -19.889   1.533
    3   3H    MET   1          3HT       MET   1   4.860 -18.814   0.777
    4    HA   MET   1           HA       MET   1   7.617 -18.276   1.706
    5   1HB   MET   1          2HB       MET   1   6.284 -18.089  -1.005
    6   2HB   MET   1          1HB       MET   1   7.971 -17.735  -0.665
    7   1HG   MET   1          2HG       MET   1   8.334 -20.060  -0.026
    8   2HG   MET   1          1HG       MET   1   6.641 -20.415  -0.360
    9   1HE   MET   1          1HE       MET   1   9.457 -18.457  -1.710
   10   2HE   MET   1          2HE       MET   1   9.148 -18.419  -3.445
   11   3HE   MET   1          3HE       MET   1  10.193 -19.666  -2.762
   12    H    GLN   2           H        GLN   2   8.262 -16.059   0.592
   13    HA   GLN   2           HA       GLN   2   6.295 -14.077   1.511
   14   1HB   GLN   2          2HB       GLN   2   8.425 -14.048   2.734
   15   2HB   GLN   2          1HB       GLN   2   9.298 -13.830   1.224
   16   1HG   GLN   2          2HG       GLN   2   8.207 -11.671   0.901
   17   2HG   GLN   2          1HG       GLN   2   7.328 -11.889   2.414
   18   1HE2  GLN   2          1HE2      GLN   2   9.856 -10.352   1.081
   19   2HE2  GLN   2          2HE2      GLN   2  10.868 -10.159   2.469
   20    H    TYR   3           H        TYR   3   5.802 -12.304   0.211
   21    HA   TYR   3           HA       TYR   3   6.863 -12.387  -2.533
   22   1HB   TYR   3          2HB       TYR   3   3.978 -11.945  -1.736
   23   2HB   TYR   3          1HB       TYR   3   4.611 -11.821  -3.375
   24    HD1  TYR   3           1HD      TYR   3   4.237 -13.639  -4.739
   25    HD2  TYR   3           2HD      TYR   3   4.678 -14.288  -0.557
   26    HE1  TYR   3           1HE      TYR   3   3.847 -16.043  -5.076
   27    HE2  TYR   3           2HE      TYR   3   4.294 -16.693  -0.884
   28    HH   TYR   3           HH       TYR   3   3.489 -18.247  -2.380
   29    H    LYS   4           H        LYS   4   7.020 -10.415  -3.616
   30    HA   LYS   4           HA       LYS   4   6.932  -8.073  -1.839
   31   1HB   LYS   4          2HB       LYS   4   9.149  -8.611  -2.709
   32   2HB   LYS   4          1HB       LYS   4   8.543  -8.536  -4.357
   33   1HG   LYS   4          2HG       LYS   4   8.011  -6.154  -4.018
   34   2HG   LYS   4          1HG       LYS   4   8.713  -6.250  -2.404
   35   1HD   LYS   4          2HD       LYS   4  10.206  -6.860  -4.955
   36   2HD   LYS   4          1HD       LYS   4  10.246  -5.306  -4.126
   37   1HE   LYS   4          2HE       LYS   4  12.187  -6.482  -3.454
   38   2HE   LYS   4          1HE       LYS   4  11.073  -6.530  -2.090
   39   1HZ   LYS   4          1HZ       LYS   4  10.987  -8.737  -2.175
   40   2HZ   LYS   4          2HZ       LYS   4  12.323  -8.670  -3.208
   41   3HZ   LYS   4          3HZ       LYS   4  10.763  -8.770  -3.852
   42    H    VAL   5           H        VAL   5   5.122  -6.953  -2.112
   43    HA   VAL   5           HA       VAL   5   3.886  -6.826  -4.752
   44    HB   VAL   5           HB       VAL   5   2.857  -5.796  -2.106
   45   1HG1  VAL   5          1HG1      VAL   5   1.477  -6.108  -4.770
   46   2HG1  VAL   5          2HG1      VAL   5   1.902  -4.586  -3.984
   47   3HG1  VAL   5          3HG1      VAL   5   0.694  -5.647  -3.257
   48   1HG2  VAL   5          1HG2      VAL   5   2.773  -8.430  -3.404
   49   2HG2  VAL   5          2HG2      VAL   5   1.229  -7.847  -2.784
   50   3HG2  VAL   5          3HG2      VAL   5   2.614  -7.996  -1.702
   51    H    ILE   6           H        ILE   6   3.970  -5.124  -6.024
   52    HA   ILE   6           HA       ILE   6   5.279  -2.687  -5.053
   53    HB   ILE   6           HB       ILE   6   4.835  -3.727  -7.853
   54   1HG1  ILE   6          2HG1      ILE   6   7.364  -3.221  -6.274
   55   2HG1  ILE   6          1HG1      ILE   6   6.642  -4.800  -6.556
   56   1HG2  ILE   6          1HG2      ILE   6   6.532  -1.643  -8.168
   57   2HG2  ILE   6          2HG2      ILE   6   5.479  -1.026  -6.897
   58   3HG2  ILE   6          3HG2      ILE   6   4.791  -1.556  -8.433
   59   1HD1  ILE   6          1HD1      ILE   6   8.535  -4.361  -8.039
   60   2HD1  ILE   6          2HD1      ILE   6   7.688  -2.958  -8.693
   61   3HD1  ILE   6          3HD1      ILE   6   7.032  -4.577  -8.936
   62    H    LEU   7           H        LEU   7   3.995  -1.077  -4.497
   63    HA   LEU   7           HA       LEU   7   1.287  -0.932  -5.585
   64   1HB   LEU   7          2HB       LEU   7   2.403   0.887  -3.472
   65   2HB   LEU   7          1HB       LEU   7   0.737   0.413  -3.743
   66    HG   LEU   7           HG       LEU   7   2.926  -1.308  -2.596
   67   1HD1  LEU   7          1HD1      LEU   7   1.980   0.375  -1.076
   68   2HD1  LEU   7          2HD1      LEU   7   1.584  -1.271  -0.585
   69   3HD1  LEU   7          3HD1      LEU   7   0.370  -0.272  -1.385
   70   1HD2  LEU   7          1HD2      LEU   7   1.421  -2.580  -4.079
   71   2HD2  LEU   7          2HD2      LEU   7   0.045  -2.020  -3.129
   72   3HD2  LEU   7          3HD2      LEU   7   1.268  -3.052  -2.386
   73    H    ASN   8           H        ASN   8   1.846  -0.209  -7.679
   74    HA   ASN   8           HA       ASN   8   3.167   2.380  -7.926
   75   1HB   ASN   8          2HB       ASN   8   3.824   0.431  -9.352
   76   2HB   ASN   8          1HB       ASN   8   2.229   0.495 -10.093
   77   1HD2  ASN   8          1HD2      ASN   8   5.243   1.147 -10.740
   78   2HD2  ASN   8          2HD2      ASN   8   5.096   2.573 -11.707
   79    H    GLY   9           H        GLY   9   1.808   4.086  -7.643
   80   1HA   GLY   9          2HA       GLY   9  -0.813   3.947  -9.007
   81   2HA   GLY   9          1HA       GLY   9  -0.531   4.860  -7.535
   82    H    LYS  10           H        LYS  10  -1.548   6.566  -8.857
   83    HA   LYS  10           HA       LYS  10  -0.088   7.677 -11.051
   84   1HB   LYS  10          2HB       LYS  10  -2.300   8.885  -9.380
   85   2HB   LYS  10          1HB       LYS  10  -1.710   9.520 -10.909
   86   1HG   LYS  10          2HG       LYS  10  -2.470   7.508 -12.051
   87   2HG   LYS  10          1HG       LYS  10  -3.039   6.846 -10.517
   88   1HD   LYS  10          2HD       LYS  10  -4.602   8.722 -10.295
   89   2HD   LYS  10          1HD       LYS  10  -4.036   9.372 -11.835
   90   1HE   LYS  10          2HE       LYS  10  -4.806   7.351 -12.973
   91   2HE   LYS  10          1HE       LYS  10  -5.363   6.693 -11.435
   92   1HZ   LYS  10          1HZ       LYS  10  -6.628   9.032 -11.458
   93   2HZ   LYS  10          2HZ       LYS  10  -7.295   7.610 -12.088
   94   3HZ   LYS  10          3HZ       LYS  10  -6.561   8.729 -13.122
   95    H    THR  11           H        THR  11  -0.782   8.914  -7.765
   96    HA   THR  11           HA       THR  11   1.601  10.612  -7.972
   97    HB   THR  11           HB       THR  11   0.442  11.780  -5.993
   98    HG1  THR  11           1HG      THR  11  -1.081   9.947  -5.802
   99   1HG2  THR  11          1HG2      THR  11   0.243  12.237  -8.688
  100   2HG2  THR  11          2HG2      THR  11  -0.320  13.312  -7.410
  101   3HG2  THR  11          3HG2      THR  11  -1.439  12.177  -8.166
  102    H    LEU  12           H        LEU  12   0.990   7.675  -6.925
  103    HA   LEU  12           HA       LEU  12   2.737   7.976  -4.600
  104   1HB   LEU  12          2HB       LEU  12   0.476   7.829  -3.734
  105   2HB   LEU  12          1HB       LEU  12   0.185   6.378  -4.671
  106    HG   LEU  12           HG       LEU  12   1.719   5.117  -3.323
  107   1HD1  LEU  12          1HD1      LEU  12   3.487   6.182  -2.508
  108   2HD1  LEU  12          2HD1      LEU  12   2.435   6.781  -1.222
  109   3HD1  LEU  12          3HD1      LEU  12   2.702   7.747  -2.669
  110   1HD2  LEU  12          1HD2      LEU  12   0.493   6.402  -1.047
  111   2HD2  LEU  12          2HD2      LEU  12   0.176   4.817  -1.748
  112   3HD2  LEU  12          3HD2      LEU  12  -0.651   6.241  -2.379
  113    H    LYS  13           H        LYS  13   4.232   6.417  -4.336
  114    HA   LYS  13           HA       LYS  13   4.058   3.956  -5.892
  115   1HB   LYS  13          2HB       LYS  13   6.379   5.883  -6.121
  116   2HB   LYS  13          1HB       LYS  13   6.349   4.256  -6.788
  117   1HG   LYS  13          2HG       LYS  13   4.481   4.880  -8.235
  118   2HG   LYS  13          1HG       LYS  13   4.507   6.512  -7.563
  119   1HD   LYS  13          2HD       LYS  13   6.771   5.190  -9.063
  120   2HD   LYS  13          1HD       LYS  13   5.664   6.394  -9.725
  121   1HE   LYS  13          2HE       LYS  13   7.564   6.807  -7.417
  122   2HE   LYS  13          1HE       LYS  13   7.785   7.407  -9.062
  123   1HZ   LYS  13          1HZ       LYS  13   6.687   9.212  -8.443
  124   2HZ   LYS  13          2HZ       LYS  13   6.310   8.550  -6.934
  125   3HZ   LYS  13          3HZ       LYS  13   5.290   8.276  -8.254
  126    H    GLY  14           H        GLY  14   5.258   2.244  -5.018
  127   1HA   GLY  14          2HA       GLY  14   7.246   2.543  -3.042
  128   2HA   GLY  14          1HA       GLY  14   5.696   2.315  -2.250
  129    H    GLU  15           H        GLU  15   7.102   0.446  -1.468
  130    HA   GLU  15           HA       GLU  15   6.382  -1.895  -3.060
  131   1HB   GLU  15          2HB       GLU  15   9.134  -1.530  -1.855
  132   2HB   GLU  15          1HB       GLU  15   8.560  -2.940  -2.732
  133   1HG   GLU  15          2HG       GLU  15   9.708  -1.933  -4.398
  134   2HG   GLU  15          1HG       GLU  15   8.152  -1.135  -4.626
  135    H    THR  16           H        THR  16   5.688  -3.579  -1.872
  136    HA   THR  16           HA       THR  16   6.107  -3.519   1.027
  137    HB   THR  16           HB       THR  16   3.972  -2.622   0.996
  138    HG1  THR  16           1HG      THR  16   3.410  -5.372   0.880
  139   1HG2  THR  16          1HG2      THR  16   3.090  -2.492  -1.071
  140   2HG2  THR  16          2HG2      THR  16   2.184  -3.896  -0.509
  141   3HG2  THR  16          3HG2      THR  16   3.614  -4.113  -1.516
  142    H    THR  17           H        THR  17   5.396  -5.644   2.068
  143    HA   THR  17           HA       THR  17   5.646  -7.914   0.242
  144    HB   THR  17           HB       THR  17   7.390  -8.933   1.701
  145    HG1  THR  17           1HG      THR  17   7.598  -6.325   2.785
  146   1HG2  THR  17          1HG2      THR  17   8.191  -7.954  -0.305
  147   2HG2  THR  17          2HG2      THR  17   9.274  -7.460   0.995
  148   3HG2  THR  17          3HG2      THR  17   8.074  -6.329   0.370
  149    H    THR  18           H        THR  18   4.107  -9.304   0.672
  150    HA   THR  18           HA       THR  18   3.086  -9.585   3.436
  151    HB   THR  18           HB       THR  18   1.423  -8.900   1.717
  152    HG1  THR  18           1HG      THR  18   0.829 -10.230   3.515
  153   1HG2  THR  18          1HG2      THR  18   0.634 -10.797   0.194
  154   2HG2  THR  18          2HG2      THR  18   2.256 -11.455   0.406
  155   3HG2  THR  18          3HG2      THR  18   2.039  -9.855  -0.304
  156    H    GLU  19           H        GLU  19   2.888 -11.668   4.320
  157    HA   GLU  19           HA       GLU  19   4.475 -13.734   2.944
  158   1HB   GLU  19          2HB       GLU  19   5.326 -13.062   5.147
  159   2HB   GLU  19          1HB       GLU  19   3.775 -13.454   5.877
  160   1HG   GLU  19          2HG       GLU  19   4.076 -15.798   5.273
  161   2HG   GLU  19          1HG       GLU  19   5.628 -15.408   4.532
  162    H    ALA  20           H        ALA  20   3.299 -15.275   1.953
  163    HA   ALA  20           HA       ALA  20   0.989 -16.374   3.343
  164   1HB   ALA  20          1HB       ALA  20   0.537 -15.803   0.476
  165   2HB   ALA  20          2HB       ALA  20   0.479 -14.437   1.591
  166   3HB   ALA  20          3HB       ALA  20  -0.597 -15.813   1.828
  167    H    VAL  21           H        VAL  21   0.406 -18.429   2.719
  168    HA   VAL  21           HA       VAL  21   2.380 -20.230   2.090
  169    HB   VAL  21           HB       VAL  21  -0.537 -20.661   1.449
  170   1HG1  VAL  21          1HG1      VAL  21   1.099 -22.816   2.596
  171   2HG1  VAL  21          2HG1      VAL  21   1.546 -22.318   0.965
  172   3HG1  VAL  21          3HG1      VAL  21  -0.099 -22.861   1.302
  173   1HG2  VAL  21          1HG2      VAL  21  -0.444 -21.662   3.858
  174   2HG2  VAL  21          2HG2      VAL  21  -0.687 -19.930   3.626
  175   3HG2  VAL  21          3HG2      VAL  21   0.907 -20.549   4.060
  176    H    ASP  22           H        ASP  22   0.194 -18.604  -0.132
  177    HA   ASP  22           HA       ASP  22   1.918 -19.408  -2.341
  178   1HB   ASP  22          2HB       ASP  22   0.087 -20.165  -3.749
  179   2HB   ASP  22          1HB       ASP  22   0.146 -21.123  -2.274
  180    H    ALA  23           H        ALA  23   1.154 -18.292  -4.443
  181    HA   ALA  23           HA       ALA  23   1.290 -15.540  -4.057
  182   1HB   ALA  23          1HB       ALA  23   1.976 -16.682  -6.126
  183   2HB   ALA  23          2HB       ALA  23   0.892 -15.325  -6.437
  184   3HB   ALA  23          3HB       ALA  23   0.279 -16.978  -6.504
  185    H    ALA  24           H        ALA  24  -1.518 -17.584  -4.721
  186    HA   ALA  24           HA       ALA  24  -3.383 -15.485  -4.988
  187   1HB   ALA  24          1HB       ALA  24  -3.845 -17.798  -5.701
  188   2HB   ALA  24          2HB       ALA  24  -5.096 -17.178  -4.624
  189   3HB   ALA  24          3HB       ALA  24  -3.881 -18.301  -4.011
  190    H    THR  25           H        THR  25  -2.630 -17.559  -2.174
  191    HA   THR  25           HA       THR  25  -4.260 -16.320  -0.316
  192    HB   THR  25           HB       THR  25  -2.640 -17.139   1.372
  193    HG1  THR  25           1HG      THR  25  -0.674 -17.557   0.867
  194   1HG2  THR  25          1HG2      THR  25  -2.424 -19.564   0.323
  195   2HG2  THR  25          2HG2      THR  25  -3.626 -18.893  -0.779
  196   3HG2  THR  25          3HG2      THR  25  -3.943 -18.930   0.956
  197    H    ALA  26           H        ALA  26  -0.954 -15.554  -1.318
  198    HA   ALA  26           HA       ALA  26  -0.536 -13.354   0.377
  199   1HB   ALA  26          1HB       ALA  26   1.416 -13.088  -0.736
  200   2HB   ALA  26          2HB       ALA  26   0.649 -13.196  -2.320
  201   3HB   ALA  26          3HB       ALA  26   1.007 -14.664  -1.413
  202    H    GLU  27           H        GLU  27  -1.658 -13.485  -3.018
  203    HA   GLU  27           HA       GLU  27  -2.158 -10.813  -3.428
  204   1HB   GLU  27          2HB       GLU  27  -2.322 -12.512  -5.188
  205   2HB   GLU  27          1HB       GLU  27  -3.766 -13.166  -4.428
  206   1HG   GLU  27          2HG       GLU  27  -4.939 -11.068  -4.841
  207   2HG   GLU  27          1HG       GLU  27  -3.491 -10.407  -5.598
  208    H    LYS  28           H        LYS  28  -4.299 -13.268  -2.027
  209    HA   LYS  28           HA       LYS  28  -6.502 -11.565  -1.581
  210   1HB   LYS  28          2HB       LYS  28  -5.678 -14.083  -0.117
  211   2HB   LYS  28          1HB       LYS  28  -7.247 -13.302   0.029
  212   1HG   LYS  28          2HG       LYS  28  -6.086 -14.542  -2.458
  213   2HG   LYS  28          1HG       LYS  28  -7.396 -15.187  -1.465
  214   1HD   LYS  28          2HD       LYS  28  -8.762 -13.231  -2.002
  215   2HD   LYS  28          1HD       LYS  28  -7.450 -12.583  -2.990
  216   1HE   LYS  28          2HE       LYS  28  -7.596 -14.530  -4.460
  217   2HE   LYS  28          1HE       LYS  28  -8.899 -15.188  -3.469
  218   1HZ   LYS  28          1HZ       LYS  28  -8.986 -13.147  -5.495
  219   2HZ   LYS  28          2HZ       LYS  28  -9.787 -12.705  -4.072
  220   3HZ   LYS  28          3HZ       LYS  28 -10.228 -14.120  -4.886
  221    H    VAL  29           H        VAL  29  -3.815 -12.582   0.499
  222    HA   VAL  29           HA       VAL  29  -4.543 -11.252   2.824
  223    HB   VAL  29           HB       VAL  29  -1.759 -11.739   1.750
  224   1HG1  VAL  29          1HG1      VAL  29  -2.746 -10.784   4.409
  225   2HG1  VAL  29          2HG1      VAL  29  -1.420 -10.167   3.424
  226   3HG1  VAL  29          3HG1      VAL  29  -1.242 -11.698   4.281
  227   1HG2  VAL  29          1HG2      VAL  29  -2.723 -13.399   3.947
  228   2HG2  VAL  29          2HG2      VAL  29  -1.910 -13.857   2.451
  229   3HG2  VAL  29          3HG2      VAL  29  -3.652 -13.592   2.461
  230    H    VAL  30           H        VAL  30  -2.730 -10.093   0.022
  231    HA   VAL  30           HA       VAL  30  -2.182  -7.513   1.052
  232    HB   VAL  30           HB       VAL  30  -2.512  -8.284  -1.853
  233   1HG1  VAL  30          1HG1      VAL  30  -2.373  -5.804  -0.998
  234   2HG1  VAL  30          2HG1      VAL  30  -1.468  -6.316  -2.421
  235   3HG1  VAL  30          3HG1      VAL  30  -0.654  -6.173  -0.863
  236   1HG2  VAL  30          1HG2      VAL  30   0.191  -8.088  -0.713
  237   2HG2  VAL  30          2HG2      VAL  30  -0.470  -9.232  -1.882
  238   3HG2  VAL  30          3HG2      VAL  30  -0.764  -9.465  -0.160
  239    H    LYS  31           H        LYS  31  -4.779  -8.788  -1.044
  240    HA   LYS  31           HA       LYS  31  -6.186  -6.452  -1.477
  241   1HB   LYS  31          2HB       LYS  31  -7.165  -9.281  -1.125
  242   2HB   LYS  31          1HB       LYS  31  -8.239  -7.955  -1.559
  243   1HG   LYS  31          2HG       LYS  31  -6.911  -7.536  -3.563
  244   2HG   LYS  31          1HG       LYS  31  -5.850  -8.881  -3.140
  245   1HD   LYS  31          2HD       LYS  31  -7.458  -9.607  -4.791
  246   2HD   LYS  31          1HD       LYS  31  -7.798 -10.400  -3.250
  247   1HE   LYS  31          2HE       LYS  31  -9.568  -8.785  -2.798
  248   2HE   LYS  31          1HE       LYS  31  -9.211  -7.956  -4.313
  249   1HZ   LYS  31          1HZ       LYS  31 -11.057  -9.881  -4.027
  250   2HZ   LYS  31          2HZ       LYS  31  -9.738 -10.782  -4.586
  251   3HZ   LYS  31          3HZ       LYS  31 -10.317  -9.480  -5.495
  252    H    GLN  32           H        GLN  32  -6.403  -8.690   1.258
  253    HA   GLN  32           HA       GLN  32  -8.440  -7.354   2.660
  254   1HB   GLN  32          2HB       GLN  32  -7.650  -9.637   3.211
  255   2HB   GLN  32          1HB       GLN  32  -6.131  -8.962   3.778
  256   1HG   GLN  32          2HG       GLN  32  -7.527  -9.467   5.654
  257   2HG   GLN  32          1HG       GLN  32  -7.350  -7.723   5.512
  258   1HE2  GLN  32          1HE2      GLN  32  -9.431  -8.912   3.133
  259   2HE2  GLN  32          2HE2      GLN  32 -10.924  -8.566   3.922
  260    H    PHE  33           H        PHE  33  -4.967  -6.955   2.554
  261    HA   PHE  33           HA       PHE  33  -4.507  -5.178   4.624
  262   1HB   PHE  33          2HB       PHE  33  -2.811  -6.286   3.127
  263   2HB   PHE  33          1HB       PHE  33  -3.225  -5.122   1.879
  264    HD1  PHE  33           1HD      PHE  33  -1.892  -5.397   5.326
  265    HD2  PHE  33           2HD      PHE  33  -2.140  -3.077   1.758
  266    HE1  PHE  33           1HE      PHE  33  -0.184  -3.852   6.198
  267    HE2  PHE  33           2HE      PHE  33  -0.435  -1.537   2.638
  268    HZ   PHE  33           HZ       PHE  33   0.541  -1.934   4.864
  269    H    PHE  34           H        PHE  34  -4.890  -4.266   1.227
  270    HA   PHE  34           HA       PHE  34  -5.402  -1.518   1.738
  271   1HB   PHE  34          2HB       PHE  34  -6.032  -3.143  -0.728
  272   2HB   PHE  34          1HB       PHE  34  -5.981  -1.378  -0.634
  273    HD1  PHE  34           1HD      PHE  34  -3.691  -0.728   0.855
  274    HD2  PHE  34           2HD      PHE  34  -4.208  -3.921  -1.904
  275    HE1  PHE  34           1HE      PHE  34  -1.264  -0.797   0.494
  276    HE2  PHE  34           2HE      PHE  34  -1.779  -3.992  -2.280
  277    HZ   PHE  34           HZ       PHE  34  -0.310  -2.430  -1.062
  278    H    ASN  35           H        ASN  35  -7.485  -4.294   1.234
  279    HA   ASN  35           HA       ASN  35  -9.962  -3.086   0.974
  280   1HB   ASN  35          2HB       ASN  35  -9.573  -5.515   0.813
  281   2HB   ASN  35          1HB       ASN  35  -9.253  -5.580   2.541
  282   1HD2  ASN  35          1HD2      ASN  35 -11.371  -6.548   0.505
  283   2HD2  ASN  35          2HD2      ASN  35 -12.856  -6.283   1.348
  284    H    ASP  36           H        ASP  36  -8.026  -3.709   3.807
  285    HA   ASP  36           HA       ASP  36 -10.011  -2.515   5.582
  286   1HB   ASP  36          2HB       ASP  36  -7.390  -3.893   6.172
  287   2HB   ASP  36          1HB       ASP  36  -8.464  -3.233   7.401
  288    H    ASN  37           H        ASN  37  -7.012  -1.663   4.036
  289    HA   ASN  37           HA       ASN  37  -6.450   0.504   5.874
  290   1HB   ASN  37          2HB       ASN  37  -5.225  -0.166   3.187
  291   2HB   ASN  37          1HB       ASN  37  -4.659   1.107   4.262
  292   1HD2  ASN  37          1HD2      ASN  37  -3.582  -1.563   3.195
  293   2HD2  ASN  37          2HD2      ASN  37  -2.943  -2.316   4.615
  294    H    GLY  38           H        GLY  38  -7.587   0.138   2.565
  295   1HA   GLY  38          2HA       GLY  38  -7.932   2.222   1.221
  296   2HA   GLY  38          1HA       GLY  38  -9.418   1.450   1.729
  297    H    VAL  39           H        VAL  39 -10.873   2.680   2.676
  298    HA   VAL  39           HA       VAL  39 -10.069   5.374   3.540
  299    HB   VAL  39           HB       VAL  39 -12.808   4.408   2.814
  300   1HG1  VAL  39          1HG1      VAL  39 -13.188   6.383   3.904
  301   2HG1  VAL  39          2HG1      VAL  39 -12.924   6.987   2.268
  302   3HG1  VAL  39          3HG1      VAL  39 -11.622   7.060   3.456
  303   1HG2  VAL  39          1HG2      VAL  39 -11.292   4.098   0.920
  304   2HG2  VAL  39          2HG2      VAL  39 -10.801   5.788   1.036
  305   3HG2  VAL  39          3HG2      VAL  39 -12.463   5.379   0.607
  306    H    ASP  40           H        ASP  40 -10.721   2.559   5.149
  307    HA   ASP  40           HA       ASP  40 -12.090   4.041   7.288
  308   1HB   ASP  40          2HB       ASP  40 -12.468   1.128   6.551
  309   2HB   ASP  40          1HB       ASP  40 -13.191   1.929   7.944
  310    H    GLY  41           H        GLY  41  -9.179   3.025   6.535
  311   1HA   GLY  41          2HA       GLY  41  -8.526   1.376   8.810
  312   2HA   GLY  41          1HA       GLY  41  -7.395   2.041   7.643
  313    H    GLU  42           H        GLU  42  -6.588   2.010  10.170
  314    HA   GLU  42           HA       GLU  42  -7.115   4.650  11.336
  315   1HB   GLU  42          2HB       GLU  42  -5.559   2.299  12.442
  316   2HB   GLU  42          1HB       GLU  42  -5.876   3.804  13.294
  317   1HG   GLU  42          2HG       GLU  42  -8.274   3.340  13.220
  318   2HG   GLU  42          1HG       GLU  42  -7.951   1.830  12.372
  319    H    TRP  43           H        TRP  43  -5.921   6.141  10.263
  320    HA   TRP  43           HA       TRP  43  -3.155   5.519   9.574
  321   1HB   TRP  43          2HB       TRP  43  -4.920   7.852   8.839
  322   2HB   TRP  43          1HB       TRP  43  -3.269   7.626   8.275
  323    HD1  TRP  43           HD       TRP  43  -6.148   5.018   8.375
  324    HE1  TRP  43           1HE      TRP  43  -6.449   4.104   5.989
  325    HE3  TRP  43           3HE      TRP  43  -2.730   7.940   5.962
  326    HZ2  TRP  43           2HZ      TRP  43  -5.369   4.563   3.418
  327    HZ3  TRP  43           3HZ      TRP  43  -2.423   7.643   3.545
  328    HH2  TRP  43           HH       TRP  43  -3.719   5.990   2.298
  329    H    THR  44           H        THR  44  -1.544   6.093  10.848
  330    HA   THR  44           HA       THR  44  -1.892   8.420  12.622
  331    HB   THR  44           HB       THR  44  -0.064   7.426  13.981
  332    HG1  THR  44           1HG      THR  44   0.594   5.318  13.518
  333   1HG2  THR  44          1HG2      THR  44  -2.078   5.253  13.652
  334   2HG2  THR  44          2HG2      THR  44  -2.558   6.825  14.290
  335   3HG2  THR  44          3HG2      THR  44  -1.324   5.875  15.119
  336    H    TYR  45           H        TYR  45  -0.434  10.098  12.483
  337    HA   TYR  45           HA       TYR  45   1.546   9.875  10.313
  338   1HB   TYR  45          2HB       TYR  45  -0.227  11.508   9.887
  339   2HB   TYR  45          1HB       TYR  45   0.155  12.334  11.393
  340    HD1  TYR  45           1HD      TYR  45   2.419  11.011   8.742
  341    HD2  TYR  45           2HD      TYR  45   0.934  14.435  10.782
  342    HE1  TYR  45           1HE      TYR  45   4.042  12.420   7.547
  343    HE2  TYR  45           2HE      TYR  45   2.552  15.854   9.591
  344    HH   TYR  45           HH       TYR  45   3.842  15.740   7.404
  345    H    ASP  46           H        ASP  46   3.617  10.616  10.570
  346    HA   ASP  46           HA       ASP  46   4.414  11.397  13.295
  347   1HB   ASP  46          2HB       ASP  46   5.108   9.082  12.845
  348   2HB   ASP  46          1HB       ASP  46   5.938   9.608  11.383
  349    H    ASP  47           H        ASP  47   4.231  13.587  12.556
  350    HA   ASP  47           HA       ASP  47   5.366  14.766  10.365
  351   1HB   ASP  47          2HB       ASP  47   5.251  15.892  13.170
  352   2HB   ASP  47          1HB       ASP  47   5.511  16.837  11.707
  353    H    ALA  48           H        ALA  48   6.993  13.758  13.312
  354    HA   ALA  48           HA       ALA  48   9.396  15.065  13.133
  355   1HB   ALA  48          1HB       ALA  48  10.114  13.646  14.730
  356   2HB   ALA  48          2HB       ALA  48   9.602  12.212  13.839
  357   3HB   ALA  48          3HB       ALA  48   8.421  13.153  14.751
  358    H    THR  49           H        THR  49   8.309  12.327  11.219
  359    HA   THR  49           HA       THR  49  10.775  12.569   9.627
  360    HB   THR  49           HB       THR  49  10.671  10.135   9.201
  361    HG1  THR  49           1HG      THR  49   8.380   9.981   9.729
  362   1HG2  THR  49          1HG2      THR  49  10.681  10.570  12.169
  363   2HG2  THR  49          2HG2      THR  49  12.007  11.079  11.122
  364   3HG2  THR  49          3HG2      THR  49  11.573   9.372  11.228
  365    H    LYS  50           H        LYS  50   7.735  13.383   9.481
  366    HA   LYS  50           HA       LYS  50   6.140  13.625   7.849
  367   1HB   LYS  50          2HB       LYS  50   8.604  13.306   6.146
  368   2HB   LYS  50          1HB       LYS  50   7.028  13.752   5.507
  369   1HG   LYS  50          2HG       LYS  50   7.363  15.556   7.533
  370   2HG   LYS  50          1HG       LYS  50   9.008  15.360   6.917
  371   1HD   LYS  50          2HD       LYS  50   6.564  16.020   5.285
  372   2HD   LYS  50          1HD       LYS  50   7.833  17.159   5.744
  373   1HE   LYS  50          2HE       LYS  50   9.466  15.874   4.477
  374   2HE   LYS  50          1HE       LYS  50   8.231  14.687   4.060
  375   1HZ   LYS  50          1HZ       LYS  50   8.864  16.626   2.440
  376   2HZ   LYS  50          2HZ       LYS  50   7.741  17.489   3.365
  377   3HZ   LYS  50          3HZ       LYS  50   7.269  16.078   2.559
  378    H    THR  51           H        THR  51   6.639  10.936   8.872
  379    HA   THR  51           HA       THR  51   5.855   9.360   6.516
  380    HB   THR  51           HB       THR  51   7.288   8.458   9.017
  381    HG1  THR  51           1HG      THR  51   8.713   9.464   7.671
  382   1HG2  THR  51          1HG2      THR  51   5.762   6.916   7.190
  383   2HG2  THR  51          2HG2      THR  51   6.744   6.374   8.551
  384   3HG2  THR  51          3HG2      THR  51   7.470   6.546   6.952
  385    H    PHE  52           H        PHE  52   4.104   8.076   6.589
  386    HA   PHE  52           HA       PHE  52   2.386   8.289   8.979
  387   1HB   PHE  52          2HB       PHE  52   1.541   7.673   6.136
  388   2HB   PHE  52          1HB       PHE  52   0.482   7.979   7.506
  389    HD1  PHE  52           1HD      PHE  52  -0.507  10.039   7.588
  390    HD2  PHE  52           2HD      PHE  52   3.312   9.670   5.745
  391    HE1  PHE  52           1HE      PHE  52  -0.561  12.429   7.004
  392    HE2  PHE  52           2HE      PHE  52   3.265  12.059   5.162
  393    HZ   PHE  52           HZ       PHE  52   1.328  13.441   5.793
  394    H    THR  53           H        THR  53   1.478   6.410   9.852
  395    HA   THR  53           HA       THR  53   2.438   3.899   8.656
  396    HB   THR  53           HB       THR  53   2.150   3.027  11.094
  397    HG1  THR  53           1HG      THR  53   2.329   4.523  12.653
  398   1HG2  THR  53          1HG2      THR  53   4.488   4.246  11.605
  399   2HG2  THR  53          2HG2      THR  53   4.404   4.433   9.852
  400   3HG2  THR  53          3HG2      THR  53   4.313   2.824  10.575
  401    H    VAL  54           H        VAL  54   0.775   3.161   7.556
  402    HA   VAL  54           HA       VAL  54  -1.934   3.288   8.575
  403    HB   VAL  54           HB       VAL  54  -0.877   1.900   6.099
  404   1HG1  VAL  54          1HG1      VAL  54  -3.558   2.164   7.297
  405   2HG1  VAL  54          2HG1      VAL  54  -2.907   0.920   6.230
  406   3HG1  VAL  54          3HG1      VAL  54  -3.456   2.457   5.561
  407   1HG2  VAL  54          1HG2      VAL  54  -2.155   4.615   6.415
  408   2HG2  VAL  54          2HG2      VAL  54  -1.733   3.849   4.884
  409   3HG2  VAL  54          3HG2      VAL  54  -0.465   4.297   6.024
  410    H    THR  55           H        THR  55  -2.402   1.941  10.204
  411    HA   THR  55           HA       THR  55  -1.251  -0.745  10.211
  412    HB   THR  55           HB       THR  55  -2.865   0.570  12.394
  413    HG1  THR  55           1HG      THR  55  -0.790   0.985  13.315
  414   1HG2  THR  55          1HG2      THR  55  -1.545  -1.011  13.826
  415   2HG2  THR  55          2HG2      THR  55  -1.052  -1.825  12.340
  416   3HG2  THR  55          3HG2      THR  55  -2.758  -1.759  12.787
  417    H    GLU  56           H        GLU  56  -2.372  -2.255   9.183
  418    HA   GLU  56           HA       GLU  56  -5.123  -2.060   8.572
  419   1HB   GLU  56          2HB       GLU  56  -3.281  -3.446   7.418
  420   2HB   GLU  56          1HB       GLU  56  -3.577  -4.645   8.668
  421   1HG   GLU  56          2HG       GLU  56  -5.575  -3.624   6.663
  422   2HG   GLU  56          1HG       GLU  56  -4.773  -5.190   6.636
  423   1H    MET   1          1HT       MET   1   5.750  18.517  -2.238
  424   2H    MET   1          2HT       MET   1   6.427  19.792  -1.356
  425   3H    MET   1          3HT       MET   1   5.326  18.742  -0.616
  426    HA   MET   1           HA       MET   1   8.083  18.137  -1.506
  427   1HB   MET   1          2HB       MET   1   6.707  17.983   1.187
  428   2HB   MET   1          1HB       MET   1   8.390  17.588   0.871
  429   1HG   MET   1          2HG       MET   1   8.818  19.905   0.236
  430   2HG   MET   1          1HG       MET   1   7.129  20.300   0.547
  431   1HE   MET   1          1HE       MET   1   9.879  18.275   1.936
  432   2HE   MET   1          2HE       MET   1   9.545  18.244   3.667
  433   3HE   MET   1          3HE       MET   1  10.628  19.465   2.999
  434    H    GLN   2           H        GLN   2   8.656  15.906  -0.379
  435    HA   GLN   2           HA       GLN   2   6.655  13.971  -1.330
  436   1HB   GLN   2          2HB       GLN   2   8.801  13.890  -2.523
  437   2HB   GLN   2          1HB       GLN   2   9.647  13.652  -1.000
  438   1HG   GLN   2          2HG       GLN   2   8.500  11.520  -0.692
  439   2HG   GLN   2          1HG       GLN   2   7.648  11.760  -2.219
  440   1HE2  GLN   2          1HE2      GLN   2  10.119  10.161  -0.852
  441   2HE2  GLN   2          2HE2      GLN   2  11.146   9.946  -2.224
  442    H    TYR   3           H        TYR   3   6.102  12.210  -0.038
  443    HA   TYR   3           HA       TYR   3   7.124  12.269   2.721
  444   1HB   TYR   3          2HB       TYR   3   4.242  11.899   1.884
  445   2HB   TYR   3          1HB       TYR   3   4.849  11.759   3.532
  446    HD1  TYR   3           1HD      TYR   3   4.499  13.585   4.890
  447    HD2  TYR   3           2HD      TYR   3   5.016  14.222   0.716
  448    HE1  TYR   3           1HE      TYR   3   4.164  15.999   5.223
  449    HE2  TYR   3           2HE      TYR   3   4.686  16.637   1.037
  450    HH   TYR   3           HH       TYR   3   3.897  18.211   2.521
  451    H    LYS   4           H        LYS   4   7.220  10.296   3.806
  452    HA   LYS   4           HA       LYS   4   7.098   7.956   2.027
  453   1HB   LYS   4          2HB       LYS   4   9.317   8.439   2.928
  454   2HB   LYS   4          1HB       LYS   4   8.685   8.379   4.567
  455   1HG   LYS   4          2HG       LYS   4   8.100   6.011   4.222
  456   2HG   LYS   4          1HG       LYS   4   8.828   6.089   2.617
  457   1HD   LYS   4          2HD       LYS   4  10.299   6.664   5.189
  458   2HD   LYS   4          1HD       LYS   4  10.312   5.107   4.360
  459   1HE   LYS   4          2HE       LYS   4  12.291   6.236   3.716
  460   2HE   LYS   4          1HE       LYS   4  11.198   6.311   2.337
  461   1HZ   LYS   4          1HZ       LYS   4  11.164   8.521   2.421
  462   2HZ   LYS   4          2HZ       LYS   4  12.483   8.421   3.473
  463   3HZ   LYS   4          3HZ       LYS   4  10.919   8.557   4.094
  464    H    VAL   5           H        VAL   5   5.259   6.879   2.276
  465    HA   VAL   5           HA       VAL   5   3.985   6.782   4.898
  466    HB   VAL   5           HB       VAL   5   2.969   5.778   2.236
  467   1HG1  VAL   5          1HG1      VAL   5   1.558   6.123   4.879
  468   2HG1  VAL   5          2HG1      VAL   5   1.956   4.591   4.101
  469   3HG1  VAL   5          3HG1      VAL   5   0.786   5.682   3.357
  470   1HG2  VAL   5          1HG2      VAL   5   2.929   8.413   3.534
  471   2HG2  VAL   5          2HG2      VAL   5   1.380   7.868   2.893
  472   3HG2  VAL   5          3HG2      VAL   5   2.784   7.984   1.831
  473    H    ILE   6           H        ILE   6   4.009   5.079   6.169
  474    HA   ILE   6           HA       ILE   6   5.271   2.610   5.217
  475    HB   ILE   6           HB       ILE   6   4.812   3.662   8.010
  476   1HG1  ILE   6          2HG1      ILE   6   7.351   3.095   6.466
  477   2HG1  ILE   6          1HG1      ILE   6   6.662   4.691   6.740
  478   1HG2  ILE   6          1HG2      ILE   6   6.456   1.538   8.350
  479   2HG2  ILE   6          2HG2      ILE   6   5.404   0.945   7.063
  480   3HG2  ILE   6          3HG2      ILE   6   4.709   1.494   8.589
  481   1HD1  ILE   6          1HD1      ILE   6   8.525   4.205   8.248
  482   2HD1  ILE   6          2HD1      ILE   6   7.635   2.825   8.890
  483   3HD1  ILE   6          3HD1      ILE   6   7.015   4.459   9.124
  484    H    LEU   7           H        LEU   7   3.958   1.033   4.643
  485    HA   LEU   7           HA       LEU   7   1.231   0.954   5.693
  486   1HB   LEU   7          2HB       LEU   7   2.333  -0.892   3.594
  487   2HB   LEU   7          1HB       LEU   7   0.673  -0.378   3.842
  488    HG   LEU   7           HG       LEU   7   2.920   1.290   2.726
  489   1HD1  LEU   7          1HD1      LEU   7   1.955  -0.370   1.193
  490   2HD1  LEU   7          2HD1      LEU   7   1.606   1.285   0.696
  491   3HD1  LEU   7          3HD1      LEU   7   0.357   0.316   1.477
  492   1HD2  LEU   7          1HD2      LEU   7   1.425   2.599   4.188
  493   2HD2  LEU   7          2HD2      LEU   7   0.049   2.073   3.220
  494   3HD2  LEU   7          3HD2      LEU   7   1.307   3.075   2.494
  495    H    ASN   8           H        ASN   8   1.743   0.219   7.793
  496    HA   ASN   8           HA       ASN   8   2.996  -2.402   8.059
  497   1HB   ASN   8          2HB       ASN   8   3.681  -0.469   9.495
  498   2HB   ASN   8          1HB       ASN   8   2.073  -0.494  10.211
  499   1HD2  ASN   8          1HD2      ASN   8   5.060  -1.222  10.901
  500   2HD2  ASN   8          2HD2      ASN   8   4.864  -2.643  11.866
  501    H    GLY   9           H        GLY   9   1.601  -4.075   7.757
  502   1HA   GLY   9          2HA       GLY   9  -1.035  -3.873   9.082
  503   2HA   GLY   9          1HA       GLY   9  -0.753  -4.792   7.614
  504    H    LYS  10           H        LYS  10  -1.830  -6.472   8.922
  505    HA   LYS  10           HA       LYS  10  -0.431  -7.617  11.135
  506   1HB   LYS  10          2HB       LYS  10  -2.647  -8.772   9.433
  507   2HB   LYS  10          1HB       LYS  10  -2.095  -9.421  10.971
  508   1HG   LYS  10          2HG       LYS  10  -2.821  -7.390  12.103
  509   2HG   LYS  10          1HG       LYS  10  -3.353  -6.715  10.562
  510   1HD   LYS  10          2HD       LYS  10  -4.957  -8.554  10.317
  511   2HD   LYS  10          1HD       LYS  10  -4.428  -9.217  11.865
  512   1HE   LYS  10          2HE       LYS  10  -5.166  -7.176  12.992
  513   2HE   LYS  10          1HE       LYS  10  -5.686  -6.506  11.446
  514   1HZ   LYS  10          1HZ       LYS  10  -7.006  -8.813  11.451
  515   2HZ   LYS  10          2HZ       LYS  10  -7.647  -7.376  12.071
  516   3HZ   LYS  10          3HZ       LYS  10  -6.955  -8.512  13.115
  517    H    THR  11           H        THR  11  -1.107  -8.838   7.842
  518    HA   THR  11           HA       THR  11   1.229 -10.595   8.081
  519    HB   THR  11           HB       THR  11   0.070 -11.733   6.085
  520    HG1  THR  11           1HG      THR  11  -1.404  -9.864   5.872
  521   1HG2  THR  11          1HG2      THR  11  -0.177 -12.186   8.779
  522   2HG2  THR  11          2HG2      THR  11  -0.748 -13.247   7.492
  523   3HG2  THR  11          3HG2      THR  11  -1.851 -12.085   8.233
  524    H    LEU  12           H        LEU  12   0.705  -7.644   7.025
  525    HA   LEU  12           HA       LEU  12   2.476  -7.987   4.725
  526   1HB   LEU  12          2HB       LEU  12   0.231  -7.783   3.828
  527   2HB   LEU  12          1HB       LEU  12  -0.034  -6.326   4.762
  528    HG   LEU  12           HG       LEU  12   1.546  -5.104   3.433
  529   1HD1  LEU  12          1HD1      LEU  12   3.300  -6.213   2.645
  530   2HD1  LEU  12          2HD1      LEU  12   2.253  -6.786   1.345
  531   3HD1  LEU  12          3HD1      LEU  12   2.476  -7.758   2.796
  532   1HD2  LEU  12          1HD2      LEU  12   0.323  -6.360   1.140
  533   2HD2  LEU  12          2HD2      LEU  12   0.033  -4.768   1.840
  534   3HD2  LEU  12          3HD2      LEU  12  -0.836  -6.173   2.456
  535    H    LYS  13           H        LYS  13   4.013  -6.465   4.484
  536    HA   LYS  13           HA       LYS  13   3.878  -3.999   6.038
  537   1HB   LYS  13          2HB       LYS  13   6.145  -5.983   6.300
  538   2HB   LYS  13          1HB       LYS  13   6.147  -4.356   6.966
  539   1HG   LYS  13          2HG       LYS  13   4.245  -4.934   8.387
  540   2HG   LYS  13          1HG       LYS  13   4.241  -6.566   7.716
  541   1HD   LYS  13          2HD       LYS  13   6.514  -5.298   9.245
  542   2HD   LYS  13          1HD       LYS  13   5.370  -6.476   9.893
  543   1HE   LYS  13          2HE       LYS  13   7.291  -6.934   7.611
  544   2HE   LYS  13          1HE       LYS  13   7.476  -7.540   9.257
  545   1HZ   LYS  13          1HZ       LYS  13   6.341  -9.317   8.623
  546   2HZ   LYS  13          2HZ       LYS  13   6.001  -8.646   7.110
  547   3HZ   LYS  13          3HZ       LYS  13   4.970  -8.348   8.415
  548    H    GLY  14           H        GLY  14   5.131  -2.318   5.179
  549   1HA   GLY  14          2HA       GLY  14   7.138  -2.667   3.231
  550   2HA   GLY  14          1HA       GLY  14   5.605  -2.401   2.419
  551    H    GLU  15           H        GLU  15   7.067  -0.566   1.656
  552    HA   GLU  15           HA       GLU  15   6.383   1.792   3.239
  553   1HB   GLU  15          2HB       GLU  15   9.141   1.362   2.073
  554   2HB   GLU  15          1HB       GLU  15   8.588   2.784   2.944
  555   1HG   GLU  15          2HG       GLU  15   9.691   1.750   4.624
  556   2HG   GLU  15          1HG       GLU  15   8.114   0.992   4.831
  557    H    THR  16           H        THR  16   5.744   3.493   2.042
  558    HA   THR  16           HA       THR  16   6.203   3.422  -0.850
  559    HB   THR  16           HB       THR  16   4.047   2.577  -0.851
  560    HG1  THR  16           1HG      THR  16   3.552   5.341  -0.740
  561   1HG2  THR  16          1HG2      THR  16   3.132   2.468   1.203
  562   2HG2  THR  16          2HG2      THR  16   2.269   3.895   0.630
  563   3HG2  THR  16          3HG2      THR  16   3.688   4.077   1.658
  564    H    THR  17           H        THR  17   5.558   5.563  -1.900
  565    HA   THR  17           HA       THR  17   5.839   7.829  -0.072
  566    HB   THR  17           HB       THR  17   7.627   8.803  -1.505
  567    HG1  THR  17           1HG      THR  17   7.789   6.192  -2.588
  568   1HG2  THR  17          1HG2      THR  17   8.375   7.806   0.512
  569   2HG2  THR  17          2HG2      THR  17   9.464   7.286  -0.774
  570   3HG2  THR  17          3HG2      THR  17   8.230   6.185  -0.165
  571    H    THR  18           H        THR  18   4.339   9.253  -0.523
  572    HA   THR  18           HA       THR  18   3.365   9.559  -3.301
  573    HB   THR  18           HB       THR  18   1.663   8.914  -1.605
  574    HG1  THR  18           1HG      THR  18   1.129  10.259  -3.412
  575   1HG2  THR  18          1HG2      THR  18   0.897  10.828  -0.093
  576   2HG2  THR  18          2HG2      THR  18   2.538  11.448  -0.282
  577   3HG2  THR  18          3HG2      THR  18   2.274   9.854   0.425
  578    H    GLU  19           H        GLU  19   3.232  11.648  -4.187
  579    HA   GLU  19           HA       GLU  19   4.848  13.673  -2.786
  580   1HB   GLU  19          2HB       GLU  19   5.715  12.982  -4.977
  581   2HB   GLU  19          1HB       GLU  19   4.185  13.409  -5.728
  582   1HG   GLU  19          2HG       GLU  19   4.533  15.747  -5.122
  583   2HG   GLU  19          1HG       GLU  19   6.065  15.320  -4.360
  584    H    ALA  20           H        ALA  20   3.697  15.245  -1.814
  585    HA   ALA  20           HA       ALA  20   1.432  16.397  -3.236
  586   1HB   ALA  20          1HB       ALA  20   0.927  15.836  -0.377
  587   2HB   ALA  20          2HB       ALA  20   0.853  14.472  -1.493
  588   3HB   ALA  20          3HB       ALA  20  -0.188  15.873  -1.744
  589    H    VAL  21           H        VAL  21   0.892  18.465  -2.622
  590    HA   VAL  21           HA       VAL  21   2.898  20.217  -1.963
  591    HB   VAL  21           HB       VAL  21  -0.014  20.721  -1.364
  592   1HG1  VAL  21          1HG1      VAL  21   1.690  22.835  -2.487
  593   2HG1  VAL  21          2HG1      VAL  21   2.102  22.324  -0.849
  594   3HG1  VAL  21          3HG1      VAL  21   0.477  22.908  -1.209
  595   1HG2  VAL  21          1HG2      VAL  21   0.136  21.720  -3.770
  596   2HG2  VAL  21          2HG2      VAL  21  -0.152  19.993  -3.543
  597   3HG2  VAL  21          3HG2      VAL  21   1.463  20.571  -3.953
  598    H    ASP  22           H        ASP  22   0.642  18.644   0.227
  599    HA   ASP  22           HA       ASP  22   2.355  19.408   2.460
  600   1HB   ASP  22          2HB       ASP  22   0.524  20.210   3.842
  601   2HB   ASP  22          1HB       ASP  22   0.628  21.165   2.368
  602    H    ALA  23           H        ALA  23   1.533  18.312   4.553
  603    HA   ALA  23           HA       ALA  23   1.611  15.558   4.167
  604   1HB   ALA  23          1HB       ALA  23   2.294  16.682   6.245
  605   2HB   ALA  23          2HB       ALA  23   1.174  15.352   6.541
  606   3HB   ALA  23          3HB       ALA  23   0.601  17.018   6.601
  607    H    ALA  24           H        ALA  24  -1.158  17.669   4.792
  608    HA   ALA  24           HA       ALA  24  -3.077  15.616   5.032
  609   1HB   ALA  24          1HB       ALA  24  -3.491  17.941   5.737
  610   2HB   ALA  24          2HB       ALA  24  -4.741  17.351   4.641
  611   3HB   ALA  24          3HB       ALA  24  -3.491  18.443   4.047
  612    H    THR  25           H        THR  25  -2.233  17.670   2.229
  613    HA   THR  25           HA       THR  25  -3.866  16.471   0.348
  614    HB   THR  25           HB       THR  25  -2.201  17.251  -1.316
  615    HG1  THR  25           1HG      THR  25  -0.234  17.620  -0.782
  616   1HG2  THR  25          1HG2      THR  25  -1.942  19.671  -0.264
  617   2HG2  THR  25          2HG2      THR  25  -3.176  19.031   0.821
  618   3HG2  THR  25          3HG2      THR  25  -3.466  19.073  -0.918
  619    H    ALA  26           H        ALA  26  -0.594  15.625   1.398
  620    HA   ALA  26           HA       ALA  26  -0.208  13.417  -0.293
  621   1HB   ALA  26          1HB       ALA  26   1.722  13.100   0.846
  622   2HB   ALA  26          2HB       ALA  26   0.936  13.227   2.421
  623   3HB   ALA  26          3HB       ALA  26   1.345  14.687   1.519
  624    H    GLU  27           H        GLU  27  -1.374  13.575   3.087
  625    HA   GLU  27           HA       GLU  27  -1.943  10.915   3.489
  626   1HB   GLU  27          2HB       GLU  27  -2.092  12.621   5.245
  627   2HB   GLU  27          1HB       GLU  27  -3.511  13.307   4.466
  628   1HG   GLU  27          2HG       GLU  27  -4.737  11.236   4.864
  629   2HG   GLU  27          1HG       GLU  27  -3.314  10.542   5.640
  630    H    LYS  28           H        LYS  28  -4.005  13.421   2.060
  631    HA   LYS  28           HA       LYS  28  -6.241  11.772   1.578
  632   1HB   LYS  28          2HB       LYS  28  -5.332  14.271   0.130
  633   2HB   LYS  28          1HB       LYS  28  -6.918  13.529  -0.040
  634   1HG   LYS  28          2HG       LYS  28  -5.764  14.739   2.463
  635   2HG   LYS  28          1HG       LYS  28  -7.043  15.414   1.454
  636   1HD   LYS  28          2HD       LYS  28  -8.463  13.493   1.969
  637   2HD   LYS  28          1HD       LYS  28  -7.182  12.814   2.976
  638   1HE   LYS  28          2HE       LYS  28  -7.304  14.766   4.444
  639   2HE   LYS  28          1HE       LYS  28  -8.575  15.452   3.435
  640   1HZ   LYS  28          1HZ       LYS  28  -8.740  13.415   5.458
  641   2HZ   LYS  28          2HZ       LYS  28  -9.531  12.992   4.025
  642   3HZ   LYS  28          3HZ       LYS  28  -9.951  14.417   4.833
  643    H    VAL  29           H        VAL  29  -3.495  12.722  -0.459
  644    HA   VAL  29           HA       VAL  29  -4.228  11.412  -2.796
  645    HB   VAL  29           HB       VAL  29  -1.447  11.831  -1.683
  646   1HG1  VAL  29          1HG1      VAL  29  -2.421  10.900  -4.357
  647   2HG1  VAL  29          2HG1      VAL  29  -1.125  10.249  -3.352
  648   3HG1  VAL  29          3HG1      VAL  29  -0.897  11.777  -4.207
  649   1HG2  VAL  29          1HG2      VAL  29  -2.342  13.514  -3.893
  650   2HG2  VAL  29          2HG2      VAL  29  -1.539  13.953  -2.384
  651   3HG2  VAL  29          3HG2      VAL  29  -3.287  13.728  -2.420
  652    H    VAL  30           H        VAL  30  -2.483  10.209   0.033
  653    HA   VAL  30           HA       VAL  30  -1.984   7.616  -0.991
  654    HB   VAL  30           HB       VAL  30  -2.337   8.395   1.908
  655   1HG1  VAL  30          1HG1      VAL  30  -2.245   5.913   1.053
  656   2HG1  VAL  30          2HG1      VAL  30  -1.348   6.402   2.490
  657   3HG1  VAL  30          3HG1      VAL  30  -0.517   6.241   0.945
  658   1HG2  VAL  30          1HG2      VAL  30   0.376   8.134   0.807
  659   2HG2  VAL  30          2HG2      VAL  30  -0.274   9.292   1.967
  660   3HG2  VAL  30          3HG2      VAL  30  -0.537   9.532   0.240
  661    H    LYS  31           H        LYS  31  -4.577   8.954   1.067
  662    HA   LYS  31           HA       LYS  31  -6.048   6.653   1.480
  663   1HB   LYS  31          2HB       LYS  31  -6.952   9.504   1.116
  664   2HB   LYS  31          1HB       LYS  31  -8.064   8.207   1.532
  665   1HG   LYS  31          2HG       LYS  31  -6.774   7.754   3.555
  666   2HG   LYS  31          1HG       LYS  31  -5.676   9.073   3.147
  667   1HD   LYS  31          2HD       LYS  31  -7.289   9.839   4.775
  668   2HD   LYS  31          1HD       LYS  31  -7.588  10.639   3.230
  669   1HE   LYS  31          2HE       LYS  31  -9.391   9.067   2.754
  670   2HE   LYS  31          1HE       LYS  31  -9.074   8.230   4.274
  671   1HZ   LYS  31          1HZ       LYS  31 -10.869  10.200   3.963
  672   2HZ   LYS  31          2HZ       LYS  31  -9.538  11.070   4.539
  673   3HZ   LYS  31          3HZ       LYS  31 -10.161   9.781   5.440
  674    H    GLN  32           H        GLN  32  -6.172   8.895  -1.256
  675    HA   GLN  32           HA       GLN  32  -8.219   7.609  -2.687
  676   1HB   GLN  32          2HB       GLN  32  -7.368   9.872  -3.227
  677   2HB   GLN  32          1HB       GLN  32  -5.858   9.161  -3.773
  678   1HG   GLN  32          2HG       GLN  32  -7.214   9.697  -5.669
  679   2HG   GLN  32          1HG       GLN  32  -7.081   7.949  -5.524
  680   1HE2  GLN  32          1HE2      GLN  32  -9.167   9.192  -3.174
  681   2HE2  GLN  32          2HE2      GLN  32 -10.656   8.881  -3.985
  682    H    PHE  33           H        PHE  33  -4.760   7.127  -2.530
  683    HA   PHE  33           HA       PHE  33  -4.312   5.338  -4.593
  684   1HB   PHE  33          2HB       PHE  33  -2.613   6.404  -3.074
  685   2HB   PHE  33          1HB       PHE  33  -3.071   5.251  -1.831
  686    HD1  PHE  33           1HD      PHE  33  -1.685   5.493  -5.259
  687    HD2  PHE  33           2HD      PHE  33  -2.039   3.179  -1.698
  688    HE1  PHE  33           1HE      PHE  33  -0.003   3.907  -6.108
  689    HE2  PHE  33           2HE      PHE  33  -0.361   1.599  -2.554
  690    HZ   PHE  33           HZ       PHE  33   0.656   1.972  -4.766
  691    H    PHE  34           H        PHE  34  -4.767   4.437  -1.204
  692    HA   PHE  34           HA       PHE  34  -5.338   1.703  -1.725
  693   1HB   PHE  34          2HB       PHE  34  -5.963   3.339   0.735
  694   2HB   PHE  34          1HB       PHE  34  -5.955   1.575   0.640
  695    HD1  PHE  34           1HD      PHE  34  -3.660   0.870  -0.818
  696    HD2  PHE  34           2HD      PHE  34  -4.139   4.074   1.933
  697    HE1  PHE  34           1HE      PHE  34  -1.237   0.881  -0.422
  698    HE2  PHE  34           2HE      PHE  34  -1.715   4.086   2.345
  699    HZ   PHE  34           HZ       PHE  34  -0.267   2.490   1.148
  700    H    ASN  35           H        ASN  35  -7.360   4.528  -1.246
  701    HA   ASN  35           HA       ASN  35  -9.869   3.379  -1.025
  702   1HB   ASN  35          2HB       ASN  35  -9.424   5.799  -0.857
  703   2HB   ASN  35          1HB       ASN  35  -9.079   5.855  -2.580
  704   1HD2  ASN  35          1HD2      ASN  35 -11.202   6.876  -0.574
  705   2HD2  ASN  35          2HD2      ASN  35 -12.680   6.648  -1.439
  706    H    ASP  36           H        ASP  36  -7.879   3.957  -3.829
  707    HA   ASP  36           HA       ASP  36  -9.867   2.807  -5.631
  708   1HB   ASP  36          2HB       ASP  36  -7.206   4.125  -6.187
  709   2HB   ASP  36          1HB       ASP  36  -8.278   3.488  -7.431
  710    H    ASN  37           H        ASN  37  -6.914   1.884  -4.044
  711    HA   ASN  37           HA       ASN  37  -6.377  -0.297  -5.875
  712   1HB   ASN  37          2HB       ASN  37  -5.176   0.348  -3.171
  713   2HB   ASN  37          1HB       ASN  37  -4.622  -0.942  -4.233
  714   1HD2  ASN  37          1HD2      ASN  37  -3.496   1.701  -3.155
  715   2HD2  ASN  37          2HD2      ASN  37  -2.821   2.439  -4.566
  716    H    GLY  38           H        GLY  38  -7.551   0.097  -2.587
  717   1HA   GLY  38          2HA       GLY  38  -7.966  -1.977  -1.250
  718   2HA   GLY  38          1HA       GLY  38  -9.426  -1.168  -1.775
  719    H    VAL  39           H        VAL  39 -10.900  -2.366  -2.741
  720    HA   VAL  39           HA       VAL  39 -10.150  -5.078  -3.596
  721    HB   VAL  39           HB       VAL  39 -12.876  -4.045  -2.903
  722   1HG1  VAL  39          1HG1      VAL  39 -13.285  -6.013  -3.995
  723   2HG1  VAL  39          2HG1      VAL  39 -13.052  -6.618  -2.356
  724   3HG1  VAL  39          3HG1      VAL  39 -11.740  -6.721  -3.528
  725   1HG2  VAL  39          1HG2      VAL  39 -11.371  -3.772  -0.991
  726   2HG2  VAL  39          2HG2      VAL  39 -10.922  -5.473  -1.105
  727   3HG2  VAL  39          3HG2      VAL  39 -12.577  -5.025  -0.691
  728    H    ASP  40           H        ASP  40 -10.705  -2.246  -5.210
  729    HA   ASP  40           HA       ASP  40 -12.080  -3.688  -7.367
  730   1HB   ASP  40          2HB       ASP  40 -12.401  -0.771  -6.632
  731   2HB   ASP  40          1HB       ASP  40 -13.122  -1.550  -8.037
  732    H    GLY  41           H        GLY  41  -9.154  -2.756  -6.576
  733   1HA   GLY  41          2HA       GLY  41  -8.432  -1.121  -8.840
  734   2HA   GLY  41          1HA       GLY  41  -7.333  -1.814  -7.658
  735    H    GLU  42           H        GLU  42  -6.488  -1.800 -10.174
  736    HA   GLU  42           HA       GLU  42  -7.064  -4.424 -11.351
  737   1HB   GLU  42          2HB       GLU  42  -5.436  -2.111 -12.429
  738   2HB   GLU  42          1HB       GLU  42  -5.777  -3.606 -13.291
  739   1HG   GLU  42          2HG       GLU  42  -8.165  -3.086 -13.247
  740   2HG   GLU  42          1HG       GLU  42  -7.815  -1.582 -12.394
  741    H    TRP  43           H        TRP  43  -5.923  -5.944 -10.260
  742    HA   TRP  43           HA       TRP  43  -3.153  -5.389  -9.531
  743   1HB   TRP  43          2HB       TRP  43  -4.986  -7.679  -8.818
  744   2HB   TRP  43          1HB       TRP  43  -3.337  -7.490  -8.231
  745    HD1  TRP  43           HD       TRP  43  -6.150  -4.812  -8.373
  746    HE1  TRP  43           1HE      TRP  43  -6.466  -3.892  -5.989
  747    HE3  TRP  43           3HE      TRP  43  -2.839  -7.816  -5.916
  748    HZ2  TRP  43           2HZ      TRP  43  -5.431  -4.381  -3.402
  749    HZ3  TRP  43           3HZ      TRP  43  -2.557  -7.530  -3.496
  750    HH2  TRP  43           HH       TRP  43  -3.827  -5.848  -2.263
  751    H    THR  44           H        THR  44  -1.541  -6.001 -10.783
  752    HA   THR  44           HA       THR  44  -1.916  -8.321 -12.559
  753    HB   THR  44           HB       THR  44  -0.047  -7.371 -13.892
  754    HG1  THR  44           1HG      THR  44   0.655  -5.280 -13.418
  755   1HG2  THR  44          1HG2      THR  44  -2.012  -5.150 -13.590
  756   2HG2  THR  44          2HG2      THR  44  -2.522  -6.710 -14.237
  757   3HG2  THR  44          3HG2      THR  44  -1.253  -5.791 -15.047
  758    H    TYR  45           H        TYR  45  -0.501 -10.031 -12.400
  759    HA   TYR  45           HA       TYR  45   1.450  -9.860 -10.202
  760   1HB   TYR  45          2HB       TYR  45  -0.368 -11.448  -9.802
  761   2HB   TYR  45          1HB       TYR  45   0.016 -12.283 -11.303
  762    HD1  TYR  45           1HD      TYR  45   2.273 -11.015  -8.620
  763    HD2  TYR  45           2HD      TYR  45   0.734 -14.403 -10.681
  764    HE1  TYR  45           1HE      TYR  45   3.846 -12.463  -7.403
  765    HE2  TYR  45           2HE      TYR  45   2.301 -15.861  -9.469
  766    HH   TYR  45           HH       TYR  45   3.561 -15.777  -7.263
  767    H    ASP  46           H        ASP  46   3.507 -10.650 -10.430
  768    HA   ASP  46           HA       ASP  46   4.323 -11.450 -13.145
  769   1HB   ASP  46          2HB       ASP  46   5.067  -9.154 -12.684
  770   2HB   ASP  46          1HB       ASP  46   5.863  -9.699 -11.212
  771    H    ASP  47           H        ASP  47   4.077 -13.635 -12.407
  772    HA   ASP  47           HA       ASP  47   5.151 -14.841 -10.202
  773   1HB   ASP  47          2HB       ASP  47   5.048 -15.966 -13.008
  774   2HB   ASP  47          1HB       ASP  47   5.264 -16.916 -11.543
  775    H    ALA  48           H        ALA  48   6.844 -13.873 -13.127
  776    HA   ALA  48           HA       ALA  48   9.210 -15.238 -12.912
  777   1HB   ALA  48          1HB       ALA  48   9.986 -13.838 -14.498
  778   2HB   ALA  48          2HB       ALA  48   9.497 -12.392 -13.616
  779   3HB   ALA  48          3HB       ALA  48   8.306 -13.304 -14.543
  780    H    THR  49           H        THR  49   8.164 -12.475 -11.014
  781    HA   THR  49           HA       THR  49  10.600 -12.776  -9.386
  782    HB   THR  49           HB       THR  49  10.550 -10.340  -8.962
  783    HG1  THR  49           1HG      THR  49   8.271 -10.130  -9.522
  784   1HG2  THR  49          1HG2      THR  49  10.592 -10.775 -11.930
  785   2HG2  THR  49          2HG2      THR  49  11.890 -11.316 -10.864
  786   3HG2  THR  49          3HG2      THR  49  11.499  -9.600 -10.976
  787    H    LYS  50           H        LYS  50   7.540 -13.516  -9.285
  788    HA   LYS  50           HA       LYS  50   5.918 -13.721  -7.674
  789   1HB   LYS  50          2HB       LYS  50   8.365 -13.459  -5.937
  790   2HB   LYS  50          1HB       LYS  50   6.770 -13.869  -5.320
  791   1HG   LYS  50          2HG       LYS  50   7.089 -15.679  -7.342
  792   2HG   LYS  50          1HG       LYS  50   8.729 -15.524  -6.702
  793   1HD   LYS  50          2HD       LYS  50   6.247 -16.123  -5.105
  794   2HD   LYS  50          1HD       LYS  50   7.495 -17.293  -5.547
  795   1HE   LYS  50          2HE       LYS  50   9.140 -16.048  -4.255
  796   2HE   LYS  50          1HE       LYS  50   7.928 -14.830  -3.856
  797   1HZ   LYS  50          1HZ       LYS  50   8.492 -16.785  -2.229
  798   2HZ   LYS  50          2HZ       LYS  50   7.360 -17.619  -3.170
  799   3HZ   LYS  50          3HZ       LYS  50   6.911 -16.198  -2.370
  800    H    THR  51           H        THR  51   6.495 -11.043  -8.691
  801    HA   THR  51           HA       THR  51   5.717  -9.448  -6.346
  802    HB   THR  51           HB       THR  51   7.208  -8.582  -8.826
  803    HG1  THR  51           1HG      THR  51   8.589  -9.621  -7.459
  804   1HG2  THR  51          1HG2      THR  51   5.694  -7.004  -7.019
  805   2HG2  THR  51          2HG2      THR  51   6.708  -6.486  -8.366
  806   3HG2  THR  51          3HG2      THR  51   7.406  -6.674  -6.760
  807    H    PHE  52           H        PHE  52   4.000  -8.122  -6.442
  808    HA   PHE  52           HA       PHE  52   2.311  -8.291  -8.855
  809   1HB   PHE  52          2HB       PHE  52   1.440  -7.658  -6.025
  810   2HB   PHE  52          1HB       PHE  52   0.394  -7.937  -7.410
  811    HD1  PHE  52           1HD      PHE  52  -0.642  -9.971  -7.508
  812    HD2  PHE  52           2HD      PHE  52   3.156  -9.696  -5.610
  813    HE1  PHE  52           1HE      PHE  52  -0.765 -12.359  -6.922
  814    HE2  PHE  52           2HE      PHE  52   3.044 -12.083  -5.029
  815    HZ   PHE  52           HZ       PHE  52   1.082 -13.418  -5.686
  816    H    THR  53           H        THR  53   1.462  -6.392  -9.741
  817    HA   THR  53           HA       THR  53   2.466  -3.904  -8.531
  818    HB   THR  53           HB       THR  53   2.233  -3.028 -10.973
  819    HG1  THR  53           1HG      THR  53   2.397  -4.528 -12.530
  820   1HG2  THR  53          1HG2      THR  53   4.546  -4.303 -11.452
  821   2HG2  THR  53          2HG2      THR  53   4.434  -4.486  -9.701
  822   3HG2  THR  53          3HG2      THR  53   4.391  -2.876 -10.425
  823    H    VAL  54           H        VAL  54   0.804  -3.126  -7.455
  824    HA   VAL  54           HA       VAL  54  -1.892  -3.189  -8.512
  825    HB   VAL  54           HB       VAL  54  -0.837  -1.825  -6.021
  826   1HG1  VAL  54          1HG1      VAL  54  -3.508  -2.025  -7.257
  827   2HG1  VAL  54          2HG1      VAL  54  -2.840  -0.797  -6.181
  828   3HG1  VAL  54          3HG1      VAL  54  -3.436  -2.320  -5.519
  829   1HG2  VAL  54          1HG2      VAL  54  -2.175  -4.508  -6.358
  830   2HG2  VAL  54          2HG2      VAL  54  -1.757  -3.754  -4.820
  831   3HG2  VAL  54          3HG2      VAL  54  -0.483  -4.231  -5.942
  832    H    THR  55           H        THR  55  -2.303  -1.832 -10.151
  833    HA   THR  55           HA       THR  55  -1.088   0.826 -10.138
  834    HB   THR  55           HB       THR  55  -2.703  -0.448 -12.344
  835    HG1  THR  55           1HG      THR  55  -0.627  -0.914 -13.237
  836   1HG2  THR  55          1HG2      THR  55  -1.324   1.101 -13.757
  837   2HG2  THR  55          2HG2      THR  55  -0.833   1.902 -12.263
  838   3HG2  THR  55          3HG2      THR  55  -2.533   1.878 -12.736
  839    H    GLU  56           H        GLU  56  -2.185   2.364  -9.126
  840    HA   GLU  56           HA       GLU  56  -4.948   2.235  -8.552
  841   1HB   GLU  56          2HB       GLU  56  -3.089   3.577  -7.372
  842   2HB   GLU  56          1HB       GLU  56  -3.340   4.780  -8.627
  843   1HG   GLU  56          2HG       GLU  56  -5.391   3.808  -6.652
  844   2HG   GLU  56          1HG       GLU  56  -4.552   5.355  -6.613
  Start of MODEL   15
    1   1H    MET   1          1HT       MET   1   6.571 -18.550   3.821
    2   2H    MET   1          2HT       MET   1   5.929 -19.677   2.736
    3   3H    MET   1          3HT       MET   1   5.101 -18.234   3.044
    4    HA   MET   1           HA       MET   1   7.831 -18.188   1.945
    5   1HB   MET   1          2HB       MET   1   6.496 -19.691   0.532
    6   2HB   MET   1          1HB       MET   1   5.250 -18.459   0.387
    7   1HG   MET   1          2HG       MET   1   6.612 -18.537  -1.608
    8   2HG   MET   1          1HG       MET   1   6.823 -16.999  -0.773
    9   1HE   MET   1          1HE       MET   1   8.844 -16.620  -2.344
   10   2HE   MET   1          2HE       MET   1   8.927 -18.229  -3.062
   11   3HE   MET   1          3HE       MET   1  10.355 -17.530  -2.299
   12    H    GLN   2           H        GLN   2   8.349 -16.176   1.056
   13    HA   GLN   2           HA       GLN   2   6.542 -13.996   1.858
   14   1HB   GLN   2          2HB       GLN   2   8.785 -14.030   2.915
   15   2HB   GLN   2          1HB       GLN   2   9.518 -13.910   1.322
   16   1HG   GLN   2          2HG       GLN   2   9.536 -11.751   2.319
   17   2HG   GLN   2          1HG       GLN   2   8.353 -11.742   1.012
   18   1HE2  GLN   2          1HE2      GLN   2   6.523 -10.772   1.481
   19   2HE2  GLN   2          2HE2      GLN   2   5.821 -10.617   3.051
   20    H    TYR   3           H        TYR   3   5.909 -12.446   0.394
   21    HA   TYR   3           HA       TYR   3   6.889 -12.762  -2.366
   22   1HB   TYR   3          2HB       TYR   3   4.036 -12.285  -1.484
   23   2HB   TYR   3          1HB       TYR   3   4.591 -12.214  -3.152
   24    HD1  TYR   3           1HD      TYR   3   4.341 -14.106  -4.455
   25    HD2  TYR   3           2HD      TYR   3   4.660 -14.547  -0.233
   26    HE1  TYR   3           1HE      TYR   3   3.956 -16.525  -4.681
   27    HE2  TYR   3           2HE      TYR   3   4.279 -16.965  -0.452
   28    HH   TYR   3           HH       TYR   3   4.537 -18.721  -2.193
   29    H    LYS   4           H        LYS   4   6.857 -10.884  -3.672
   30    HA   LYS   4           HA       LYS   4   7.098  -8.418  -2.109
   31   1HB   LYS   4          2HB       LYS   4   9.030  -9.043  -3.475
   32   2HB   LYS   4          1HB       LYS   4   8.019  -9.080  -4.911
   33   1HG   LYS   4          2HG       LYS   4   9.285  -7.045  -4.883
   34   2HG   LYS   4          1HG       LYS   4   7.581  -6.668  -4.627
   35   1HD   LYS   4          2HD       LYS   4   8.972  -5.363  -3.121
   36   2HD   LYS   4          1HD       LYS   4   7.994  -6.515  -2.209
   37   1HE   LYS   4          2HE       LYS   4   9.896  -8.012  -2.018
   38   2HE   LYS   4          1HE       LYS   4  10.877  -6.923  -2.997
   39   1HZ   LYS   4          1HZ       LYS   4  11.261  -5.593  -1.262
   40   2HZ   LYS   4          2HZ       LYS   4  10.769  -6.901  -0.309
   41   3HZ   LYS   4          3HZ       LYS   4   9.669  -5.676  -0.695
   42    H    VAL   5           H        VAL   5   5.676  -6.818  -2.283
   43    HA   VAL   5           HA       VAL   5   3.735  -6.918  -4.498
   44    HB   VAL   5           HB       VAL   5   3.239  -5.914  -1.688
   45   1HG1  VAL   5          1HG1      VAL   5   1.976  -5.125  -3.989
   46   2HG1  VAL   5          2HG1      VAL   5   1.281  -5.065  -2.369
   47   3HG1  VAL   5          3HG1      VAL   5   0.946  -6.439  -3.423
   48   1HG2  VAL   5          1HG2      VAL   5   1.500  -8.016  -2.279
   49   2HG2  VAL   5          2HG2      VAL   5   2.867  -8.042  -1.165
   50   3HG2  VAL   5          3HG2      VAL   5   3.085  -8.554  -2.839
   51    H    ILE   6           H        ILE   6   3.934  -5.282  -5.843
   52    HA   ILE   6           HA       ILE   6   5.224  -2.812  -4.931
   53    HB   ILE   6           HB       ILE   6   4.789  -3.921  -7.703
   54   1HG1  ILE   6          2HG1      ILE   6   7.296  -3.461  -6.073
   55   2HG1  ILE   6          1HG1      ILE   6   6.566  -5.023  -6.432
   56   1HG2  ILE   6          1HG2      ILE   6   5.915  -1.282  -6.817
   57   2HG2  ILE   6          2HG2      ILE   6   4.597  -1.591  -7.948
   58   3HG2  ILE   6          3HG2      ILE   6   6.256  -1.986  -8.398
   59   1HD1  ILE   6          1HD1      ILE   6   8.024  -5.082  -8.116
   60   2HD1  ILE   6          2HD1      ILE   6   8.309  -3.344  -8.056
   61   3HD1  ILE   6          3HD1      ILE   6   6.911  -3.978  -8.924
   62    H    LEU   7           H        LEU   7   4.044  -1.032  -4.629
   63    HA   LEU   7           HA       LEU   7   1.326  -0.960  -5.747
   64   1HB   LEU   7          2HB       LEU   7   2.386   0.794  -3.540
   65   2HB   LEU   7          1HB       LEU   7   0.714   0.442  -3.941
   66    HG   LEU   7           HG       LEU   7   2.685  -1.488  -2.730
   67   1HD1  LEU   7          1HD1      LEU   7   1.703   0.394  -1.311
   68   2HD1  LEU   7          2HD1      LEU   7   1.515  -1.257  -0.720
   69   3HD1  LEU   7          3HD1      LEU   7   0.160  -0.438  -1.498
   70   1HD2  LEU   7          1HD2      LEU   7  -0.249  -1.948  -3.174
   71   2HD2  LEU   7          2HD2      LEU   7   0.999  -3.119  -2.744
   72   3HD2  LEU   7          3HD2      LEU   7   0.965  -2.420  -4.363
   73    H    ASN   8           H        ASN   8   1.696  -0.091  -7.766
   74    HA   ASN   8           HA       ASN   8   3.116   2.474  -7.910
   75   1HB   ASN   8          2HB       ASN   8   2.330   0.552 -10.102
   76   2HB   ASN   8          1HB       ASN   8   3.123   2.101 -10.372
   77   1HD2  ASN   8          1HD2      ASN   8   3.737  -0.989 -10.456
   78   2HD2  ASN   8          2HD2      ASN   8   5.362  -1.039  -9.874
   79    H    GLY   9           H        GLY   9   1.815   4.186  -7.641
   80   1HA   GLY   9          2HA       GLY   9  -0.801   4.132  -9.020
   81   2HA   GLY   9          1HA       GLY   9  -0.508   5.007  -7.525
   82    H    LYS  10           H        LYS  10  -1.456   6.778  -8.819
   83    HA   LYS  10           HA       LYS  10   0.115   7.888 -10.953
   84   1HB   LYS  10          2HB       LYS  10  -2.182   9.081  -9.389
   85   2HB   LYS  10          1HB       LYS  10  -1.495   9.751 -10.862
   86   1HG   LYS  10          2HG       LYS  10  -2.876   7.086 -10.616
   87   2HG   LYS  10          1HG       LYS  10  -3.565   8.557 -11.308
   88   1HD   LYS  10          2HD       LYS  10  -1.832   8.550 -13.037
   89   2HD   LYS  10          1HD       LYS  10  -1.145   7.079 -12.343
   90   1HE   LYS  10          2HE       LYS  10  -2.546   6.576 -14.279
   91   2HE   LYS  10          1HE       LYS  10  -3.218   5.882 -12.805
   92   1HZ   LYS  10          1HZ       LYS  10  -4.159   8.541 -13.510
   93   2HZ   LYS  10          2HZ       LYS  10  -5.012   7.219 -12.890
   94   3HZ   LYS  10          3HZ       LYS  10  -4.648   7.289 -14.539
   95    H    THR  11           H        THR  11  -0.739   9.063  -7.690
   96    HA   THR  11           HA       THR  11   1.610  10.808  -7.750
   97    HB   THR  11           HB       THR  11   0.356  11.823  -5.731
   98    HG1  THR  11           1HG      THR  11  -1.966  11.431  -5.999
   99   1HG2  THR  11          1HG2      THR  11  -0.167  13.414  -7.170
  100   2HG2  THR  11          2HG2      THR  11  -1.508  12.438  -7.772
  101   3HG2  THR  11          3HG2      THR  11   0.090  12.287  -8.503
  102    H    LEU  12           H        LEU  12   1.009   7.801  -6.786
  103    HA   LEU  12           HA       LEU  12   2.754   8.074  -4.451
  104   1HB   LEU  12          2HB       LEU  12   0.487   7.846  -3.616
  105   2HB   LEU  12          1HB       LEU  12   0.248   6.404  -4.583
  106    HG   LEU  12           HG       LEU  12   1.793   5.164  -3.235
  107   1HD1  LEU  12          1HD1      LEU  12   2.471   6.787  -1.105
  108   2HD1  LEU  12          2HD1      LEU  12   2.698   7.812  -2.519
  109   3HD1  LEU  12          3HD1      LEU  12   3.535   6.270  -2.413
  110   1HD2  LEU  12          1HD2      LEU  12   0.532   6.376  -0.947
  111   2HD2  LEU  12          2HD2      LEU  12   0.238   4.804  -1.689
  112   3HD2  LEU  12          3HD2      LEU  12  -0.603   6.233  -2.288
  113    H    LYS  13           H        LYS  13   4.337   6.623  -4.295
  114    HA   LYS  13           HA       LYS  13   4.288   4.214  -5.979
  115   1HB   LYS  13          2HB       LYS  13   6.654   6.095  -5.804
  116   2HB   LYS  13          1HB       LYS  13   6.567   4.609  -6.738
  117   1HG   LYS  13          2HG       LYS  13   4.876   7.052  -7.222
  118   2HG   LYS  13          1HG       LYS  13   6.340   6.632  -8.112
  119   1HD   LYS  13          2HD       LYS  13   5.273   4.535  -8.834
  120   2HD   LYS  13          1HD       LYS  13   3.802   5.006  -7.983
  121   1HE   LYS  13          2HE       LYS  13   5.088   6.426 -10.310
  122   2HE   LYS  13          1HE       LYS  13   3.571   5.528 -10.326
  123   1HZ   LYS  13          1HZ       LYS  13   2.718   7.574 -10.033
  124   2HZ   LYS  13          2HZ       LYS  13   4.131   8.206  -9.352
  125   3HZ   LYS  13          3HZ       LYS  13   3.073   7.289  -8.403
  126    H    GLY  14           H        GLY  14   5.227   2.429  -4.994
  127   1HA   GLY  14          2HA       GLY  14   7.161   2.641  -2.927
  128   2HA   GLY  14          1HA       GLY  14   5.566   2.412  -2.236
  129    H    GLU  15           H        GLU  15   6.999   0.530  -1.454
  130    HA   GLU  15           HA       GLU  15   6.267  -1.791  -3.067
  131   1HB   GLU  15          2HB       GLU  15   9.051  -1.347  -1.965
  132   2HB   GLU  15          1HB       GLU  15   8.481  -2.827  -2.725
  133   1HG   GLU  15          2HG       GLU  15   8.133  -1.624  -4.820
  134   2HG   GLU  15          1HG       GLU  15   8.699  -0.137  -4.060
  135    H    THR  16           H        THR  16   5.752  -3.583  -1.881
  136    HA   THR  16           HA       THR  16   6.195  -3.541   1.002
  137    HB   THR  16           HB       THR  16   4.081  -2.601   1.062
  138    HG1  THR  16           1HG      THR  16   3.437  -5.331   0.893
  139   1HG2  THR  16          1HG2      THR  16   3.227  -2.411  -1.036
  140   2HG2  THR  16          2HG2      THR  16   2.192  -3.686  -0.391
  141   3HG2  THR  16          3HG2      THR  16   3.547  -4.094  -1.440
  142    H    THR  17           H        THR  17   5.438  -5.694   2.009
  143    HA   THR  17           HA       THR  17   5.612  -7.917   0.116
  144    HB   THR  17           HB       THR  17   7.380  -9.011   1.458
  145    HG1  THR  17           1HG      THR  17   7.447  -6.510   2.785
  146   1HG2  THR  17          1HG2      THR  17   8.079  -6.318   0.331
  147   2HG2  THR  17          2HG2      THR  17   8.152  -7.881  -0.483
  148   3HG2  THR  17          3HG2      THR  17   9.267  -7.520   0.836
  149    H    THR  18           H        THR  18   4.148  -9.389   0.560
  150    HA   THR  18           HA       THR  18   3.090  -9.636   3.313
  151    HB   THR  18           HB       THR  18   1.436  -8.968   1.593
  152    HG1  THR  18           1HG      THR  18   0.866 -10.353   3.379
  153   1HG2  THR  18          1HG2      THR  18   0.708 -10.988   0.099
  154   2HG2  THR  18          2HG2      THR  18   2.415 -11.412   0.219
  155   3HG2  THR  18          3HG2      THR  18   1.940  -9.849  -0.447
  156    H    GLU  19           H        GLU  19   2.873 -11.697   4.222
  157    HA   GLU  19           HA       GLU  19   4.449 -13.798   2.891
  158   1HB   GLU  19          2HB       GLU  19   5.235 -12.993   5.122
  159   2HB   GLU  19          1HB       GLU  19   3.721 -13.550   5.818
  160   1HG   GLU  19          2HG       GLU  19   5.703 -15.328   4.419
  161   2HG   GLU  19          1HG       GLU  19   5.631 -15.089   6.164
  162    H    ALA  20           H        ALA  20   3.284 -15.378   1.953
  163    HA   ALA  20           HA       ALA  20   0.958 -16.430   3.350
  164   1HB   ALA  20          1HB       ALA  20   0.511 -15.884   0.475
  165   2HB   ALA  20          2HB       ALA  20   0.442 -14.514   1.584
  166   3HB   ALA  20          3HB       ALA  20  -0.628 -15.896   1.821
  167    H    VAL  21           H        VAL  21   0.364 -18.491   2.749
  168    HA   VAL  21           HA       VAL  21   2.333 -20.304   2.136
  169    HB   VAL  21           HB       VAL  21  -0.585 -20.738   1.512
  170   1HG1  VAL  21          1HG1      VAL  21   1.057 -22.883   2.670
  171   2HG1  VAL  21          2HG1      VAL  21   1.491 -22.400   1.030
  172   3HG1  VAL  21          3HG1      VAL  21  -0.150 -22.940   1.387
  173   1HG2  VAL  21          1HG2      VAL  21  -0.475 -21.718   3.931
  174   2HG2  VAL  21          2HG2      VAL  21  -0.730 -19.991   3.682
  175   3HG2  VAL  21          3HG2      VAL  21   0.872 -20.595   4.111
  176    H    ASP  22           H        ASP  22   0.145 -18.695  -0.101
  177    HA   ASP  22           HA       ASP  22   1.872 -19.514  -2.302
  178   1HB   ASP  22          2HB       ASP  22   0.041 -20.303  -3.703
  179   2HB   ASP  22          1HB       ASP  22   0.135 -21.254  -2.224
  180    H    ALA  23           H        ALA  23   1.068 -18.450  -4.425
  181    HA   ALA  23           HA       ALA  23   1.187 -15.691  -4.093
  182   1HB   ALA  23          1HB       ALA  23   1.922 -16.512  -6.154
  183   2HB   ALA  23          2HB       ALA  23   0.429 -15.655  -6.538
  184   3HB   ALA  23          3HB       ALA  23   0.430 -17.415  -6.426
  185    H    ALA  24           H        ALA  24  -1.616 -17.767  -4.692
  186    HA   ALA  24           HA       ALA  24  -3.497 -15.686  -4.978
  187   1HB   ALA  24          1HB       ALA  24  -3.616 -18.380  -5.244
  188   2HB   ALA  24          2HB       ALA  24  -5.033 -17.334  -5.156
  189   3HB   ALA  24          3HB       ALA  24  -4.462 -18.167  -3.712
  190    H    THR  25           H        THR  25  -2.714 -17.703  -2.133
  191    HA   THR  25           HA       THR  25  -4.319 -16.418  -0.280
  192    HB   THR  25           HB       THR  25  -2.686 -17.229   1.403
  193    HG1  THR  25           1HG      THR  25  -0.729 -17.639   0.878
  194   1HG2  THR  25          1HG2      THR  25  -4.189 -18.911   0.815
  195   2HG2  THR  25          2HG2      THR  25  -2.596 -19.655   0.672
  196   3HG2  THR  25          3HG2      THR  25  -3.456 -19.123  -0.775
  197    H    ALA  26           H        ALA  26  -1.016 -15.699  -1.328
  198    HA   ALA  26           HA       ALA  26  -0.560 -13.477   0.329
  199   1HB   ALA  26          1HB       ALA  26   0.957 -12.806  -1.723
  200   2HB   ALA  26          2HB       ALA  26   0.582 -14.446  -2.251
  201   3HB   ALA  26          3HB       ALA  26   1.375 -14.180  -0.699
  202    H    GLU  27           H        GLU  27  -1.714 -13.652  -3.053
  203    HA   GLU  27           HA       GLU  27  -2.203 -11.001  -3.530
  204   1HB   GLU  27          2HB       GLU  27  -2.455 -12.757  -5.219
  205   2HB   GLU  27          1HB       GLU  27  -3.881 -13.362  -4.388
  206   1HG   GLU  27          2HG       GLU  27  -5.043 -11.268  -4.840
  207   2HG   GLU  27          1HG       GLU  27  -3.611 -10.649  -5.662
  208    H    LYS  28           H        LYS  28  -4.374 -13.368  -2.016
  209    HA   LYS  28           HA       LYS  28  -6.517 -11.602  -1.553
  210   1HB   LYS  28          2HB       LYS  28  -5.710 -14.087  -0.028
  211   2HB   LYS  28          1HB       LYS  28  -7.265 -13.276   0.113
  212   1HG   LYS  28          2HG       LYS  28  -6.156 -14.632  -2.334
  213   2HG   LYS  28          1HG       LYS  28  -7.485 -15.192  -1.318
  214   1HD   LYS  28          2HD       LYS  28  -8.783 -13.212  -1.929
  215   2HD   LYS  28          1HD       LYS  28  -7.451 -12.649  -2.940
  216   1HE   LYS  28          2HE       LYS  28  -9.174 -13.724  -4.288
  217   2HE   LYS  28          1HE       LYS  28  -7.669 -14.640  -4.339
  218   1HZ   LYS  28          1HZ       LYS  28  -8.585 -16.376  -3.263
  219   2HZ   LYS  28          2HZ       LYS  28 -10.032 -15.746  -3.871
  220   3HZ   LYS  28          3HZ       LYS  28  -9.568 -15.413  -2.279
  221    H    VAL  29           H        VAL  29  -3.800 -12.610   0.487
  222    HA   VAL  29           HA       VAL  29  -4.450 -11.202   2.791
  223    HB   VAL  29           HB       VAL  29  -1.699 -11.759   1.663
  224   1HG1  VAL  29          1HG1      VAL  29  -1.191 -10.235   3.283
  225   2HG1  VAL  29          2HG1      VAL  29  -1.241 -11.702   4.262
  226   3HG1  VAL  29          3HG1      VAL  29  -2.623 -10.608   4.240
  227   1HG2  VAL  29          1HG2      VAL  29  -1.851 -13.857   2.436
  228   2HG2  VAL  29          2HG2      VAL  29  -3.592 -13.576   2.438
  229   3HG2  VAL  29          3HG2      VAL  29  -2.661 -13.352   3.919
  230    H    VAL  30           H        VAL  30  -2.684 -10.164  -0.083
  231    HA   VAL  30           HA       VAL  30  -2.077  -7.559   0.860
  232    HB   VAL  30           HB       VAL  30  -2.393  -8.525  -1.992
  233   1HG1  VAL  30          1HG1      VAL  30  -0.566  -6.304  -1.320
  234   2HG1  VAL  30          2HG1      VAL  30  -2.291  -5.947  -1.247
  235   3HG1  VAL  30          3HG1      VAL  30  -1.578  -6.550  -2.743
  236   1HG2  VAL  30          1HG2      VAL  30   0.257  -8.125  -0.711
  237   2HG2  VAL  30          2HG2      VAL  30  -0.228  -9.246  -1.982
  238   3HG2  VAL  30          3HG2      VAL  30  -0.655  -9.578  -0.304
  239    H    LYS  31           H        LYS  31  -4.677  -8.852  -1.239
  240    HA   LYS  31           HA       LYS  31  -6.043  -6.480  -1.682
  241   1HB   LYS  31          2HB       LYS  31  -7.090  -9.293  -1.430
  242   2HB   LYS  31          1HB       LYS  31  -8.100  -7.933  -1.906
  243   1HG   LYS  31          2HG       LYS  31  -6.515  -7.522  -3.789
  244   2HG   LYS  31          1HG       LYS  31  -5.714  -9.035  -3.365
  245   1HD   LYS  31          2HD       LYS  31  -7.248  -9.507  -5.129
  246   2HD   LYS  31          1HD       LYS  31  -7.930 -10.177  -3.644
  247   1HE   LYS  31          2HE       LYS  31  -9.374  -8.223  -3.417
  248   2HE   LYS  31          1HE       LYS  31  -8.672  -7.523  -4.877
  249   1HZ   LYS  31          1HZ       LYS  31  -9.772 -10.199  -5.152
  250   2HZ   LYS  31          2HZ       LYS  31  -9.867  -8.875  -6.201
  251   3HZ   LYS  31          3HZ       LYS  31 -10.902  -8.972  -4.867
  252    H    GLN  32           H        GLN  32  -6.309  -8.738   1.030
  253    HA   GLN  32           HA       GLN  32  -8.414  -7.414   2.360
  254   1HB   GLN  32          2HB       GLN  32  -7.633  -9.696   2.944
  255   2HB   GLN  32          1HB       GLN  32  -6.142  -9.010   3.570
  256   1HG   GLN  32          2HG       GLN  32  -7.606  -9.512   5.392
  257   2HG   GLN  32          1HG       GLN  32  -7.439  -7.765   5.245
  258   1HE2  GLN  32          1HE2      GLN  32  -9.412  -8.995   2.792
  259   2HE2  GLN  32          2HE2      GLN  32 -10.939  -8.656   3.518
  260    H    PHE  33           H        PHE  33  -4.946  -6.990   2.341
  261    HA   PHE  33           HA       PHE  33  -4.553  -5.219   4.430
  262   1HB   PHE  33          2HB       PHE  33  -2.820  -6.312   2.950
  263   2HB   PHE  33          1HB       PHE  33  -3.200  -5.115   1.722
  264    HD1  PHE  33           1HD      PHE  33  -2.017  -5.444   5.222
  265    HD2  PHE  33           2HD      PHE  33  -2.055  -3.102   1.661
  266    HE1  PHE  33           1HE      PHE  33  -0.333  -3.929   6.187
  267    HE2  PHE  33           2HE      PHE  33  -0.375  -1.592   2.636
  268    HZ   PHE  33           HZ       PHE  33   0.486  -2.015   4.904
  269    H    PHE  34           H        PHE  34  -4.895  -4.323   1.027
  270    HA   PHE  34           HA       PHE  34  -5.437  -1.574   1.529
  271   1HB   PHE  34          2HB       PHE  34  -5.964  -3.186  -0.967
  272   2HB   PHE  34          1HB       PHE  34  -5.890  -1.424  -0.859
  273    HD1  PHE  34           1HD      PHE  34  -3.665  -0.729   0.617
  274    HD2  PHE  34           2HD      PHE  34  -4.098  -4.080  -1.952
  275    HE1  PHE  34           1HE      PHE  34  -1.226  -0.826   0.346
  276    HE2  PHE  34           2HE      PHE  34  -1.658  -4.181  -2.243
  277    HZ   PHE  34           HZ       PHE  34  -0.226  -2.551  -1.078
  278    H    ASN  35           H        ASN  35  -7.489  -4.353   0.880
  279    HA   ASN  35           HA       ASN  35  -9.959  -3.151   0.526
  280   1HB   ASN  35          2HB       ASN  35  -9.547  -5.575   0.350
  281   2HB   ASN  35          1HB       ASN  35  -9.298  -5.665   2.088
  282   1HD2  ASN  35          1HD2      ASN  35 -11.321  -6.614  -0.056
  283   2HD2  ASN  35          2HD2      ASN  35 -12.842  -6.382   0.732
  284    H    ASP  36           H        ASP  36  -8.153  -3.833   3.433
  285    HA   ASP  36           HA       ASP  36 -10.202  -2.652   5.143
  286   1HB   ASP  36          2HB       ASP  36  -7.640  -4.095   5.822
  287   2HB   ASP  36          1HB       ASP  36  -8.762  -3.447   7.015
  288    H    ASN  37           H        ASN  37  -7.069  -1.831   3.826
  289    HA   ASN  37           HA       ASN  37  -6.555   0.261   5.742
  290   1HB   ASN  37          2HB       ASN  37  -5.299  -0.335   3.054
  291   2HB   ASN  37          1HB       ASN  37  -4.774   0.968   4.112
  292   1HD2  ASN  37          1HD2      ASN  37  -3.588  -1.658   3.088
  293   2HD2  ASN  37          2HD2      ASN  37  -2.942  -2.380   4.520
  294    H    GLY  38           H        GLY  38  -7.859  -0.020   2.531
  295   1HA   GLY  38          2HA       GLY  38  -8.220   2.023   1.156
  296   2HA   GLY  38          1HA       GLY  38  -9.694   1.378   1.839
  297    H    VAL  39           H        VAL  39 -10.980   2.807   2.697
  298    HA   VAL  39           HA       VAL  39 -10.083   5.493   3.091
  299    HB   VAL  39           HB       VAL  39 -12.814   4.301   3.440
  300   1HG1  VAL  39          1HG1      VAL  39 -13.035   6.270   4.600
  301   2HG1  VAL  39          2HG1      VAL  39 -13.373   6.830   2.963
  302   3HG1  VAL  39          3HG1      VAL  39 -11.778   7.084   3.669
  303   1HG2  VAL  39          1HG2      VAL  39 -12.871   5.871   1.209
  304   2HG2  VAL  39          2HG2      VAL  39 -12.680   4.117   1.217
  305   3HG2  VAL  39          3HG2      VAL  39 -11.259   5.161   1.122
  306    H    ASP  40           H        ASP  40 -11.802   3.265   5.358
  307    HA   ASP  40           HA       ASP  40 -11.275   5.146   7.480
  308   1HB   ASP  40          2HB       ASP  40 -12.735   2.505   7.480
  309   2HB   ASP  40          1HB       ASP  40 -12.636   3.602   8.854
  310    H    GLY  41           H        GLY  41  -8.981   3.567   6.318
  311   1HA   GLY  41          2HA       GLY  41  -8.191   1.621   8.219
  312   2HA   GLY  41          1HA       GLY  41  -7.117   2.466   7.113
  313    H    GLU  42           H        GLU  42  -6.732   1.745   9.957
  314    HA   GLU  42           HA       GLU  42  -6.844   4.211  11.444
  315   1HB   GLU  42          2HB       GLU  42  -5.409   1.617  12.055
  316   2HB   GLU  42          1HB       GLU  42  -5.610   2.954  13.177
  317   1HG   GLU  42          2HG       GLU  42  -8.033   2.656  13.104
  318   2HG   GLU  42          1HG       GLU  42  -7.830   1.311  11.981
  319    H    TRP  43           H        TRP  43  -5.636   5.724  10.285
  320    HA   TRP  43           HA       TRP  43  -2.817   5.103   9.781
  321   1HB   TRP  43          2HB       TRP  43  -4.467   7.464   8.878
  322   2HB   TRP  43          1HB       TRP  43  -2.812   7.121   8.397
  323    HD1  TRP  43           HD       TRP  43  -5.267   4.212   8.448
  324    HE1  TRP  43           1HE      TRP  43  -5.784   3.517   6.027
  325    HE3  TRP  43           3HE      TRP  43  -2.954   8.049   6.019
  326    HZ2  TRP  43           2HZ      TRP  43  -5.254   4.470   3.426
  327    HZ3  TRP  43           3HZ      TRP  43  -2.995   8.084   3.565
  328    HH2  TRP  43           HH       TRP  43  -4.120   6.330   2.294
  329    H    THR  44           H        THR  44  -1.258   5.859  11.046
  330    HA   THR  44           HA       THR  44  -1.852   8.124  12.829
  331    HB   THR  44           HB       THR  44   0.056   7.305  14.199
  332    HG1  THR  44           1HG      THR  44   1.050   6.166  12.386
  333   1HG2  THR  44          1HG2      THR  44  -1.746   4.957  13.815
  334   2HG2  THR  44          2HG2      THR  44  -2.355   6.462  14.502
  335   3HG2  THR  44          3HG2      THR  44  -1.040   5.599  15.298
  336    H    TYR  45           H        TYR  45  -0.508   9.929  12.772
  337    HA   TYR  45           HA       TYR  45   1.466   9.925  10.585
  338   1HB   TYR  45          2HB       TYR  45  -0.457  11.397  10.189
  339   2HB   TYR  45          1HB       TYR  45  -0.127  12.244  11.698
  340    HD1  TYR  45           1HD      TYR  45   2.338  11.118   9.157
  341    HD2  TYR  45           2HD      TYR  45   0.339  14.419  10.943
  342    HE1  TYR  45           1HE      TYR  45   3.825  12.662   7.952
  343    HE2  TYR  45           2HE      TYR  45   1.818  15.972   9.742
  344    HH   TYR  45           HH       TYR  45   3.961  16.018   8.672
  345    H    ASP  46           H        ASP  46   3.480  10.738  10.878
  346    HA   ASP  46           HA       ASP  46   4.192  11.638  13.590
  347   1HB   ASP  46          2HB       ASP  46   5.018   9.352  13.209
  348   2HB   ASP  46          1HB       ASP  46   5.843   9.887  11.749
  349    H    ASP  47           H        ASP  47   3.933  13.808  12.816
  350    HA   ASP  47           HA       ASP  47   5.040  14.966  10.590
  351   1HB   ASP  47          2HB       ASP  47   4.823  16.178  13.354
  352   2HB   ASP  47          1HB       ASP  47   5.063  17.085  11.863
  353    H    ALA  48           H        ALA  48   6.639  14.169  13.623
  354    HA   ALA  48           HA       ALA  48   9.019  15.550  13.321
  355   1HB   ALA  48          1HB       ALA  48   8.037  13.809  15.154
  356   2HB   ALA  48          2HB       ALA  48   9.695  14.412  15.133
  357   3HB   ALA  48          3HB       ALA  48   9.318  12.844  14.417
  358    H    THR  49           H        THR  49   7.971  12.581  11.778
  359    HA   THR  49           HA       THR  49  10.546  12.470  10.351
  360    HB   THR  49           HB       THR  49  10.076  10.076   9.974
  361    HG1  THR  49           1HG      THR  49   7.806  10.162  10.137
  362   1HG2  THR  49          1HG2      THR  49  10.502  11.229  12.616
  363   2HG2  THR  49          2HG2      THR  49  11.356   9.925  11.788
  364   3HG2  THR  49          3HG2      THR  49   9.851   9.589  12.645
  365    H    LYS  50           H        LYS  50   7.628  13.678   9.881
  366    HA   LYS  50           HA       LYS  50   6.242  14.051   8.077
  367   1HB   LYS  50          2HB       LYS  50   8.904  13.640   6.702
  368   2HB   LYS  50          1HB       LYS  50   7.472  14.257   5.892
  369   1HG   LYS  50          2HG       LYS  50   8.659  15.581   8.312
  370   2HG   LYS  50          1HG       LYS  50   9.162  15.965   6.664
  371   1HD   LYS  50          2HD       LYS  50   6.343  16.175   7.725
  372   2HD   LYS  50          1HD       LYS  50   7.456  17.527   7.512
  373   1HE   LYS  50          2HE       LYS  50   6.369  15.730   5.350
  374   2HE   LYS  50          1HE       LYS  50   5.931  17.412   5.635
  375   1HZ   LYS  50          1HZ       LYS  50   7.526  17.896   4.188
  376   2HZ   LYS  50          2HZ       LYS  50   8.172  16.333   4.226
  377   3HZ   LYS  50          3HZ       LYS  50   8.642  17.470   5.386
  378    H    THR  51           H        THR  51   6.398  11.303   9.014
  379    HA   THR  51           HA       THR  51   5.765   9.919   6.495
  380    HB   THR  51           HB       THR  51   7.040   8.733   8.965
  381    HG1  THR  51           1HG      THR  51   8.820   8.458   7.545
  382   1HG2  THR  51          1HG2      THR  51   5.564   7.150   7.737
  383   2HG2  THR  51          2HG2      THR  51   7.264   6.688   7.776
  384   3HG2  THR  51          3HG2      THR  51   6.576   7.395   6.314
  385    H    PHE  52           H        PHE  52   4.150   8.313   6.569
  386    HA   PHE  52           HA       PHE  52   2.295   8.522   8.855
  387   1HB   PHE  52          2HB       PHE  52   1.540   8.100   5.952
  388   2HB   PHE  52          1HB       PHE  52   0.434   8.297   7.306
  389    HD1  PHE  52           1HD      PHE  52  -0.575  10.338   7.503
  390    HD2  PHE  52           2HD      PHE  52   3.305  10.129   5.767
  391    HE1  PHE  52           1HE      PHE  52  -0.632  12.764   7.090
  392    HE2  PHE  52           2HE      PHE  52   3.258  12.552   5.358
  393    HZ   PHE  52           HZ       PHE  52   1.288  13.874   6.020
  394    H    THR  53           H        THR  53   1.328   6.594   9.546
  395    HA   THR  53           HA       THR  53   2.283   4.160   8.211
  396    HB   THR  53           HB       THR  53   2.061   3.145  10.598
  397    HG1  THR  53           1HG      THR  53   2.640   5.825  11.279
  398   1HG2  THR  53          1HG2      THR  53   4.401   4.092  11.177
  399   2HG2  THR  53          2HG2      THR  53   4.313   4.792   9.560
  400   3HG2  THR  53          3HG2      THR  53   4.194   3.043   9.773
  401    H    VAL  54           H        VAL  54   0.820   2.753   7.602
  402    HA   VAL  54           HA       VAL  54  -1.957   3.133   8.496
  403    HB   VAL  54           HB       VAL  54  -0.932   1.653   6.055
  404   1HG1  VAL  54          1HG1      VAL  54  -3.307   1.258   7.343
  405   2HG1  VAL  54          2HG1      VAL  54  -3.025   0.972   5.627
  406   3HG1  VAL  54          3HG1      VAL  54  -3.737   2.493   6.160
  407   1HG2  VAL  54          1HG2      VAL  54  -1.591   3.504   4.747
  408   2HG2  VAL  54          2HG2      VAL  54  -0.653   4.170   6.085
  409   3HG2  VAL  54          3HG2      VAL  54  -2.414   4.270   6.107
  410    H    THR  55           H        THR  55  -2.285   1.880  10.242
  411    HA   THR  55           HA       THR  55  -1.103  -0.781  10.330
  412    HB   THR  55           HB       THR  55  -2.654   0.648  12.485
  413    HG1  THR  55           1HG      THR  55   0.131   0.504  11.976
  414   1HG2  THR  55          1HG2      THR  55  -2.591  -1.663  12.991
  415   2HG2  THR  55          2HG2      THR  55  -1.346  -0.886  13.969
  416   3HG2  THR  55          3HG2      THR  55  -0.895  -1.786  12.518
  417    H    GLU  56           H        GLU  56  -2.198  -2.387   9.463
  418    HA   GLU  56           HA       GLU  56  -4.838  -2.437   8.698
  419   1HB   GLU  56          2HB       GLU  56  -3.244  -4.084   7.921
  420   2HB   GLU  56          1HB       GLU  56  -3.054  -4.723   9.548
  421   1HG   GLU  56          2HG       GLU  56  -4.441  -6.169   8.166
  422   2HG   GLU  56          1HG       GLU  56  -5.346  -5.516   9.530
  423   1H    MET   1          1HT       MET   1   7.073  18.435  -3.636
  424   2H    MET   1          2HT       MET   1   6.444  19.579  -2.560
  425   3H    MET   1          3HT       MET   1   5.585  18.157  -2.878
  426    HA   MET   1           HA       MET   1   8.297  18.044  -1.742
  427   1HB   MET   1          2HB       MET   1   6.980  19.581  -0.347
  428   2HB   MET   1          1HB       MET   1   5.702  18.379  -0.221
  429   1HG   MET   1          2HG       MET   1   7.038  18.424   1.794
  430   2HG   MET   1          1HG       MET   1   7.224  16.881   0.961
  431   1HE   MET   1          1HE       MET   1   9.212  16.454   2.560
  432   2HE   MET   1          2HE       MET   1   9.323  18.060   3.281
  433   3HE   MET   1          3HE       MET   1  10.745  17.326   2.537
  434    H    GLN   2           H        GLN   2   8.754  16.021  -0.847
  435    HA   GLN   2           HA       GLN   2   6.906  13.886  -1.674
  436   1HB   GLN   2          2HB       GLN   2   9.163  13.865  -2.699
  437   2HB   GLN   2          1HB       GLN   2   9.871  13.727  -1.095
  438   1HG   GLN   2          2HG       GLN   2   9.850  11.568  -2.092
  439   2HG   GLN   2          1HG       GLN   2   8.649  11.589  -0.802
  440   1HE2  GLN   2          1HE2      GLN   2   6.803  10.662  -1.297
  441   2HE2  GLN   2          2HE2      GLN   2   6.119  10.524  -2.878
  442    H    TYR   3           H        TYR   3   6.214  12.351  -0.218
  443    HA   TYR   3           HA       TYR   3   7.162  12.645   2.554
  444   1HB   TYR   3          2HB       TYR   3   4.312  12.236   1.633
  445   2HB   TYR   3          1HB       TYR   3   4.841  12.151   3.310
  446    HD1  TYR   3           1HD      TYR   3   4.619  14.050   4.608
  447    HD2  TYR   3           2HD      TYR   3   5.007  14.481   0.391
  448    HE1  TYR   3           1HE      TYR   3   4.289  16.476   4.830
  449    HE2  TYR   3           2HE      TYR   3   4.683  16.909   0.605
  450    HH   TYR   3           HH       TYR   3   4.959  18.659   2.349
  451    H    LYS   4           H        LYS   4   7.067  10.767   3.860
  452    HA   LYS   4           HA       LYS   4   7.270   8.296   2.299
  453   1HB   LYS   4          2HB       LYS   4   9.196   8.875   3.693
  454   2HB   LYS   4          1HB       LYS   4   8.168   8.937   5.115
  455   1HG   LYS   4          2HG       LYS   4   9.384   6.870   5.104
  456   2HG   LYS   4          1HG       LYS   4   7.675   6.535   4.825
  457   1HD   LYS   4          2HD       LYS   4   9.054   5.196   3.339
  458   2HD   LYS   4          1HD       LYS   4   8.118   6.372   2.413
  459   1HE   LYS   4          2HE       LYS   4  10.058   7.822   2.248
  460   2HE   LYS   4          1HE       LYS   4  10.998   6.710   3.242
  461   1HZ   LYS   4          1HZ       LYS   4  11.374   5.371   1.511
  462   2HZ   LYS   4          2HZ       LYS   4  10.928   6.690   0.551
  463   3HZ   LYS   4          3HZ       LYS   4   9.792   5.491   0.922
  464    H    VAL   5           H        VAL   5   5.807   6.731   2.454
  465    HA   VAL   5           HA       VAL   5   3.838   6.877   4.640
  466    HB   VAL   5           HB       VAL   5   3.358   5.888   1.825
  467   1HG1  VAL   5          1HG1      VAL   5   2.044   5.129   4.106
  468   2HG1  VAL   5          2HG1      VAL   5   1.371   5.085   2.479
  469   3HG1  VAL   5          3HG1      VAL   5   1.054   6.467   3.528
  470   1HG2  VAL   5          1HG2      VAL   5   1.662   8.030   2.391
  471   2HG2  VAL   5          2HG2      VAL   5   3.045   8.024   1.296
  472   3HG2  VAL   5          3HG2      VAL   5   3.251   8.529   2.973
  473    H    ILE   6           H        ILE   6   3.979   5.239   5.989
  474    HA   ILE   6           HA       ILE   6   5.221   2.739   5.095
  475    HB   ILE   6           HB       ILE   6   4.773   3.858   7.860
  476   1HG1  ILE   6          2HG1      ILE   6   7.291   3.336   6.266
  477   2HG1  ILE   6          1HG1      ILE   6   6.595   4.917   6.614
  478   1HG2  ILE   6          1HG2      ILE   6   5.846   1.192   6.989
  479   2HG2  ILE   6          2HG2      ILE   6   4.522   1.532   8.103
  480   3HG2  ILE   6          3HG2      ILE   6   6.183   1.888   8.575
  481   1HD1  ILE   6          1HD1      ILE   6   8.029   4.940   8.319
  482   2HD1  ILE   6          2HD1      ILE   6   8.274   3.195   8.262
  483   3HD1  ILE   6          3HD1      ILE   6   6.880   3.863   9.111
  484    H    LEU   7           H        LEU   7   4.001   0.987   4.775
  485    HA   LEU   7           HA       LEU   7   1.268   0.980   5.854
  486   1HB   LEU   7          2HB       LEU   7   2.315  -0.798   3.664
  487   2HB   LEU   7          1HB       LEU   7   0.648  -0.406   4.038
  488    HG   LEU   7           HG       LEU   7   2.682   1.475   2.857
  489   1HD1  LEU   7          1HD1      LEU   7   1.675  -0.382   1.425
  490   2HD1  LEU   7          2HD1      LEU   7   1.535   1.272   0.831
  491   3HD1  LEU   7          3HD1      LEU   7   0.149   0.487   1.590
  492   1HD2  LEU   7          1HD2      LEU   7  -0.246   2.007   3.260
  493   2HD2  LEU   7          2HD2      LEU   7   1.036   3.147   2.849
  494   3HD2  LEU   7          3HD2      LEU   7   0.962   2.449   4.466
  495    H    ASN   8           H        ASN   8   1.588   0.104   7.880
  496    HA   ASN   8           HA       ASN   8   2.943  -2.495   8.042
  497   1HB   ASN   8          2HB       ASN   8   2.173  -0.555  10.224
  498   2HB   ASN   8          1HB       ASN   8   2.923  -2.122  10.505
  499   1HD2  ASN   8          1HD2      ASN   8   3.611   0.953  10.596
  500   2HD2  ASN   8          2HD2      ASN   8   5.244   0.963  10.038
  501    H    GLY   9           H        GLY   9   1.604  -4.175   7.754
  502   1HA   GLY   9          2HA       GLY   9  -1.029  -4.057   9.096
  503   2HA   GLY   9          1HA       GLY   9  -0.737  -4.939   7.605
  504    H    LYS  10           H        LYS  10  -1.744  -6.686   8.887
  505    HA   LYS  10           HA       LYS  10  -0.232  -7.835  11.041
  506   1HB   LYS  10          2HB       LYS  10  -2.535  -8.971   9.445
  507   2HB   LYS  10          1HB       LYS  10  -1.885  -9.657  10.927
  508   1HG   LYS  10          2HG       LYS  10  -3.197  -6.961  10.661
  509   2HG   LYS  10          1HG       LYS  10  -3.931  -8.413  11.345
  510   1HD   LYS  10          2HD       LYS  10  -2.223  -8.449  13.098
  511   2HD   LYS  10          1HD       LYS  10  -1.491  -6.995  12.414
  512   1HE   LYS  10          2HE       LYS  10  -2.907  -6.457  14.330
  513   2HE   LYS  10          1HE       LYS  10  -3.542  -5.748  12.845
  514   1HZ   LYS  10          1HZ       LYS  10  -4.556  -8.383  13.538
  515   2HZ   LYS  10          2HZ       LYS  10  -5.368  -7.040  12.905
  516   3HZ   LYS  10          3HZ       LYS  10  -5.029  -7.119  14.560
  517    H    THR  11           H        THR  11  -1.067  -8.989   7.767
  518    HA   THR  11           HA       THR  11   1.238 -10.790   7.860
  519    HB   THR  11           HB       THR  11  -0.012 -11.775   5.823
  520    HG1  THR  11           1HG      THR  11  -2.328 -11.325   6.058
  521   1HG2  THR  11          1HG2      THR  11  -0.594 -13.352   7.254
  522   2HG2  THR  11          2HG2      THR  11  -1.918 -12.345   7.837
  523   3HG2  THR  11          3HG2      THR  11  -0.328 -12.232   8.591
  524    H    LEU  12           H        LEU  12   0.724  -7.770   6.887
  525    HA   LEU  12           HA       LEU  12   2.494  -8.085   4.577
  526   1HB   LEU  12          2HB       LEU  12   0.245  -7.802   3.710
  527   2HB   LEU  12          1HB       LEU  12   0.027  -6.356   4.674
  528    HG   LEU  12           HG       LEU  12   1.620  -5.152   3.348
  529   1HD1  LEU  12          1HD1      LEU  12   2.289  -6.793   1.227
  530   2HD1  LEU  12          2HD1      LEU  12   2.473  -7.821   2.645
  531   3HD1  LEU  12          3HD1      LEU  12   3.348  -6.301   2.550
  532   1HD2  LEU  12          1HD2      LEU  12   0.365  -6.334   1.042
  533   2HD2  LEU  12          2HD2      LEU  12   0.098  -4.755   1.780
  534   3HD2  LEU  12          3HD2      LEU  12  -0.787  -6.164   2.367
  535    H    LYS  13           H        LYS  13   4.114  -6.674   4.444
  536    HA   LYS  13           HA       LYS  13   4.099  -4.263   6.127
  537   1HB   LYS  13          2HB       LYS  13   6.420  -6.200   5.984
  538   2HB   LYS  13          1HB       LYS  13   6.357  -4.713   6.918
  539   1HG   LYS  13          2HG       LYS  13   4.601  -7.115   7.378
  540   2HG   LYS  13          1HG       LYS  13   6.061  -6.730   8.290
  541   1HD   LYS  13          2HD       LYS  13   5.037  -4.607   8.996
  542   2HD   LYS  13          1HD       LYS  13   3.565  -5.044   8.124
  543   1HE   LYS  13          2HE       LYS  13   4.785  -6.493  10.471
  544   2HE   LYS  13          1HE       LYS  13   3.289  -5.559  10.464
  545   1HZ   LYS  13          1HZ       LYS  13   2.390  -7.584  10.158
  546   2HZ   LYS  13          2HZ       LYS  13   3.797  -8.250   9.497
  547   3HZ   LYS  13          3HZ       LYS  13   2.776  -7.308   8.534
  548    H    GLY  14           H        GLY  14   5.095  -2.502   5.157
  549   1HA   GLY  14          2HA       GLY  14   7.053  -2.761   3.117
  550   2HA   GLY  14          1HA       GLY  14   5.475  -2.493   2.402
  551    H    GLU  15           H        GLU  15   6.962  -0.646   1.643
  552    HA   GLU  15           HA       GLU  15   6.265   1.691   3.244
  553   1HB   GLU  15          2HB       GLU  15   9.052   1.181   2.183
  554   2HB   GLU  15          1HB       GLU  15   8.507   2.673   2.935
  555   1HG   GLU  15          2HG       GLU  15   8.102   1.480   5.024
  556   2HG   GLU  15          1HG       GLU  15   8.642  -0.021   4.272
  557    H    THR  16           H        THR  16   5.810   3.495   2.053
  558    HA   THR  16           HA       THR  16   6.293   3.442  -0.825
  559    HB   THR  16           HB       THR  16   4.158   2.553  -0.915
  560    HG1  THR  16           1HG      THR  16   3.578   5.299  -0.755
  561   1HG2  THR  16          1HG2      THR  16   3.269   2.384   1.170
  562   2HG2  THR  16          2HG2      THR  16   2.275   3.684   0.512
  563   3HG2  THR  16          3HG2      THR  16   3.625   4.062   1.579
  564    H    THR  17           H        THR  17   5.602   5.613  -1.841
  565    HA   THR  17           HA       THR  17   5.804   7.831   0.054
  566    HB   THR  17           HB       THR  17   7.617   8.880  -1.262
  567    HG1  THR  17           1HG      THR  17   7.641   6.379  -2.590
  568   1HG2  THR  17          1HG2      THR  17   8.234   6.172  -0.125
  569   2HG2  THR  17          2HG2      THR  17   8.333   7.734   0.688
  570   3HG2  THR  17          3HG2      THR  17   9.458   7.345  -0.614
  571    H    THR  18           H        THR  18   4.382   9.338  -0.411
  572    HA   THR  18           HA       THR  18   3.370   9.611  -3.178
  573    HB   THR  18           HB       THR  18   1.675   8.983  -1.482
  574    HG1  THR  18           1HG      THR  18   1.165  10.382  -3.275
  575   1HG2  THR  18          1HG2      THR  18   0.975  11.020   0.002
  576   2HG2  THR  18          2HG2      THR  18   2.695  11.403  -0.094
  577   3HG2  THR  18          3HG2      THR  18   2.172   9.853   0.565
  578    H    GLU  19           H        GLU  19   3.216  11.675  -4.090
  579    HA   GLU  19           HA       GLU  19   4.824  13.738  -2.737
  580   1HB   GLU  19          2HB       GLU  19   5.621  12.914  -4.956
  581   2HB   GLU  19          1HB       GLU  19   4.131  13.508  -5.674
  582   1HG   GLU  19          2HG       GLU  19   6.136  15.239  -4.245
  583   2HG   GLU  19          1HG       GLU  19   6.083  14.999  -5.991
  584    H    ALA  20           H        ALA  20   3.683  15.346  -1.814
  585    HA   ALA  20           HA       ALA  20   1.406  16.453  -3.243
  586   1HB   ALA  20          1HB       ALA  20   0.903  15.919  -0.375
  587   2HB   ALA  20          2HB       ALA  20   0.817  14.552  -1.487
  588   3HB   ALA  20          3HB       ALA  20  -0.216  15.958  -1.739
  589    H    VAL  21           H        VAL  21   0.852  18.530  -2.651
  590    HA   VAL  21           HA       VAL  21   2.856  20.294  -2.010
  591    HB   VAL  21           HB       VAL  21  -0.061  20.800  -1.427
  592   1HG1  VAL  21          1HG1      VAL  21   1.651  22.903  -2.562
  593   2HG1  VAL  21          2HG1      VAL  21   2.050  22.409  -0.916
  594   3HG1  VAL  21          3HG1      VAL  21   0.428  22.990  -1.295
  595   1HG2  VAL  21          1HG2      VAL  21   0.107  21.776  -3.845
  596   2HG2  VAL  21          2HG2      VAL  21  -0.191  20.055  -3.600
  597   3HG2  VAL  21          3HG2      VAL  21   1.430  20.619  -4.006
  598    H    ASP  22           H        ASP  22   0.597  18.739   0.197
  599    HA   ASP  22           HA       ASP  22   2.312  19.516   2.420
  600   1HB   ASP  22          2HB       ASP  22   0.482  20.349   3.796
  601   2HB   ASP  22          1HB       ASP  22   0.619  21.298   2.319
  602    H    ALA  23           H        ALA  23   1.453  18.472   4.532
  603    HA   ALA  23           HA       ALA  23   1.509  15.711   4.201
  604   1HB   ALA  23          1HB       ALA  23   2.234  16.515   6.272
  605   2HB   ALA  23          2HB       ALA  23   0.717  15.693   6.636
  606   3HB   ALA  23          3HB       ALA  23   0.762  17.453   6.524
  607    H    ALA  24           H        ALA  24  -1.250  17.854   4.762
  608    HA   ALA  24           HA       ALA  24  -3.185  15.820   5.019
  609   1HB   ALA  24          1HB       ALA  24  -3.242  18.517   5.285
  610   2HB   ALA  24          2HB       ALA  24  -4.683  17.505   5.178
  611   3HB   ALA  24          3HB       ALA  24  -4.073  18.323   3.741
  612    H    THR  25           H        THR  25  -2.313  17.816   2.187
  613    HA   THR  25           HA       THR  25  -3.922  16.572   0.311
  614    HB   THR  25           HB       THR  25  -2.246  17.341  -1.349
  615    HG1  THR  25           1HG      THR  25  -0.287  17.704  -0.797
  616   1HG2  THR  25          1HG2      THR  25  -3.717  19.058  -0.782
  617   2HG2  THR  25          2HG2      THR  25  -2.108  19.764  -0.615
  618   3HG2  THR  25          3HG2      THR  25  -3.001  19.254   0.819
  619    H    ALA  26           H        ALA  26  -0.653  15.772   1.405
  620    HA   ALA  26           HA       ALA  26  -0.227  13.539  -0.245
  621   1HB   ALA  26          1HB       ALA  26   1.243  12.832   1.828
  622   2HB   ALA  26          2HB       ALA  26   0.901  14.481   2.351
  623   3HB   ALA  26          3HB       ALA  26   1.709  14.195   0.809
  624    H    GLU  27           H        GLU  27  -1.425  13.742   3.119
  625    HA   GLU  27           HA       GLU  27  -1.984  11.106   3.591
  626   1HB   GLU  27          2HB       GLU  27  -2.217  12.867   5.276
  627   2HB   GLU  27          1HB       GLU  27  -3.616  13.507   4.424
  628   1HG   GLU  27          2HG       GLU  27  -4.835  11.441   4.860
  629   2HG   GLU  27          1HG       GLU  27  -3.432  10.788   5.702
  630    H    LYS  28           H        LYS  28  -4.076  13.523   2.047
  631    HA   LYS  28           HA       LYS  28  -6.255  11.810   1.553
  632   1HB   LYS  28          2HB       LYS  28  -5.366  14.274   0.039
  633   2HB   LYS  28          1HB       LYS  28  -6.938  13.501  -0.124
  634   1HG   LYS  28          2HG       LYS  28  -5.830  14.832   2.337
  635   2HG   LYS  28          1HG       LYS  28  -7.132  15.422   1.304
  636   1HD   LYS  28          2HD       LYS  28  -8.486  13.473   1.896
  637   2HD   LYS  28          1HD       LYS  28  -7.182  12.879   2.925
  638   1HE   LYS  28          2HE       LYS  28  -8.897  13.996   4.249
  639   2HE   LYS  28          1HE       LYS  28  -7.371  14.875   4.323
  640   1HZ   LYS  28          1HZ       LYS  28  -8.229  16.633   3.233
  641   2HZ   LYS  28          2HZ       LYS  28  -9.700  16.039   3.821
  642   3HZ   LYS  28          3HZ       LYS  28  -9.222  15.695   2.236
  643    H    VAL  29           H        VAL  29  -3.485  12.751  -0.449
  644    HA   VAL  29           HA       VAL  29  -4.137  11.359  -2.762
  645    HB   VAL  29           HB       VAL  29  -1.390  11.850  -1.595
  646   1HG1  VAL  29          1HG1      VAL  29  -0.894  10.313  -3.209
  647   2HG1  VAL  29          2HG1      VAL  29  -0.895  11.781  -4.187
  648   3HG1  VAL  29          3HG1      VAL  29  -2.304  10.719  -4.186
  649   1HG2  VAL  29          1HG2      VAL  29  -1.480  13.949  -2.369
  650   2HG2  VAL  29          2HG2      VAL  29  -3.226  13.712  -2.398
  651   3HG2  VAL  29          3HG2      VAL  29  -2.279  13.464  -3.865
  652    H    VAL  30           H        VAL  30  -2.437  10.279   0.137
  653    HA   VAL  30           HA       VAL  30  -1.879   7.660  -0.798
  654    HB   VAL  30           HB       VAL  30  -2.212   8.634   2.049
  655   1HG1  VAL  30          1HG1      VAL  30  -0.432   6.369   1.402
  656   2HG1  VAL  30          2HG1      VAL  30  -2.163   6.054   1.304
  657   3HG1  VAL  30          3HG1      VAL  30  -1.457   6.639   2.810
  658   1HG2  VAL  30          1HG2      VAL  30   0.444   8.168   0.806
  659   2HG2  VAL  30          2HG2      VAL  30  -0.031   9.302   2.069
  660   3HG2  VAL  30          3HG2      VAL  30  -0.425   9.644   0.385
  661    H    LYS  31           H        LYS  31  -4.478   9.015   1.265
  662    HA   LYS  31           HA       LYS  31  -5.906   6.678   1.686
  663   1HB   LYS  31          2HB       LYS  31  -6.882   9.515   1.421
  664   2HB   LYS  31          1HB       LYS  31  -7.931   8.181   1.883
  665   1HG   LYS  31          2HG       LYS  31  -6.384   7.732   3.787
  666   2HG   LYS  31          1HG       LYS  31  -5.540   9.225   3.374
  667   1HD   LYS  31          2HD       LYS  31  -7.087   9.733   5.116
  668   2HD   LYS  31          1HD       LYS  31  -7.731  10.420   3.622
  669   1HE   LYS  31          2HE       LYS  31  -9.218   8.502   3.374
  670   2HE   LYS  31          1HE       LYS  31  -8.556   7.785   4.844
  671   1HZ   LYS  31          1HZ       LYS  31  -9.594  10.487   5.105
  672   2HZ   LYS  31          2HZ       LYS  31  -9.735   9.167   6.151
  673   3HZ   LYS  31          3HZ       LYS  31 -10.747   9.287   4.803
  674    H    GLN  32           H        GLN  32  -6.079   8.942  -1.028
  675    HA   GLN  32           HA       GLN  32  -8.196   7.667  -2.388
  676   1HB   GLN  32          2HB       GLN  32  -7.352   9.931  -2.960
  677   2HB   GLN  32          1HB       GLN  32  -5.869   9.208  -3.565
  678   1HG   GLN  32          2HG       GLN  32  -7.296   9.746  -5.409
  679   2HG   GLN  32          1HG       GLN  32  -7.174   7.996  -5.259
  680   1HE2  GLN  32          1HE2      GLN  32  -9.150   9.272  -2.834
  681   2HE2  GLN  32          2HE2      GLN  32 -10.675   8.971  -3.581
  682    H    PHE  33           H        PHE  33  -4.741   7.161  -2.320
  683    HA   PHE  33           HA       PHE  33  -4.362   5.380  -4.404
  684   1HB   PHE  33          2HB       PHE  33  -2.624   6.431  -2.900
  685   2HB   PHE  33          1HB       PHE  33  -3.050   5.244  -1.676
  686    HD1  PHE  33           1HD      PHE  33  -1.809   5.544  -5.159
  687    HD2  PHE  33           2HD      PHE  33  -1.956   3.203  -1.600
  688    HE1  PHE  33           1HE      PHE  33  -0.150   3.989  -6.102
  689    HE2  PHE  33           2HE      PHE  33  -0.299   1.652  -2.551
  690    HZ   PHE  33           HZ       PHE  33   0.604   2.054  -4.808
  691    H    PHE  34           H        PHE  34  -4.774   4.494  -1.007
  692    HA   PHE  34           HA       PHE  34  -5.376   1.758  -1.516
  693   1HB   PHE  34          2HB       PHE  34  -5.898   3.383   0.974
  694   2HB   PHE  34          1HB       PHE  34  -5.865   1.620   0.866
  695    HD1  PHE  34           1HD      PHE  34  -3.638   0.870  -0.579
  696    HD2  PHE  34           2HD      PHE  34  -4.025   4.231   1.984
  697    HE1  PHE  34           1HE      PHE  34  -1.201   0.907  -0.273
  698    HE2  PHE  34           2HE      PHE  34  -1.588   4.272   2.311
  699    HZ   PHE  34           HZ       PHE  34  -0.179   2.608   1.164
  700    H    ASN  35           H        ASN  35  -7.368   4.586  -0.896
  701    HA   ASN  35           HA       ASN  35  -9.871   3.445  -0.577
  702   1HB   ASN  35          2HB       ASN  35  -9.403   5.858  -0.394
  703   2HB   ASN  35          1HB       ASN  35  -9.127   5.941  -2.129
  704   1HD2  ASN  35          1HD2      ASN  35 -11.157   6.941  -0.013
  705   2HD2  ASN  35          2HD2      ASN  35 -12.671   6.745  -0.824
  706    H    ASP  36           H        ASP  36  -8.007   4.082  -3.459
  707    HA   ASP  36           HA       ASP  36 -10.061   2.951  -5.197
  708   1HB   ASP  36          2HB       ASP  36  -7.456   4.331  -5.840
  709   2HB   ASP  36          1HB       ASP  36  -8.575   3.709  -7.048
  710    H    ASN  37           H        ASN  37  -6.968   2.055  -3.835
  711    HA   ASN  37           HA       ASN  37  -6.477  -0.050  -5.746
  712   1HB   ASN  37          2HB       ASN  37  -5.245   0.516  -3.039
  713   2HB   ASN  37          1HB       ASN  37  -4.738  -0.799  -4.091
  714   1HD2  ASN  37          1HD2      ASN  37  -3.502   1.798  -3.048
  715   2HD2  ASN  37          2HD2      ASN  37  -2.818   2.503  -4.471
  716    H    GLY  38           H        GLY  38  -7.820   0.264  -2.553
  717   1HA   GLY  38          2HA       GLY  38  -8.249  -1.772  -1.183
  718   2HA   GLY  38          1HA       GLY  38  -9.698  -1.089  -1.886
  719    H    VAL  39           H        VAL  39 -11.005  -2.487  -2.762
  720    HA   VAL  39           HA       VAL  39 -10.169  -5.194  -3.144
  721    HB   VAL  39           HB       VAL  39 -12.865  -3.937  -3.532
  722   1HG1  VAL  39          1HG1      VAL  39 -13.118  -5.899  -4.695
  723   2HG1  VAL  39          2HG1      VAL  39 -13.492  -6.451  -3.064
  724   3HG1  VAL  39          3HG1      VAL  39 -11.894  -6.744  -3.748
  725   1HG2  VAL  39          1HG2      VAL  39 -12.993  -5.504  -1.303
  726   2HG2  VAL  39          2HG2      VAL  39 -12.758  -3.756  -1.307
  727   3HG2  VAL  39          3HG2      VAL  39 -11.365  -4.833  -1.192
  728    H    ASP  40           H        ASP  40 -11.801  -2.925  -5.437
  729    HA   ASP  40           HA       ASP  40 -11.290  -4.819  -7.551
  730   1HB   ASP  40          2HB       ASP  40 -12.684  -2.144  -7.569
  731   2HB   ASP  40          1HB       ASP  40 -12.594  -3.243  -8.943
  732    H    GLY  41           H        GLY  41  -8.975  -3.295  -6.355
  733   1HA   GLY  41          2HA       GLY  41  -8.111  -1.370  -8.245
  734   2HA   GLY  41          1HA       GLY  41  -7.074  -2.241  -7.122
  735    H    GLU  42           H        GLU  42  -6.631  -1.529  -9.961
  736    HA   GLU  42           HA       GLU  42  -6.782  -3.993 -11.451
  737   1HB   GLU  42          2HB       GLU  42  -5.276  -1.434 -12.041
  738   2HB   GLU  42          1HB       GLU  42  -5.493  -2.767 -13.166
  739   1HG   GLU  42          2HG       GLU  42  -7.908  -2.409 -13.127
  740   2HG   GLU  42          1HG       GLU  42  -7.689  -1.071 -12.000
  741    H    TRP  43           H        TRP  43  -5.628  -5.534 -10.275
  742    HA   TRP  43           HA       TRP  43  -2.802  -4.982  -9.732
  743   1HB   TRP  43          2HB       TRP  43  -4.521  -7.304  -8.852
  744   2HB   TRP  43          1HB       TRP  43  -2.866  -6.999  -8.347
  745    HD1  TRP  43           HD       TRP  43  -5.248  -4.031  -8.434
  746    HE1  TRP  43           1HE      TRP  43  -5.782  -3.324  -6.019
  747    HE3  TRP  43           3HE      TRP  43  -3.063  -7.923  -5.973
  748    HZ2  TRP  43           2HZ      TRP  43  -5.312  -4.288  -3.412
  749    HZ3  TRP  43           3HZ      TRP  43  -3.140  -7.957  -3.520
  750    HH2  TRP  43           HH       TRP  43  -4.239  -6.176  -2.264
  751    H    THR  44           H        THR  44  -1.242  -5.776 -10.974
  752    HA   THR  44           HA       THR  44  -1.868  -8.026 -12.767
  753    HB   THR  44           HB       THR  44   0.079  -7.254 -14.108
  754    HG1  THR  44           1HG      THR  44   1.075  -6.140 -12.281
  755   1HG2  THR  44          1HG2      THR  44  -1.670  -4.862 -13.750
  756   2HG2  THR  44          2HG2      THR  44  -2.307  -6.353 -14.446
  757   3HG2  THR  44          3HG2      THR  44  -0.958  -5.522 -15.222
  758    H    TYR  45           H        TYR  45  -0.569  -9.863 -12.689
  759    HA   TYR  45           HA       TYR  45   1.374  -9.907 -10.476
  760   1HB   TYR  45          2HB       TYR  45  -0.590 -11.331 -10.108
  761   2HB   TYR  45          1HB       TYR  45  -0.258 -12.186 -11.610
  762    HD1  TYR  45           1HD      TYR  45   2.197 -11.120  -9.035
  763    HD2  TYR  45           2HD      TYR  45   0.143 -14.373 -10.851
  764    HE1  TYR  45           1HE      TYR  45   3.629 -12.699  -7.811
  765    HE2  TYR  45           2HE      TYR  45   1.567 -15.961  -9.630
  766    HH   TYR  45           HH       TYR  45   3.693 -16.059  -8.530
  767    H    ASP  46           H        ASP  46   3.372 -10.769 -10.740
  768    HA   ASP  46           HA       ASP  46   4.101 -11.686 -13.441
  769   1HB   ASP  46          2HB       ASP  46   4.975  -9.420 -13.050
  770   2HB   ASP  46          1HB       ASP  46   5.766  -9.976 -11.577
  771    H    ASP  47           H        ASP  47   3.776 -13.849 -12.672
  772    HA   ASP  47           HA       ASP  47   4.823 -15.033 -10.431
  773   1HB   ASP  47          2HB       ASP  47   4.617 -16.240 -13.197
  774   2HB   ASP  47          1HB       ASP  47   4.815 -17.153 -11.704
  775    H    ALA  48           H        ALA  48   6.485 -14.275 -13.440
  776    HA   ALA  48           HA       ALA  48   8.825 -15.715 -13.106
  777   1HB   ALA  48          1HB       ALA  48   7.912 -13.951 -14.951
  778   2HB   ALA  48          2HB       ALA  48   9.555 -14.593 -14.908
  779   3HB   ALA  48          3HB       ALA  48   9.204 -13.018 -14.197
  780    H    THR  49           H        THR  49   7.828 -12.719 -11.576
  781    HA   THR  49           HA       THR  49  10.386 -12.672 -10.113
  782    HB   THR  49           HB       THR  49   9.969 -10.267  -9.743
  783    HG1  THR  49           1HG      THR  49   7.699 -10.297  -9.939
  784   1HG2  THR  49          1HG2      THR  49  10.403 -11.430 -12.378
  785   2HG2  THR  49          2HG2      THR  49  11.277 -10.149 -11.539
  786   3HG2  THR  49          3HG2      THR  49   9.793  -9.776 -12.417
  787    H    LYS  50           H        LYS  50   7.432 -13.809  -9.685
  788    HA   LYS  50           HA       LYS  50   6.012 -14.147  -7.901
  789   1HB   LYS  50          2HB       LYS  50   8.663 -13.800  -6.489
  790   2HB   LYS  50          1HB       LYS  50   7.206 -14.382  -5.699
  791   1HG   LYS  50          2HG       LYS  50   8.395 -15.736  -8.101
  792   2HG   LYS  50          1HG       LYS  50   8.864 -16.131  -6.448
  793   1HD   LYS  50          2HD       LYS  50   6.056 -16.272  -7.548
  794   2HD   LYS  50          1HD       LYS  50   7.133 -17.651  -7.319
  795   1HE   LYS  50          2HE       LYS  50   6.060 -15.827  -5.173
  796   2HE   LYS  50          1HE       LYS  50   5.585 -17.499  -5.465
  797   1HZ   LYS  50          1HZ       LYS  50   7.148 -18.021  -3.996
  798   2HZ   LYS  50          2HZ       LYS  50   7.832 -16.475  -4.023
  799   3HZ   LYS  50          3HZ       LYS  50   8.291 -17.623  -5.178
  800    H    THR  51           H        THR  51   6.248 -11.404  -8.836
  801    HA   THR  51           HA       THR  51   5.612 -10.006  -6.326
  802    HB   THR  51           HB       THR  51   6.952  -8.850  -8.776
  803    HG1  THR  51           1HG      THR  51   8.716  -8.620  -7.332
  804   1HG2  THR  51          1HG2      THR  51   5.497  -7.231  -7.570
  805   2HG2  THR  51          2HG2      THR  51   7.210  -6.810  -7.583
  806   3HG2  THR  51          3HG2      THR  51   6.483  -7.500  -6.133
  807    H    PHE  52           H        PHE  52   4.040  -8.360  -6.422
  808    HA   PHE  52           HA       PHE  52   2.213  -8.524  -8.735
  809   1HB   PHE  52          2HB       PHE  52   1.427  -8.083  -5.842
  810   2HB   PHE  52          1HB       PHE  52   0.336  -8.254  -7.211
  811    HD1  PHE  52           1HD      PHE  52  -0.720 -10.269  -7.423
  812    HD2  PHE  52           2HD      PHE  52   3.140 -10.154  -5.633
  813    HE1  PHE  52           1HE      PHE  52  -0.841 -12.693  -7.011
  814    HE2  PHE  52           2HE      PHE  52   3.028 -12.578  -5.225
  815    HZ   PHE  52           HZ       PHE  52   1.035 -13.850  -5.914
  816    H    THR  53           H        THR  53   1.302  -6.573  -9.438
  817    HA   THR  53           HA       THR  53   2.298  -4.163  -8.089
  818    HB   THR  53           HB       THR  53   2.134  -3.143 -10.480
  819    HG1  THR  53           1HG      THR  53   2.657  -5.838 -11.151
  820   1HG2  THR  53          1HG2      THR  53   4.458  -4.146 -11.024
  821   2HG2  THR  53          2HG2      THR  53   4.330  -4.844  -9.410
  822   3HG2  THR  53          3HG2      THR  53   4.257  -3.093  -9.624
  823    H    VAL  54           H        VAL  54   0.860  -2.720  -7.501
  824    HA   VAL  54           HA       VAL  54  -1.912  -3.033  -8.433
  825    HB   VAL  54           HB       VAL  54  -0.887  -1.579  -5.980
  826   1HG1  VAL  54          1HG1      VAL  54  -3.233  -1.127  -7.300
  827   2HG1  VAL  54          2HG1      VAL  54  -2.968  -0.846  -5.579
  828   3HG1  VAL  54          3HG1      VAL  54  -3.709  -2.350  -6.123
  829   1HG2  VAL  54          1HG2      VAL  54  -1.608  -3.413  -4.680
  830   2HG2  VAL  54          2HG2      VAL  54  -0.668  -4.102  -6.005
  831   3HG2  VAL  54          3HG2      VAL  54  -2.430  -4.159  -6.051
  832    H    THR  55           H        THR  55  -2.185  -1.774 -10.183
  833    HA   THR  55           HA       THR  55  -0.937   0.859 -10.255
  834    HB   THR  55           HB       THR  55  -2.492  -0.533 -12.432
  835    HG1  THR  55           1HG      THR  55   0.288  -0.457 -11.883
  836   1HG2  THR  55          1HG2      THR  55  -2.366   1.776 -12.936
  837   2HG2  THR  55          2HG2      THR  55  -1.126   0.968 -13.897
  838   3HG2  THR  55          3HG2      THR  55  -0.674   1.857 -12.441
  839    H    GLU  56           H        GLU  56  -2.005   2.490  -9.404
  840    HA   GLU  56           HA       GLU  56  -4.654   2.605  -8.675
  841   1HB   GLU  56          2HB       GLU  56  -3.032   4.212  -7.876
  842   2HB   GLU  56          1HB       GLU  56  -2.804   4.848  -9.498
  843   1HG   GLU  56          2HG       GLU  56  -4.174   6.327  -8.136
  844   2HG   GLU  56          1HG       GLU  56  -5.075   5.695  -9.514
  Start of MODEL   16
    1   1H    MET   1          1HT       MET   1   6.053 -19.737   2.181
    2   2H    MET   1          2HT       MET   1   4.906 -18.498   2.271
    3   3H    MET   1          3HT       MET   1   6.281 -18.449   3.256
    4    HA   MET   1           HA       MET   1   7.708 -18.148   1.373
    5   1HB   MET   1          2HB       MET   1   6.426 -19.522  -0.185
    6   2HB   MET   1          1HB       MET   1   5.123 -18.342  -0.188
    7   1HG   MET   1          2HG       MET   1   6.470 -18.170  -2.199
    8   2HG   MET   1          1HG       MET   1   6.589 -16.703  -1.228
    9   1HE   MET   1          1HE       MET   1   8.879 -17.564  -3.613
   10   2HE   MET   1          2HE       MET   1  10.114 -16.699  -2.699
   11   3HE   MET   1          3HE       MET   1   8.469 -16.069  -2.774
   12    H    GLN   2           H        GLN   2   8.234 -16.070   0.705
   13    HA   GLN   2           HA       GLN   2   6.397 -13.976   1.640
   14   1HB   GLN   2          2HB       GLN   2   8.586 -14.008   2.750
   15   2HB   GLN   2          1HB       GLN   2   9.385 -13.870   1.189
   16   1HG   GLN   2          2HG       GLN   2   8.374 -11.675   0.858
   17   2HG   GLN   2          1HG       GLN   2   7.565 -11.812   2.419
   18   1HE2  GLN   2          1HE2      GLN   2   8.518 -10.698   3.950
   19   2HE2  GLN   2          2HE2      GLN   2  10.212 -10.405   4.103
   20    H    TYR   3           H        TYR   3   5.763 -12.337   0.304
   21    HA   TYR   3           HA       TYR   3   6.725 -12.458  -2.477
   22   1HB   TYR   3          2HB       TYR   3   3.903 -11.962  -1.510
   23   2HB   TYR   3          1HB       TYR   3   4.431 -11.782  -3.180
   24    HD1  TYR   3           1HD      TYR   3   4.245 -13.591  -4.622
   25    HD2  TYR   3           2HD      TYR   3   4.355 -14.302  -0.427
   26    HE1  TYR   3           1HE      TYR   3   3.804 -15.975  -5.020
   27    HE2  TYR   3           2HE      TYR   3   3.918 -16.691  -0.816
   28    HH   TYR   3           HH       TYR   3   4.421 -18.281  -3.244
   29    H    LYS   4           H        LYS   4   6.990 -10.525  -3.564
   30    HA   LYS   4           HA       LYS   4   7.083  -8.154  -1.835
   31   1HB   LYS   4          2HB       LYS   4   9.178  -8.929  -2.969
   32   2HB   LYS   4          1HB       LYS   4   8.411  -8.600  -4.515
   33   1HG   LYS   4          2HG       LYS   4   9.898  -6.797  -3.888
   34   2HG   LYS   4          1HG       LYS   4   8.225  -6.237  -3.919
   35   1HD   LYS   4          2HD       LYS   4   8.083  -6.323  -1.531
   36   2HD   LYS   4          1HD       LYS   4   9.652  -7.120  -1.414
   37   1HE   LYS   4          2HE       LYS   4  10.739  -5.125  -2.301
   38   2HE   LYS   4          1HE       LYS   4   9.174  -4.332  -2.455
   39   1HZ   LYS   4          1HZ       LYS   4  10.139  -3.564  -0.461
   40   2HZ   LYS   4          2HZ       LYS   4  10.561  -5.122   0.040
   41   3HZ   LYS   4          3HZ       LYS   4   8.936  -4.658   0.002
   42    H    VAL   5           H        VAL   5   5.162  -7.116  -1.974
   43    HA   VAL   5           HA       VAL   5   3.849  -6.916  -4.571
   44    HB   VAL   5           HB       VAL   5   2.873  -6.012  -1.859
   45   1HG1  VAL   5          1HG1      VAL   5   0.848  -6.514  -3.860
   46   2HG1  VAL   5          2HG1      VAL   5   1.972  -5.259  -4.382
   47   3HG1  VAL   5          3HG1      VAL   5   1.109  -5.089  -2.854
   48   1HG2  VAL   5          1HG2      VAL   5   1.719  -8.005  -1.646
   49   2HG2  VAL   5          2HG2      VAL   5   3.243  -8.530  -2.360
   50   3HG2  VAL   5          3HG2      VAL   5   1.807  -8.361  -3.371
   51    H    ILE   6           H        ILE   6   4.013  -5.229  -5.808
   52    HA   ILE   6           HA       ILE   6   5.154  -2.741  -4.752
   53    HB   ILE   6           HB       ILE   6   4.944  -3.800  -7.572
   54   1HG1  ILE   6          2HG1      ILE   6   7.332  -3.204  -5.818
   55   2HG1  ILE   6          1HG1      ILE   6   6.700  -4.807  -6.167
   56   1HG2  ILE   6          1HG2      ILE   6   6.323  -1.781  -8.159
   57   2HG2  ILE   6          2HG2      ILE   6   5.891  -1.126  -6.580
   58   3HG2  ILE   6          3HG2      ILE   6   4.632  -1.467  -7.767
   59   1HD1  ILE   6          1HD1      ILE   6   7.095  -4.068  -8.651
   60   2HD1  ILE   6          2HD1      ILE   6   8.418  -4.684  -7.661
   61   3HD1  ILE   6          3HD1      ILE   6   8.233  -2.947  -7.903
   62    H    LEU   7           H        LEU   7   3.952  -0.945  -4.606
   63    HA   LEU   7           HA       LEU   7   1.260  -0.987  -5.799
   64   1HB   LEU   7          2HB       LEU   7   2.129   0.845  -3.580
   65   2HB   LEU   7          1HB       LEU   7   0.505   0.341  -4.011
   66    HG   LEU   7           HG       LEU   7   2.611  -1.358  -2.685
   67   1HD1  LEU   7          1HD1      LEU   7   1.566   0.273  -1.206
   68   2HD1  LEU   7          2HD1      LEU   7   1.056  -1.365  -0.804
   69   3HD1  LEU   7          3HD1      LEU   7  -0.029  -0.295  -1.693
   70   1HD2  LEU   7          1HD2      LEU   7  -0.195  -2.075  -3.527
   71   2HD2  LEU   7          2HD2      LEU   7   0.903  -3.096  -2.597
   72   3HD2  LEU   7          3HD2      LEU   7   1.291  -2.672  -4.262
   73    H    ASN   8           H        ASN   8   2.048  -0.227  -7.842
   74    HA   ASN   8           HA       ASN   8   3.309   2.388  -7.925
   75   1HB   ASN   8          2HB       ASN   8   2.532   0.504 -10.152
   76   2HB   ASN   8          1HB       ASN   8   3.401   2.020 -10.372
   77   1HD2  ASN   8          1HD2      ASN   8   3.836  -1.132 -10.385
   78   2HD2  ASN   8          2HD2      ASN   8   5.452  -1.248  -9.789
   79    H    GLY   9           H        GLY   9   2.057   4.137  -7.743
   80   1HA   GLY   9          2HA       GLY   9  -0.541   4.111  -9.156
   81   2HA   GLY   9          1HA       GLY   9  -0.253   4.999  -7.667
   82    H    LYS  10           H        LYS  10  -1.180   6.735  -9.102
   83    HA   LYS  10           HA       LYS  10   0.591   7.808 -11.117
   84   1HB   LYS  10          2HB       LYS  10  -1.933   8.949  -9.905
   85   2HB   LYS  10          1HB       LYS  10  -1.090   9.608 -11.300
   86   1HG   LYS  10          2HG       LYS  10  -1.507   7.492 -12.503
   87   2HG   LYS  10          1HG       LYS  10  -2.439   6.921 -11.119
   88   1HD   LYS  10          2HD       LYS  10  -3.068   9.404 -12.715
   89   2HD   LYS  10          1HD       LYS  10  -3.841   7.837 -12.951
   90   1HE   LYS  10          2HE       LYS  10  -5.312   9.104 -11.602
   91   2HE   LYS  10          1HE       LYS  10  -4.531   7.946 -10.527
   92   1HZ   LYS  10          1HZ       LYS  10  -3.091  10.410 -10.685
   93   2HZ   LYS  10          2HZ       LYS  10  -3.667   9.586  -9.325
   94   3HZ   LYS  10          3HZ       LYS  10  -4.682  10.648 -10.162
   95    H    THR  11           H        THR  11  -0.736   9.047  -8.052
   96    HA   THR  11           HA       THR  11   1.494  10.918  -7.846
   97    HB   THR  11           HB       THR  11   0.015  11.755  -5.894
   98    HG1  THR  11           1HG      THR  11  -1.309   9.756  -6.099
   99   1HG2  THR  11          1HG2      THR  11  -1.675  12.785  -7.548
  100   2HG2  THR  11          2HG2      THR  11  -0.673  12.024  -8.783
  101   3HG2  THR  11          3HG2      THR  11   0.032  13.209  -7.684
  102    H    LEU  12           H        LEU  12   0.821   7.847  -6.942
  103    HA   LEU  12           HA       LEU  12   2.558   8.063  -4.605
  104   1HB   LEU  12          2HB       LEU  12   0.270   7.931  -3.771
  105   2HB   LEU  12          1HB       LEU  12  -0.005   6.477  -4.711
  106    HG   LEU  12           HG       LEU  12   1.467   5.211  -3.340
  107   1HD1  LEU  12          1HD1      LEU  12   3.301   6.252  -2.625
  108   2HD1  LEU  12          2HD1      LEU  12   2.315   6.826  -1.279
  109   3HD1  LEU  12          3HD1      LEU  12   2.532   7.831  -2.705
  110   1HD2  LEU  12          1HD2      LEU  12  -0.856   6.320  -2.414
  111   2HD2  LEU  12          2HD2      LEU  12   0.281   6.672  -1.115
  112   3HD2  LEU  12          3HD2      LEU  12   0.032   5.008  -1.643
  113    H    LYS  13           H        LYS  13   4.033   6.493  -4.399
  114    HA   LYS  13           HA       LYS  13   3.839   4.062  -6.000
  115   1HB   LYS  13          2HB       LYS  13   6.179   5.972  -6.183
  116   2HB   LYS  13          1HB       LYS  13   6.129   4.364  -6.890
  117   1HG   LYS  13          2HG       LYS  13   4.292   5.042  -8.337
  118   2HG   LYS  13          1HG       LYS  13   4.309   6.652  -7.614
  119   1HD   LYS  13          2HD       LYS  13   6.592   5.380  -9.121
  120   2HD   LYS  13          1HD       LYS  13   5.488   6.596  -9.768
  121   1HE   LYS  13          2HE       LYS  13   7.358   6.956  -7.427
  122   2HE   LYS  13          1HE       LYS  13   7.593   7.603  -9.050
  123   1HZ   LYS  13          1HZ       LYS  13   5.493   8.849  -8.746
  124   2HZ   LYS  13          2HZ       LYS  13   6.709   9.313  -7.666
  125   3HZ   LYS  13          3HZ       LYS  13   5.441   8.326  -7.138
  126    H    GLY  14           H        GLY  14   5.011   2.329  -5.122
  127   1HA   GLY  14          2HA       GLY  14   7.006   2.582  -3.160
  128   2HA   GLY  14          1HA       GLY  14   5.458   2.430  -2.350
  129    H    GLU  15           H        GLU  15   6.603   0.516  -1.479
  130    HA   GLU  15           HA       GLU  15   5.823  -1.817  -3.024
  131   1HB   GLU  15          2HB       GLU  15   8.619  -1.549  -1.908
  132   2HB   GLU  15          1HB       GLU  15   7.958  -2.938  -2.758
  133   1HG   GLU  15          2HG       GLU  15   7.728  -1.592  -4.783
  134   2HG   GLU  15          1HG       GLU  15   8.407  -0.206  -3.932
  135    H    THR  16           H        THR  16   5.659  -3.736  -1.750
  136    HA   THR  16           HA       THR  16   5.963  -3.527   1.118
  137    HB   THR  16           HB       THR  16   3.820  -2.645   1.153
  138    HG1  THR  16           1HG      THR  16   3.269  -5.399   1.070
  139   1HG2  THR  16          1HG2      THR  16   3.300  -4.271  -1.282
  140   2HG2  THR  16          2HG2      THR  16   3.008  -2.559  -0.988
  141   3HG2  THR  16          3HG2      THR  16   1.954  -3.772  -0.260
  142    H    THR  17           H        THR  17   5.255  -5.670   2.191
  143    HA   THR  17           HA       THR  17   5.525  -7.934   0.356
  144    HB   THR  17           HB       THR  17   7.272  -8.939   1.824
  145    HG1  THR  17           1HG      THR  17   8.325  -7.608   3.280
  146   1HG2  THR  17          1HG2      THR  17   7.915  -6.348   0.455
  147   2HG2  THR  17          2HG2      THR  17   8.102  -7.989  -0.164
  148   3HG2  THR  17          3HG2      THR  17   9.142  -7.413   1.139
  149    H    THR  18           H        THR  18   4.004  -9.333   0.771
  150    HA   THR  18           HA       THR  18   2.948  -9.640   3.521
  151    HB   THR  18           HB       THR  18   1.303  -9.014   1.761
  152    HG1  THR  18           1HG      THR  18   0.708 -10.361   3.547
  153   1HG2  THR  18          1HG2      THR  18   2.619 -10.987   0.220
  154   2HG2  THR  18          2HG2      THR  18   1.278  -9.938  -0.241
  155   3HG2  THR  18          3HG2      THR  18   0.957 -11.515   0.482
  156    H    GLU  19           H        GLU  19   2.882 -11.687   4.454
  157    HA   GLU  19           HA       GLU  19   4.503 -13.733   3.097
  158   1HB   GLU  19          2HB       GLU  19   5.359 -12.991   5.269
  159   2HB   GLU  19          1HB       GLU  19   3.830 -13.410   6.028
  160   1HG   GLU  19          2HG       GLU  19   4.198 -15.760   5.474
  161   2HG   GLU  19          1HG       GLU  19   5.730 -15.339   4.714
  162    H    ALA  20           H        ALA  20   3.361 -15.310   2.126
  163    HA   ALA  20           HA       ALA  20   1.150 -16.520   3.573
  164   1HB   ALA  20          1HB       ALA  20  -0.524 -16.052   2.099
  165   2HB   ALA  20          2HB       ALA  20   0.579 -15.834   0.740
  166   3HB   ALA  20          3HB       ALA  20   0.426 -14.574   1.964
  167    H    VAL  21           H        VAL  21   0.552 -18.558   2.848
  168    HA   VAL  21           HA       VAL  21   2.551 -20.304   2.147
  169    HB   VAL  21           HB       VAL  21  -0.353 -20.767   1.478
  170   1HG1  VAL  21          1HG1      VAL  21   0.708 -22.617   0.662
  171   2HG1  VAL  21          2HG1      VAL  21   0.470 -23.122   2.336
  172   3HG1  VAL  21          3HG1      VAL  21   2.037 -22.502   1.816
  173   1HG2  VAL  21          1HG2      VAL  21  -0.268 -21.837   3.856
  174   2HG2  VAL  21          2HG2      VAL  21  -0.539 -20.103   3.673
  175   3HG2  VAL  21          3HG2      VAL  21   1.062 -20.703   4.104
  176    H    ASP  22           H        ASP  22   0.312 -18.652  -0.015
  177    HA   ASP  22           HA       ASP  22   2.066 -19.335  -2.249
  178   1HB   ASP  22          2HB       ASP  22   0.257 -20.072  -3.692
  179   2HB   ASP  22          1HB       ASP  22   0.310 -21.074  -2.245
  180    H    ALA  23           H        ALA  23   1.378 -18.118  -4.290
  181    HA   ALA  23           HA       ALA  23   1.440 -15.391  -3.776
  182   1HB   ALA  23          1HB       ALA  23   1.640 -17.017  -6.026
  183   2HB   ALA  23          2HB       ALA  23   1.873 -15.271  -5.955
  184   3HB   ALA  23          3HB       ALA  23   0.291 -15.933  -6.370
  185    H    ALA  24           H        ALA  24  -1.320 -17.455  -4.564
  186    HA   ALA  24           HA       ALA  24  -3.216 -15.375  -4.787
  187   1HB   ALA  24          1HB       ALA  24  -4.701 -17.485  -3.897
  188   2HB   ALA  24          2HB       ALA  24  -3.282 -18.303  -4.555
  189   3HB   ALA  24          3HB       ALA  24  -4.232 -17.224  -5.577
  190    H    THR  25           H        THR  25  -2.482 -17.546  -2.042
  191    HA   THR  25           HA       THR  25  -4.159 -16.395  -0.169
  192    HB   THR  25           HB       THR  25  -2.568 -17.288   1.515
  193    HG1  THR  25           1HG      THR  25  -0.595 -17.697   1.030
  194   1HG2  THR  25          1HG2      THR  25  -3.482 -18.953  -0.743
  195   2HG2  THR  25          2HG2      THR  25  -3.874 -19.052   0.973
  196   3HG2  THR  25          3HG2      THR  25  -2.328 -19.663   0.383
  197    H    ALA  26           H        ALA  26  -0.832 -15.571  -1.058
  198    HA   ALA  26           HA       ALA  26  -0.488 -13.444   0.748
  199   1HB   ALA  26          1HB       ALA  26   1.535 -13.897  -0.163
  200   2HB   ALA  26          2HB       ALA  26   1.051 -12.679  -1.341
  201   3HB   ALA  26          3HB       ALA  26   0.844 -14.391  -1.709
  202    H    GLU  27           H        GLU  27  -1.507 -13.465  -2.677
  203    HA   GLU  27           HA       GLU  27  -1.997 -10.781  -3.012
  204   1HB   GLU  27          2HB       GLU  27  -2.062 -12.409  -4.838
  205   2HB   GLU  27          1HB       GLU  27  -3.525 -13.117  -4.167
  206   1HG   GLU  27          2HG       GLU  27  -4.721 -11.028  -4.555
  207   2HG   GLU  27          1HG       GLU  27  -3.255 -10.309  -5.217
  208    H    LYS  28           H        LYS  28  -4.235 -13.294  -1.845
  209    HA   LYS  28           HA       LYS  28  -6.475 -11.665  -1.494
  210   1HB   LYS  28          2HB       LYS  28  -5.625 -14.116   0.057
  211   2HB   LYS  28          1HB       LYS  28  -7.220 -13.383   0.150
  212   1HG   LYS  28          2HG       LYS  28  -5.962 -14.608  -2.295
  213   2HG   LYS  28          1HG       LYS  28  -7.262 -15.296  -1.320
  214   1HD   LYS  28          2HD       LYS  28  -8.690 -13.391  -1.895
  215   2HD   LYS  28          1HD       LYS  28  -7.389 -12.717  -2.879
  216   1HE   LYS  28          2HE       LYS  28  -9.035 -13.888  -4.256
  217   2HE   LYS  28          1HE       LYS  28  -7.456 -14.669  -4.333
  218   1HZ   LYS  28          1HZ       LYS  28  -8.354 -16.545  -3.614
  219   2HZ   LYS  28          2HZ       LYS  28  -9.884 -15.828  -3.663
  220   3HZ   LYS  28          3HZ       LYS  28  -8.980 -15.789  -2.235
  221    H    VAL  29           H        VAL  29  -3.735 -12.309   0.611
  222    HA   VAL  29           HA       VAL  29  -4.688 -11.067   2.932
  223    HB   VAL  29           HB       VAL  29  -1.838 -11.263   1.940
  224   1HG1  VAL  29          1HG1      VAL  29  -1.290 -11.072   4.381
  225   2HG1  VAL  29          2HG1      VAL  29  -2.963 -10.577   4.643
  226   3HG1  VAL  29          3HG1      VAL  29  -1.901  -9.598   3.630
  227   1HG2  VAL  29          1HG2      VAL  29  -1.784 -13.390   2.624
  228   2HG2  VAL  29          2HG2      VAL  29  -3.547 -13.312   2.604
  229   3HG2  VAL  29          3HG2      VAL  29  -2.669 -13.025   4.107
  230    H    VAL  30           H        VAL  30  -3.118  -9.780   0.066
  231    HA   VAL  30           HA       VAL  30  -2.709  -7.156   1.056
  232    HB   VAL  30           HB       VAL  30  -3.168  -7.928  -1.825
  233   1HG1  VAL  30          1HG1      VAL  30  -2.129  -5.944  -2.409
  234   2HG1  VAL  30          2HG1      VAL  30  -1.320  -5.790  -0.849
  235   3HG1  VAL  30          3HG1      VAL  30  -3.048  -5.472  -0.981
  236   1HG2  VAL  30          1HG2      VAL  30  -0.625  -8.068  -1.873
  237   2HG2  VAL  30          2HG2      VAL  30  -1.487  -9.412  -1.122
  238   3HG2  VAL  30          3HG2      VAL  30  -0.713  -8.188  -0.115
  239    H    LYS  31           H        LYS  31  -5.295  -8.627  -0.941
  240    HA   LYS  31           HA       LYS  31  -6.912  -6.443  -1.336
  241   1HB   LYS  31          2HB       LYS  31  -7.565  -9.338  -0.895
  242   2HB   LYS  31          1HB       LYS  31  -8.853  -8.160  -1.095
  243   1HG   LYS  31          2HG       LYS  31  -8.372  -9.227  -3.200
  244   2HG   LYS  31          1HG       LYS  31  -7.915  -7.526  -3.273
  245   1HD   LYS  31          2HD       LYS  31  -5.570  -8.184  -2.818
  246   2HD   LYS  31          1HD       LYS  31  -6.071  -9.876  -2.872
  247   1HE   LYS  31          2HE       LYS  31  -6.353  -7.898  -5.129
  248   2HE   LYS  31          1HE       LYS  31  -5.089  -9.118  -4.996
  249   1HZ   LYS  31          1HZ       LYS  31  -7.591  -9.409  -6.136
  250   2HZ   LYS  31          2HZ       LYS  31  -7.634 -10.316  -4.709
  251   3HZ   LYS  31          3HZ       LYS  31  -6.440 -10.620  -5.868
  252    H    GLN  32           H        GLN  32  -6.699  -8.508   1.509
  253    HA   GLN  32           HA       GLN  32  -8.743  -7.148   2.971
  254   1HB   GLN  32          2HB       GLN  32  -8.022  -9.454   3.526
  255   2HB   GLN  32          1HB       GLN  32  -6.444  -8.836   3.994
  256   1HG   GLN  32          2HG       GLN  32  -7.739  -9.240   5.960
  257   2HG   GLN  32          1HG       GLN  32  -7.522  -7.504   5.762
  258   1HE2  GLN  32          1HE2      GLN  32  -9.769  -8.671   3.533
  259   2HE2  GLN  32          2HE2      GLN  32 -11.205  -8.273   4.401
  260    H    PHE  33           H        PHE  33  -5.275  -6.882   2.644
  261    HA   PHE  33           HA       PHE  33  -4.664  -5.083   4.668
  262   1HB   PHE  33          2HB       PHE  33  -3.053  -6.300   3.144
  263   2HB   PHE  33          1HB       PHE  33  -3.433  -5.118   1.899
  264    HD1  PHE  33           1HD      PHE  33  -2.251  -5.313   5.420
  265    HD2  PHE  33           2HD      PHE  33  -2.087  -3.235   1.693
  266    HE1  PHE  33           1HE      PHE  33  -0.499  -3.833   6.313
  267    HE2  PHE  33           2HE      PHE  33  -0.332  -1.764   2.595
  268    HZ   PHE  33           HZ       PHE  33   0.461  -2.065   4.908
  269    H    PHE  34           H        PHE  34  -5.395  -4.360   1.269
  270    HA   PHE  34           HA       PHE  34  -5.614  -1.546   1.713
  271   1HB   PHE  34          2HB       PHE  34  -6.417  -3.235  -0.652
  272   2HB   PHE  34          1HB       PHE  34  -6.415  -1.471  -0.633
  273    HD1  PHE  34           1HD      PHE  34  -3.985  -0.889   0.865
  274    HD2  PHE  34           2HD      PHE  34  -4.712  -3.822  -2.130
  275    HE1  PHE  34           1HE      PHE  34  -1.596  -0.893   0.301
  276    HE2  PHE  34           2HE      PHE  34  -2.318  -3.827  -2.704
  277    HZ   PHE  34           HZ       PHE  34  -0.766  -2.363  -1.477
  278    H    ASN  35           H        ASN  35  -7.959  -4.153   1.305
  279    HA   ASN  35           HA       ASN  35 -10.317  -2.738   1.165
  280   1HB   ASN  35          2HB       ASN  35 -10.279  -5.158   1.021
  281   2HB   ASN  35          1HB       ASN  35  -9.719  -5.287   2.685
  282   1HD2  ASN  35          1HD2      ASN  35 -12.291  -5.717   0.825
  283   2HD2  ASN  35          2HD2      ASN  35 -13.563  -5.409   1.949
  284    H    ASP  36           H        ASP  36  -8.317  -3.447   3.927
  285    HA   ASP  36           HA       ASP  36 -10.117  -2.024   5.732
  286   1HB   ASP  36          2HB       ASP  36  -7.602  -3.599   6.306
  287   2HB   ASP  36          1HB       ASP  36  -8.620  -2.847   7.530
  288    H    ASN  37           H        ASN  37  -7.108  -1.473   4.054
  289    HA   ASN  37           HA       ASN  37  -6.288   0.653   5.832
  290   1HB   ASN  37          2HB       ASN  37  -5.320  -0.144   3.076
  291   2HB   ASN  37          1HB       ASN  37  -4.655   1.210   3.983
  292   1HD2  ASN  37          1HD2      ASN  37  -3.568  -1.444   3.030
  293   2HD2  ASN  37          2HD2      ASN  37  -2.840  -2.125   4.442
  294    H    GLY  38           H        GLY  38  -7.709   0.345   2.636
  295   1HA   GLY  38          2HA       GLY  38  -8.143   2.362   1.283
  296   2HA   GLY  38          1HA       GLY  38  -9.594   1.743   2.038
  297    H    VAL  39           H        VAL  39 -10.828   3.261   2.778
  298    HA   VAL  39           HA       VAL  39  -9.623   5.799   3.662
  299    HB   VAL  39           HB       VAL  39 -12.418   5.259   2.715
  300   1HG1  VAL  39          1HG1      VAL  39 -11.058   7.639   3.792
  301   2HG1  VAL  39          2HG1      VAL  39 -12.771   7.219   3.779
  302   3HG1  VAL  39          3HG1      VAL  39 -12.021   7.908   2.339
  303   1HG2  VAL  39          1HG2      VAL  39 -11.313   6.814   0.797
  304   2HG2  VAL  39          2HG2      VAL  39 -11.393   5.053   0.722
  305   3HG2  VAL  39          3HG2      VAL  39  -9.920   5.845   1.281
  306    H    ASP  40           H        ASP  40 -10.816   3.123   5.182
  307    HA   ASP  40           HA       ASP  40 -11.984   4.780   7.311
  308   1HB   ASP  40          2HB       ASP  40 -12.828   1.996   6.493
  309   2HB   ASP  40          1HB       ASP  40 -13.459   2.882   7.878
  310    H    GLY  41           H        GLY  41  -9.238   3.376   6.694
  311   1HA   GLY  41          2HA       GLY  41  -8.999   1.596   8.969
  312   2HA   GLY  41          1HA       GLY  41  -7.719   2.035   7.849
  313    H    GLU  42           H        GLU  42  -6.839   1.934  10.262
  314    HA   GLU  42           HA       GLU  42  -7.082   4.561  11.540
  315   1HB   GLU  42          2HB       GLU  42  -5.701   2.041  12.485
  316   2HB   GLU  42          1HB       GLU  42  -5.840   3.531  13.408
  317   1HG   GLU  42          2HG       GLU  42  -8.270   3.297  13.428
  318   2HG   GLU  42          1HG       GLU  42  -8.132   1.805  12.500
  319    H    TRP  43           H        TRP  43  -5.824   5.976  10.440
  320    HA   TRP  43           HA       TRP  43  -3.134   5.180   9.641
  321   1HB   TRP  43          2HB       TRP  43  -4.721   7.681   9.055
  322   2HB   TRP  43          1HB       TRP  43  -3.128   7.316   8.405
  323    HD1  TRP  43           HD       TRP  43  -6.119   4.849   8.560
  324    HE1  TRP  43           1HE      TRP  43  -6.669   4.144   6.141
  325    HE3  TRP  43           3HE      TRP  43  -2.842   7.868   6.067
  326    HZ2  TRP  43           2HZ      TRP  43  -5.823   4.783   3.534
  327    HZ3  TRP  43           3HZ      TRP  43  -2.774   7.765   3.618
  328    HH2  TRP  43           HH       TRP  43  -4.242   6.252   2.374
  329    H    THR  44           H        THR  44  -1.463   5.580  10.918
  330    HA   THR  44           HA       THR  44  -1.615   7.805  12.834
  331    HB   THR  44           HB       THR  44   0.291   6.663  13.965
  332    HG1  THR  44           1HG      THR  44  -0.224   4.578  12.116
  333   1HG2  THR  44          1HG2      THR  44  -0.940   5.082  15.087
  334   2HG2  THR  44          2HG2      THR  44  -1.820   4.585  13.642
  335   3HG2  THR  44          3HG2      THR  44  -2.199   6.121  14.419
  336    H    TYR  45           H        TYR  45  -0.270   9.525  12.617
  337    HA   TYR  45           HA       TYR  45   1.658   9.431  10.398
  338   1HB   TYR  45          2HB       TYR  45  -0.183  11.076  10.200
  339   2HB   TYR  45          1HB       TYR  45   0.360  11.838  11.690
  340    HD1  TYR  45           1HD      TYR  45   2.569  10.561   9.003
  341    HD2  TYR  45           2HD      TYR  45   0.860  13.991  10.849
  342    HE1  TYR  45           1HE      TYR  45   4.075  12.003   7.701
  343    HE2  TYR  45           2HE      TYR  45   2.360  15.444   9.552
  344    HH   TYR  45           HH       TYR  45   4.700  15.133   8.416
  345    H    ASP  46           H        ASP  46   3.755  10.146  10.655
  346    HA   ASP  46           HA       ASP  46   4.601  10.717  13.420
  347   1HB   ASP  46          2HB       ASP  46   5.268   8.447  12.750
  348   2HB   ASP  46          1HB       ASP  46   6.094   9.103  11.340
  349    H    ASP  47           H        ASP  47   4.472  12.961  12.936
  350    HA   ASP  47           HA       ASP  47   5.565  14.360  10.855
  351   1HB   ASP  47          2HB       ASP  47   5.646  15.187  13.764
  352   2HB   ASP  47          1HB       ASP  47   5.764  16.265  12.377
  353    H    ALA  48           H        ALA  48   7.251  13.053  13.660
  354    HA   ALA  48           HA       ALA  48   9.678  14.304  13.512
  355   1HB   ALA  48          1HB       ALA  48  10.396  11.719  14.126
  356   2HB   ALA  48          2HB       ALA  48   8.694  11.786  14.582
  357   3HB   ALA  48          3HB       ALA  48   9.838  12.942  15.268
  358    H    THR  49           H        THR  49   8.470  11.784  11.383
  359    HA   THR  49           HA       THR  49  10.935  12.077   9.798
  360    HB   THR  49           HB       THR  49  10.740   9.699   9.153
  361    HG1  THR  49           1HG      THR  49   8.435   9.605   9.696
  362   1HG2  THR  49          1HG2      THR  49  11.672  10.659  11.594
  363   2HG2  THR  49          2HG2      THR  49  12.075   9.129  10.816
  364   3HG2  THR  49          3HG2      THR  49  10.751   9.205  11.979
  365    H    LYS  50           H        LYS  50   7.982  13.098   9.709
  366    HA   LYS  50           HA       LYS  50   6.368  13.491   8.119
  367   1HB   LYS  50          2HB       LYS  50   8.784  13.227   6.316
  368   2HB   LYS  50          1HB       LYS  50   7.249  13.941   5.846
  369   1HG   LYS  50          2HG       LYS  50   9.034  14.978   8.037
  370   2HG   LYS  50          1HG       LYS  50   8.968  15.614   6.393
  371   1HD   LYS  50          2HD       LYS  50   6.663  15.531   8.339
  372   2HD   LYS  50          1HD       LYS  50   7.627  16.955   7.948
  373   1HE   LYS  50          2HE       LYS  50   6.911  16.772   5.603
  374   2HE   LYS  50          1HE       LYS  50   5.919  15.377   6.028
  375   1HZ   LYS  50          1HZ       LYS  50   5.535  17.921   7.452
  376   2HZ   LYS  50          2HZ       LYS  50   4.427  16.676   7.172
  377   3HZ   LYS  50          3HZ       LYS  50   4.861  17.720   5.913
  378    H    THR  51           H        THR  51   6.732  10.755   8.913
  379    HA   THR  51           HA       THR  51   6.070   9.342   6.423
  380    HB   THR  51           HB       THR  51   7.155   8.250   9.024
  381    HG1  THR  51           1HG      THR  51   8.617   9.432   7.612
  382   1HG2  THR  51          1HG2      THR  51   5.650   6.788   7.361
  383   2HG2  THR  51          2HG2      THR  51   7.014   6.140   8.272
  384   3HG2  THR  51          3HG2      THR  51   7.224   6.608   6.585
  385    H    PHE  52           H        PHE  52   4.250   8.120   6.267
  386    HA   PHE  52           HA       PHE  52   2.283   8.432   8.435
  387   1HB   PHE  52          2HB       PHE  52   1.893   7.896   5.480
  388   2HB   PHE  52          1HB       PHE  52   0.591   7.947   6.662
  389    HD1  PHE  52           1HD      PHE  52   0.127  10.094   7.866
  390    HD2  PHE  52           2HD      PHE  52   2.747   9.863   4.521
  391    HE1  PHE  52           1HE      PHE  52  -0.084  12.525   7.538
  392    HE2  PHE  52           2HE      PHE  52   2.542  12.293   4.188
  393    HZ   PHE  52           HZ       PHE  52   1.126  13.626   5.698
  394    H    THR  53           H        THR  53   1.859   6.704   9.600
  395    HA   THR  53           HA       THR  53   2.458   4.057   8.475
  396    HB   THR  53           HB       THR  53   2.278   3.372  10.982
  397    HG1  THR  53           1HG      THR  53   2.327   4.923  12.393
  398   1HG2  THR  53          1HG2      THR  53   4.673   4.178  11.366
  399   2HG2  THR  53          2HG2      THR  53   4.575   4.801   9.718
  400   3HG2  THR  53          3HG2      THR  53   4.361   3.075  10.025
  401    H    VAL  54           H        VAL  54   0.929   2.683   8.069
  402    HA   VAL  54           HA       VAL  54  -1.766   3.183   9.150
  403    HB   VAL  54           HB       VAL  54  -1.045   1.813   6.543
  404   1HG1  VAL  54          1HG1      VAL  54  -3.563   2.147   6.176
  405   2HG1  VAL  54          2HG1      VAL  54  -3.653   2.359   7.925
  406   3HG1  VAL  54          3HG1      VAL  54  -3.052   0.845   7.250
  407   1HG2  VAL  54          1HG2      VAL  54  -2.484   3.961   5.813
  408   2HG2  VAL  54          2HG2      VAL  54  -0.723   3.957   5.905
  409   3HG2  VAL  54          3HG2      VAL  54  -1.675   4.611   7.239
  410    H    THR  55           H        THR  55  -2.209   1.781  10.718
  411    HA   THR  55           HA       THR  55  -0.964  -0.864  10.636
  412    HB   THR  55           HB       THR  55  -2.478   0.350  12.942
  413    HG1  THR  55           1HG      THR  55  -0.395   0.922  13.714
  414   1HG2  THR  55          1HG2      THR  55  -0.924  -1.153  14.238
  415   2HG2  THR  55          2HG2      THR  55  -0.539  -1.927  12.700
  416   3HG2  THR  55          3HG2      THR  55  -2.195  -1.959  13.314
  417    H    GLU  56           H        GLU  56  -2.081  -2.442   9.759
  418    HA   GLU  56           HA       GLU  56  -4.751  -2.422   9.060
  419   1HB   GLU  56          2HB       GLU  56  -3.164  -4.010   8.127
  420   2HB   GLU  56          1HB       GLU  56  -2.973  -4.783   9.694
  421   1HG   GLU  56          2HG       GLU  56  -4.393  -6.096   8.230
  422   2HG   GLU  56          1HG       GLU  56  -5.292  -5.515   9.632
  423   1H    MET   1          1HT       MET   1   6.561  19.636  -2.004
  424   2H    MET   1          2HT       MET   1   5.386  18.426  -2.110
  425   3H    MET   1          3HT       MET   1   6.772  18.343  -3.074
  426    HA   MET   1           HA       MET   1   8.166  18.008  -1.173
  427   1HB   MET   1          2HB       MET   1   6.894  19.413   0.368
  428   2HB   MET   1          1HB       MET   1   5.564  18.264   0.351
  429   1HG   MET   1          2HG       MET   1   6.877  18.060   2.383
  430   2HG   MET   1          1HG       MET   1   6.974  16.590   1.413
  431   1HE   MET   1          1HE       MET   1   9.251  17.396   3.831
  432   2HE   MET   1          2HE       MET   1  10.478  16.501   2.935
  433   3HE   MET   1          3HE       MET   1   8.817  15.912   2.985
  434    H    GLN   2           H        GLN   2   8.631  15.917  -0.496
  435    HA   GLN   2           HA       GLN   2   6.756  13.869  -1.458
  436   1HB   GLN   2          2HB       GLN   2   8.963  13.848  -2.536
  437   2HB   GLN   2          1HB       GLN   2   9.737  13.690  -0.965
  438   1HG   GLN   2          2HG       GLN   2   8.667  11.520  -0.649
  439   2HG   GLN   2          1HG       GLN   2   7.884  11.678  -2.220
  440   1HE2  GLN   2          1HE2      GLN   2   8.829  10.541  -3.738
  441   2HE2  GLN   2          2HE2      GLN   2  10.519  10.206  -3.867
  442    H    TYR   3           H        TYR   3   6.064  12.246  -0.131
  443    HA   TYR   3           HA       TYR   3   6.991  12.343   2.664
  444   1HB   TYR   3          2HB       TYR   3   4.171  11.916   1.657
  445   2HB   TYR   3          1HB       TYR   3   4.671  11.724   3.334
  446    HD1  TYR   3           1HD      TYR   3   4.508  13.536   4.773
  447    HD2  TYR   3           2HD      TYR   3   4.695  14.245   0.580
  448    HE1  TYR   3           1HE      TYR   3   4.120  15.932   5.164
  449    HE2  TYR   3           2HE      TYR   3   4.311  16.645   0.963
  450    HH   TYR   3           HH       TYR   3   4.817  18.222   3.398
  451    H    LYS   4           H        LYS   4   7.194  10.405   3.753
  452    HA   LYS   4           HA       LYS   4   7.252   8.032   2.025
  453   1HB   LYS   4          2HB       LYS   4   9.350   8.757   3.189
  454   2HB   LYS   4          1HB       LYS   4   8.553   8.446   4.724
  455   1HG   LYS   4          2HG       LYS   4  10.005   6.608   4.118
  456   2HG   LYS   4          1HG       LYS   4   8.318   6.088   4.124
  457   1HD   LYS   4          2HD       LYS   4   8.211   6.178   1.736
  458   2HD   LYS   4          1HD       LYS   4   9.803   6.937   1.641
  459   1HE   LYS   4          2HE       LYS   4  10.827   4.916   2.542
  460   2HE   LYS   4          1HE       LYS   4   9.241   4.162   2.674
  461   1HZ   LYS   4          1HZ       LYS   4  10.215   3.369   0.695
  462   2HZ   LYS   4          2HZ       LYS   4  10.682   4.917   0.200
  463   3HZ   LYS   4          3HZ       LYS   4   9.045   4.492   0.214
  464    H    VAL   5           H        VAL   5   5.304   7.041   2.137
  465    HA   VAL   5           HA       VAL   5   3.951   6.874   4.715
  466    HB   VAL   5           HB       VAL   5   2.992   5.994   1.988
  467   1HG1  VAL   5          1HG1      VAL   5   0.951   6.545   3.963
  468   2HG1  VAL   5          2HG1      VAL   5   2.038   5.264   4.500
  469   3HG1  VAL   5          3HG1      VAL   5   1.191   5.114   2.960
  470   1HG2  VAL   5          1HG2      VAL   5   1.890   8.014   1.760
  471   2HG2  VAL   5          2HG2      VAL   5   3.416   8.502   2.496
  472   3HG2  VAL   5          3HG2      VAL   5   1.963   8.368   3.487
  473    H    ILE   6           H        ILE   6   4.057   5.183   5.954
  474    HA   ILE   6           HA       ILE   6   5.151   2.668   4.915
  475    HB   ILE   6           HB       ILE   6   4.926   3.733   7.731
  476   1HG1  ILE   6          2HG1      ILE   6   7.325   3.078   6.011
  477   2HG1  ILE   6          1HG1      ILE   6   6.727   4.696   6.351
  478   1HG2  ILE   6          1HG2      ILE   6   6.248   1.681   8.337
  479   2HG2  ILE   6          2HG2      ILE   6   5.824   1.037   6.752
  480   3HG2  ILE   6          3HG2      ILE   6   4.556   1.408   7.920
  481   1HD1  ILE   6          1HD1      ILE   6   7.068   3.949   8.841
  482   2HD1  ILE   6          2HD1      ILE   6   8.421   4.532   7.870
  483   3HD1  ILE   6          3HD1      ILE   6   8.189   2.801   8.108
  484    H    LEU   7           H        LEU   7   3.909   0.902   4.751
  485    HA   LEU   7           HA       LEU   7   1.202   1.009   5.906
  486   1HB   LEU   7          2HB       LEU   7   2.057  -0.844   3.699
  487   2HB   LEU   7          1HB       LEU   7   0.439  -0.299   4.106
  488    HG   LEU   7           HG       LEU   7   2.605   1.347   2.811
  489   1HD1  LEU   7          1HD1      LEU   7   1.543  -0.258   1.318
  490   2HD1  LEU   7          2HD1      LEU   7   1.076   1.392   0.910
  491   3HD1  LEU   7          3HD1      LEU   7  -0.046   0.349   1.782
  492   1HD2  LEU   7          1HD2      LEU   7  -0.194   2.132   3.614
  493   2HD2  LEU   7          2HD2      LEU   7   0.941   3.127   2.700
  494   3HD2  LEU   7          3HD2      LEU   7   1.296   2.694   4.370
  495    H    ASN   8           H        ASN   8   1.941   0.231   7.960
  496    HA   ASN   8           HA       ASN   8   3.138  -2.414   8.059
  497   1HB   ASN   8          2HB       ASN   8   2.376  -0.511  10.276
  498   2HB   ASN   8          1HB       ASN   8   3.204  -2.047  10.508
  499   1HD2  ASN   8          1HD2      ASN   8   3.714   1.093  10.528
  500   2HD2  ASN   8          2HD2      ASN   8   5.341   1.170   9.954
  501    H    GLY   9           H        GLY   9   1.846  -4.132   7.861
  502   1HA   GLY   9          2HA       GLY   9  -0.769  -4.042   9.236
  503   2HA   GLY   9          1HA       GLY   9  -0.482  -4.937   7.753
  504    H    LYS  10           H        LYS  10  -1.472  -6.649   9.173
  505    HA   LYS  10           HA       LYS  10   0.244  -7.765  11.213
  506   1HB   LYS  10          2HB       LYS  10  -2.288  -8.844   9.964
  507   2HB   LYS  10          1HB       LYS  10  -1.483  -9.524  11.371
  508   1HG   LYS  10          2HG       LYS  10  -1.865  -7.397  12.569
  509   2HG   LYS  10          1HG       LYS  10  -2.763  -6.805  11.172
  510   1HD   LYS  10          2HD       LYS  10  -3.476  -9.271  12.758
  511   2HD   LYS  10          1HD       LYS  10  -4.213  -7.686  12.983
  512   1HE   LYS  10          2HE       LYS  10  -5.694  -8.917  11.614
  513   2HE   LYS  10          1HE       LYS  10  -4.871  -7.779  10.549
  514   1HZ   LYS  10          1HZ       LYS  10  -3.493 -10.276  10.728
  515   2HZ   LYS  10          2HZ       LYS  10  -4.029  -9.440   9.360
  516   3HZ   LYS  10          3HZ       LYS  10  -5.082 -10.476  10.182
  517    H    THR  11           H        THR  11  -1.070  -8.974   8.129
  518    HA   THR  11           HA       THR  11   1.117 -10.897   7.955
  519    HB   THR  11           HB       THR  11  -0.354 -11.698   5.981
  520    HG1  THR  11           1HG      THR  11  -1.631  -9.667   6.168
  521   1HG2  THR  11          1HG2      THR  11  -2.092 -12.686   7.611
  522   2HG2  THR  11          2HG2      THR  11  -1.089 -11.949   8.860
  523   3HG2  THR  11          3HG2      THR  11  -0.398 -13.152   7.771
  524    H    LEU  12           H        LEU  12   0.533  -7.811   7.041
  525    HA   LEU  12           HA       LEU  12   2.296  -8.069   4.730
  526   1HB   LEU  12          2HB       LEU  12   0.023  -7.883   3.862
  527   2HB   LEU  12          1HB       LEU  12  -0.230  -6.422   4.799
  528    HG   LEU  12           HG       LEU  12   1.293  -5.191   3.449
  529   1HD1  LEU  12          1HD1      LEU  12   3.110  -6.277   2.759
  530   2HD1  LEU  12          2HD1      LEU  12   2.130  -6.827   1.399
  531   3HD1  LEU  12          3HD1      LEU  12   2.303  -7.836   2.829
  532   1HD2  LEU  12          1HD2      LEU  12  -1.044  -6.245   2.490
  533   2HD2  LEU  12          2HD2      LEU  12   0.103  -6.625   1.208
  534   3HD2  LEU  12          3HD2      LEU  12  -0.113  -4.955   1.733
  535    H    LYS  13           H        LYS  13   3.811  -6.536   4.543
  536    HA   LYS  13           HA       LYS  13   3.654  -4.101   6.142
  537   1HB   LYS  13          2HB       LYS  13   5.945  -6.068   6.358
  538   2HB   LYS  13          1HB       LYS  13   5.924  -4.458   7.064
  539   1HG   LYS  13          2HG       LYS  13   4.050  -5.091   8.485
  540   2HG   LYS  13          1HG       LYS  13   4.039  -6.701   7.763
  541   1HD   LYS  13          2HD       LYS  13   6.330  -5.483   9.302
  542   2HD   LYS  13          1HD       LYS  13   5.188  -6.672   9.933
  543   1HE   LYS  13          2HE       LYS  13   7.081  -7.077   7.619
  544   2HE   LYS  13          1HE       LYS  13   7.278  -7.730   9.245
  545   1HZ   LYS  13          1HZ       LYS  13   5.151  -8.926   8.912
  546   2HZ   LYS  13          2HZ       LYS  13   6.372  -9.418   7.848
  547   3HZ   LYS  13          3HZ       LYS  13   5.137  -8.401   7.302
  548    H    GLY  14           H        GLY  14   4.879  -2.396   5.281
  549   1HA   GLY  14          2HA       GLY  14   6.896  -2.698   3.347
  550   2HA   GLY  14          1HA       GLY  14   5.363  -2.508   2.516
  551    H    GLU  15           H        GLU  15   6.567  -0.623   1.662
  552    HA   GLU  15           HA       GLU  15   5.823   1.728   3.197
  553   1HB   GLU  15          2HB       GLU  15   8.627   1.392   2.121
  554   2HB   GLU  15          1HB       GLU  15   7.987   2.797   2.959
  555   1HG   GLU  15          2HG       GLU  15   7.696   1.457   4.982
  556   2HG   GLU  15          1HG       GLU  15   8.353   0.055   4.140
  557    H    THR  16           H        THR  16   5.722   3.649   1.918
  558    HA   THR  16           HA       THR  16   6.061   3.433  -0.944
  559    HB   THR  16           HB       THR  16   3.898   2.604  -1.009
  560    HG1  THR  16           1HG      THR  16   3.414   5.370  -0.933
  561   1HG2  THR  16          1HG2      THR  16   3.384   4.243   1.418
  562   2HG2  THR  16          2HG2      THR  16   3.056   2.538   1.120
  563   3HG2  THR  16          3HG2      THR  16   2.042   3.776   0.378
  564    H    THR  17           H        THR  17   5.422   5.593  -2.025
  565    HA   THR  17           HA       THR  17   5.720   7.850  -0.187
  566    HB   THR  17           HB       THR  17   7.512   8.812  -1.628
  567    HG1  THR  17           1HG      THR  17   8.554   7.456  -3.071
  568   1HG2  THR  17          1HG2      THR  17   8.072   6.207  -0.253
  569   2HG2  THR  17          2HG2      THR  17   8.291   7.842   0.370
  570   3HG2  THR  17          3HG2      THR  17   9.335   7.242  -0.920
  571    H    THR  18           H        THR  18   4.239   9.285  -0.623
  572    HA   THR  18           HA       THR  18   3.230   9.617  -3.388
  573    HB   THR  18           HB       THR  18   1.548   9.032  -1.652
  574    HG1  THR  18           1HG      THR  18   1.011  10.392  -3.446
  575   1HG2  THR  18          1HG2      THR  18   2.888  10.974  -0.092
  576   2HG2  THR  18          2HG2      THR  18   1.516   9.957   0.350
  577   3HG2  THR  18          3HG2      THR  18   1.243  11.540  -0.378
  578    H    GLU  19           H        GLU  19   3.227  11.665  -4.322
  579    HA   GLU  19           HA       GLU  19   4.879  13.672  -2.941
  580   1HB   GLU  19          2HB       GLU  19   5.746  12.908  -5.101
  581   2HB   GLU  19          1HB       GLU  19   4.238  13.364  -5.883
  582   1HG   GLU  19          2HG       GLU  19   4.655  15.704  -5.324
  583   2HG   GLU  19          1HG       GLU  19   6.168  15.246  -4.540
  584    H    ALA  20           H        ALA  20   3.761  15.276  -1.986
  585    HA   ALA  20           HA       ALA  20   1.600  16.540  -3.464
  586   1HB   ALA  20          1HB       ALA  20  -0.105  16.113  -2.015
  587   2HB   ALA  20          2HB       ALA  20   0.974  15.867  -0.640
  588   3HB   ALA  20          3HB       ALA  20   0.807  14.611  -1.866
  589    H    VAL  21           H        VAL  21   1.044  18.592  -2.748
  590    HA   VAL  21           HA       VAL  21   3.074  20.289  -2.017
  591    HB   VAL  21           HB       VAL  21   0.174  20.822  -1.389
  592   1HG1  VAL  21          1HG1      VAL  21   1.266  22.646  -0.561
  593   2HG1  VAL  21          2HG1      VAL  21   1.065  23.155  -2.237
  594   3HG1  VAL  21          3HG1      VAL  21   2.608  22.499  -1.694
  595   1HG2  VAL  21          1HG2      VAL  21   0.318  21.888  -3.766
  596   2HG2  VAL  21          2HG2      VAL  21   0.001  20.161  -3.587
  597   3HG2  VAL  21          3HG2      VAL  21   1.622  20.723  -3.996
  598    H    ASP  22           H        ASP  22   0.764  18.692   0.112
  599    HA   ASP  22           HA       ASP  22   2.503  19.332   2.371
  600   1HB   ASP  22          2HB       ASP  22   0.693  20.114   3.788
  601   2HB   ASP  22          1HB       ASP  22   0.790  21.114   2.342
  602    H    ALA  23           H        ALA  23   1.758  18.133   4.402
  603    HA   ALA  23           HA       ALA  23   1.759  15.406   3.890
  604   1HB   ALA  23          1HB       ALA  23   1.967  17.025   6.142
  605   2HB   ALA  23          2HB       ALA  23   2.158  15.274   6.073
  606   3HB   ALA  23          3HB       ALA  23   0.589  15.974   6.465
  607    H    ALA  24           H        ALA  24  -0.960  17.536   4.637
  608    HA   ALA  24           HA       ALA  24  -2.908  15.502   4.834
  609   1HB   ALA  24          1HB       ALA  24  -4.329  17.647   3.923
  610   2HB   ALA  24          2HB       ALA  24  -2.901  18.430   4.600
  611   3HB   ALA  24          3HB       ALA  24  -3.890  17.375   5.609
  612    H    THR  25           H        THR  25  -2.083  17.655   2.099
  613    HA   THR  25           HA       THR  25  -3.762  16.543   0.202
  614    HB   THR  25           HB       THR  25  -2.126  17.397  -1.459
  615    HG1  THR  25           1HG      THR  25  -0.150  17.759  -0.948
  616   1HG2  THR  25          1HG2      THR  25  -3.030  19.084   0.787
  617   2HG2  THR  25          2HG2      THR  25  -3.395  19.193  -0.936
  618   3HG2  THR  25          3HG2      THR  25  -1.844  19.765  -0.325
  619    H    ALA  26           H        ALA  26  -0.469  15.640   1.138
  620    HA   ALA  26           HA       ALA  26  -0.150  13.503  -0.664
  621   1HB   ALA  26          1HB       ALA  26   1.870  13.909   0.275
  622   2HB   ALA  26          2HB       ALA  26   1.340  12.701   1.447
  623   3HB   ALA  26          3HB       ALA  26   1.169  14.418   1.812
  624    H    GLU  27           H        GLU  27  -1.216  13.552   2.747
  625    HA   GLU  27           HA       GLU  27  -1.777  10.879   3.074
  626   1HB   GLU  27          2HB       GLU  27  -1.828  12.509   4.900
  627   2HB   GLU  27          1HB       GLU  27  -3.264  13.252   4.208
  628   1HG   GLU  27          2HG       GLU  27  -4.516  11.194   4.579
  629   2HG   GLU  27          1HG       GLU  27  -3.077  10.438   5.262
  630    H    LYS  28           H        LYS  28  -3.936  13.445   1.877
  631    HA   LYS  28           HA       LYS  28  -6.212  11.872   1.493
  632   1HB   LYS  28          2HB       LYS  28  -5.279  14.302  -0.044
  633   2HB   LYS  28          1HB       LYS  28  -6.889  13.607  -0.162
  634   1HG   LYS  28          2HG       LYS  28  -5.637  14.802   2.301
  635   2HG   LYS  28          1HG       LYS  28  -6.907  15.520   1.307
  636   1HD   LYS  28          2HD       LYS  28  -8.389  13.652   1.863
  637   2HD   LYS  28          1HD       LYS  28  -7.119  12.945   2.865
  638   1HE   LYS  28          2HE       LYS  28  -8.754  14.157   4.221
  639   2HE   LYS  28          1HE       LYS  28  -7.159  14.900   4.319
  640   1HZ   LYS  28          1HZ       LYS  28  -8.000  16.797   3.586
  641   2HZ   LYS  28          2HZ       LYS  28  -9.547  16.116   3.615
  642   3HZ   LYS  28          3HZ       LYS  28  -8.623  16.055   2.199
  643    H    VAL  29           H        VAL  29  -3.425  12.449  -0.572
  644    HA   VAL  29           HA       VAL  29  -4.376  11.229  -2.906
  645    HB   VAL  29           HB       VAL  29  -1.536  11.357  -1.874
  646   1HG1  VAL  29          1HG1      VAL  29  -0.958  11.153  -4.308
  647   2HG1  VAL  29          2HG1      VAL  29  -2.639  10.698  -4.593
  648   3HG1  VAL  29          3HG1      VAL  29  -1.615   9.694  -3.566
  649   1HG2  VAL  29          1HG2      VAL  29  -1.422  13.482  -2.559
  650   2HG2  VAL  29          2HG2      VAL  29  -3.185  13.446  -2.563
  651   3HG2  VAL  29          3HG2      VAL  29  -2.294  13.138  -4.053
  652    H    VAL  30           H        VAL  30  -2.879   9.906  -0.019
  653    HA   VAL  30           HA       VAL  30  -2.519   7.272  -1.004
  654    HB   VAL  30           HB       VAL  30  -3.000   8.056   1.870
  655   1HG1  VAL  30          1HG1      VAL  30  -2.018   6.048   2.469
  656   2HG1  VAL  30          2HG1      VAL  30  -1.191   5.874   0.922
  657   3HG1  VAL  30          3HG1      VAL  30  -2.929   5.597   1.027
  658   1HG2  VAL  30          1HG2      VAL  30  -0.455   8.134   1.954
  659   2HG2  VAL  30          2HG2      VAL  30  -1.273   9.498   1.191
  660   3HG2  VAL  30          3HG2      VAL  30  -0.516   8.255   0.195
  661    H    LYS  31           H        LYS  31  -5.097   8.804   0.957
  662    HA   LYS  31           HA       LYS  31  -6.772   6.663   1.330
  663   1HB   LYS  31          2HB       LYS  31  -7.347   9.573   0.879
  664   2HB   LYS  31          1HB       LYS  31  -8.666   8.425   1.061
  665   1HG   LYS  31          2HG       LYS  31  -8.189   9.480   3.171
  666   2HG   LYS  31          1HG       LYS  31  -7.775   7.769   3.251
  667   1HD   LYS  31          2HD       LYS  31  -5.410   8.371   2.829
  668   2HD   LYS  31          1HD       LYS  31  -5.869  10.074   2.876
  669   1HE   LYS  31          2HE       LYS  31  -6.231   8.103   5.130
  670   2HE   LYS  31          1HE       LYS  31  -4.935   9.293   5.015
  671   1HZ   LYS  31          1HZ       LYS  31  -7.447   9.645   6.119
  672   2HZ   LYS  31          2HZ       LYS  31  -7.448  10.553   4.691
  673   3HZ   LYS  31          3HZ       LYS  31  -6.262  10.828   5.866
  674    H    GLN  32           H        GLN  32  -6.468   8.720  -1.513
  675    HA   GLN  32           HA       GLN  32  -8.526   7.411  -3.005
  676   1HB   GLN  32          2HB       GLN  32  -7.739   9.698  -3.547
  677   2HB   GLN  32          1HB       GLN  32  -6.171   9.042  -3.994
  678   1HG   GLN  32          2HG       GLN  32  -7.427   9.476  -5.978
  679   2HG   GLN  32          1HG       GLN  32  -7.256   7.736  -5.778
  680   1HE2  GLN  32          1HE2      GLN  32  -9.505   8.957  -3.579
  681   2HE2  GLN  32          2HE2      GLN  32 -10.936   8.594  -4.468
  682    H    PHE  33           H        PHE  33  -5.069   7.060  -2.628
  683    HA   PHE  33           HA       PHE  33  -4.473   5.247  -4.643
  684   1HB   PHE  33          2HB       PHE  33  -2.853   6.424  -3.096
  685   2HB   PHE  33          1HB       PHE  33  -3.281   5.252  -1.858
  686    HD1  PHE  33           1HD      PHE  33  -2.044   5.418  -5.360
  687    HD2  PHE  33           2HD      PHE  33  -1.985   3.338  -1.632
  688    HE1  PHE  33           1HE      PHE  33  -0.316   3.896  -6.229
  689    HE2  PHE  33           2HE      PHE  33  -0.253   1.824  -2.509
  690    HZ   PHE  33           HZ       PHE  33   0.580   2.105  -4.811
  691    H    PHE  34           H        PHE  34  -5.269   4.543  -1.256
  692    HA   PHE  34           HA       PHE  34  -5.550   1.734  -1.703
  693   1HB   PHE  34          2HB       PHE  34  -6.345   3.444   0.652
  694   2HB   PHE  34          1HB       PHE  34  -6.384   1.679   0.632
  695    HD1  PHE  34           1HD      PHE  34  -3.950   1.037  -0.831
  696    HD2  PHE  34           2HD      PHE  34  -4.647   3.988   2.154
  697    HE1  PHE  34           1HE      PHE  34  -1.569   0.985  -0.233
  698    HE2  PHE  34           2HE      PHE  34  -2.262   3.936   2.762
  699    HZ   PHE  34           HZ       PHE  34  -0.729   2.434   1.556
  700    H    ASN  35           H        ASN  35  -7.836   4.397  -1.327
  701    HA   ASN  35           HA       ASN  35 -10.230   3.040  -1.220
  702   1HB   ASN  35          2HB       ASN  35 -10.136   5.458  -1.076
  703   2HB   ASN  35          1HB       ASN  35  -9.549   5.574  -2.731
  704   1HD2  ASN  35          1HD2      ASN  35 -12.135   6.067  -0.908
  705   2HD2  ASN  35          2HD2      ASN  35 -13.399   5.789  -2.050
  706    H    ASP  36           H        ASP  36  -8.174   3.700  -3.954
  707    HA   ASP  36           HA       ASP  36  -9.984   2.321  -5.786
  708   1HB   ASP  36          2HB       ASP  36  -7.421   3.833  -6.322
  709   2HB   ASP  36          1HB       ASP  36  -8.441   3.107  -7.561
  710    H    ASN  37           H        ASN  37  -7.013   1.697  -4.064
  711    HA   ASN  37           HA       ASN  37  -6.219  -0.449  -5.831
  712   1HB   ASN  37          2HB       ASN  37  -5.270   0.325  -3.061
  713   2HB   ASN  37          1HB       ASN  37  -4.626  -1.043  -3.959
  714   1HD2  ASN  37          1HD2      ASN  37  -3.489   1.582  -2.990
  715   2HD2  ASN  37          2HD2      ASN  37  -2.724   2.244  -4.393
  716    H    GLY  38           H        GLY  38  -7.678  -0.105  -2.656
  717   1HA   GLY  38          2HA       GLY  38  -8.180  -2.111  -1.310
  718   2HA   GLY  38          1HA       GLY  38  -9.604  -1.457  -2.085
  719    H    VAL  39           H        VAL  39 -10.864  -2.945  -2.842
  720    HA   VAL  39           HA       VAL  39  -9.708  -5.511  -3.710
  721    HB   VAL  39           HB       VAL  39 -12.503  -4.903  -2.800
  722   1HG1  VAL  39          1HG1      VAL  39 -11.185  -7.315  -3.859
  723   2HG1  VAL  39          2HG1      VAL  39 -12.888  -6.854  -3.871
  724   3HG1  VAL  39          3HG1      VAL  39 -12.176  -7.561  -2.420
  725   1HG2  VAL  39          1HG2      VAL  39 -11.462  -6.484  -0.868
  726   2HG2  VAL  39          2HG2      VAL  39 -11.501  -4.722  -0.794
  727   3HG2  VAL  39          3HG2      VAL  39 -10.040  -5.551  -1.332
  728    H    ASP  40           H        ASP  40 -10.814  -2.807  -5.245
  729    HA   ASP  40           HA       ASP  40 -11.993  -4.435  -7.391
  730   1HB   ASP  40          2HB       ASP  40 -12.781  -1.632  -6.584
  731   2HB   ASP  40          1HB       ASP  40 -13.413  -2.503  -7.978
  732    H    GLY  41           H        GLY  41  -9.221  -3.099  -6.736
  733   1HA   GLY  41          2HA       GLY  41  -8.907  -1.325  -9.006
  734   2HA   GLY  41          1HA       GLY  41  -7.656  -1.797  -7.869
  735    H    GLU  42           H        GLU  42  -6.737  -1.717 -10.269
  736    HA   GLU  42           HA       GLU  42  -7.028  -4.337 -11.550
  737   1HB   GLU  42          2HB       GLU  42  -5.572  -1.851 -12.477
  738   2HB   GLU  42          1HB       GLU  42  -5.735  -3.338 -13.401
  739   1HG   GLU  42          2HG       GLU  42  -8.157  -3.043 -13.455
  740   2HG   GLU  42          1HG       GLU  42  -7.996  -1.556 -12.525
  741    H    TRP  43           H        TRP  43  -5.820  -5.782 -10.435
  742    HA   TRP  43           HA       TRP  43  -3.122  -5.052  -9.596
  743   1HB   TRP  43          2HB       TRP  43  -4.778  -7.513  -9.033
  744   2HB   TRP  43          1HB       TRP  43  -3.185  -7.186  -8.360
  745    HD1  TRP  43           HD       TRP  43  -6.115  -4.649  -8.556
  746    HE1  TRP  43           1HE      TRP  43  -6.680  -3.929  -6.145
  747    HE3  TRP  43           3HE      TRP  43  -2.947  -7.745  -6.019
  748    HZ2  TRP  43           2HZ      TRP  43  -5.887  -4.589  -3.527
  749    HZ3  TRP  43           3HZ      TRP  43  -2.911  -7.643  -3.568
  750    HH2  TRP  43           HH       TRP  43  -4.359  -6.096  -2.345
  751    H    THR  44           H        THR  44  -1.443  -5.493 -10.849
  752    HA   THR  44           HA       THR  44  -1.623  -7.713 -12.767
  753    HB   THR  44           HB       THR  44   0.327  -6.618 -13.872
  754    HG1  THR  44           1HG      THR  44  -0.164  -4.521 -12.030
  755   1HG2  THR  44          1HG2      THR  44  -0.850  -5.009 -15.011
  756   2HG2  THR  44          2HG2      THR  44  -1.737  -4.489 -13.578
  757   3HG2  THR  44          3HG2      THR  44  -2.143  -6.017 -14.361
  758    H    TYR  45           H        TYR  45  -0.323  -9.466 -12.531
  759    HA   TYR  45           HA       TYR  45   1.575  -9.417 -10.286
  760   1HB   TYR  45          2HB       TYR  45  -0.308 -11.016 -10.115
  761   2HB   TYR  45          1HB       TYR  45   0.236 -11.793 -11.595
  762    HD1  TYR  45           1HD      TYR  45   2.439 -10.569  -8.878
  763    HD2  TYR  45           2HD      TYR  45   0.673 -13.956 -10.749
  764    HE1  TYR  45           1HE      TYR  45   3.891 -12.048  -7.555
  765    HE2  TYR  45           2HE      TYR  45   2.119 -15.445  -9.430
  766    HH   TYR  45           HH       TYR  45   4.449 -15.191  -8.263
  767    H    ASP  46           H        ASP  46   3.658 -10.184 -10.514
  768    HA   ASP  46           HA       ASP  46   4.529 -10.776 -13.266
  769   1HB   ASP  46          2HB       ASP  46   5.241  -8.522 -12.587
  770   2HB   ASP  46          1HB       ASP  46   6.030  -9.196 -11.164
  771    H    ASP  47           H        ASP  47   4.338 -13.016 -12.784
  772    HA   ASP  47           HA       ASP  47   5.368 -14.440 -10.688
  773   1HB   ASP  47          2HB       ASP  47   5.469 -15.269 -13.596
  774   2HB   ASP  47          1HB       ASP  47   5.541 -16.351 -12.208
  775    H    ALA  48           H        ALA  48   7.124 -13.175 -13.469
  776    HA   ALA  48           HA       ALA  48   9.518 -14.484 -13.285
  777   1HB   ALA  48          1HB       ALA  48  10.308 -11.918 -13.890
  778   2HB   ALA  48          2HB       ALA  48   8.610 -11.945 -14.370
  779   3HB   ALA  48          3HB       ALA  48   9.735 -13.128 -15.039
  780    H    THR  49           H        THR  49   8.342 -11.935 -11.175
  781    HA   THR  49           HA       THR  49  10.776 -12.288  -9.555
  782    HB   THR  49           HB       THR  49  10.629  -9.906  -8.913
  783    HG1  THR  49           1HG      THR  49   8.335  -9.756  -9.488
  784   1HG2  THR  49          1HG2      THR  49  11.571 -10.889 -11.341
  785   2HG2  THR  49          2HG2      THR  49  12.001  -9.369 -10.555
  786   3HG2  THR  49          3HG2      THR  49  10.692  -9.412 -11.736
  787    H    LYS  50           H        LYS  50   7.799 -13.237  -9.509
  788    HA   LYS  50           HA       LYS  50   6.153 -13.591  -7.940
  789   1HB   LYS  50          2HB       LYS  50   8.549 -13.385  -6.103
  790   2HB   LYS  50          1HB       LYS  50   6.990 -14.062  -5.657
  791   1HG   LYS  50          2HG       LYS  50   8.780 -15.142  -7.822
  792   2HG   LYS  50          1HG       LYS  50   8.675 -15.776  -6.179
  793   1HD   LYS  50          2HD       LYS  50   6.401 -15.636  -8.157
  794   2HD   LYS  50          1HD       LYS  50   7.323 -17.085  -7.752
  795   1HE   LYS  50          2HE       LYS  50   6.580 -16.882  -5.419
  796   2HE   LYS  50          1HE       LYS  50   5.627 -15.466  -5.856
  797   1HZ   LYS  50          1HZ       LYS  50   5.202 -18.000  -7.288
  798   2HZ   LYS  50          2HZ       LYS  50   4.122 -16.726  -7.022
  799   3HZ   LYS  50          3HZ       LYS  50   4.512 -17.781  -5.758
  800    H    THR  51           H        THR  51   6.594 -10.864  -8.730
  801    HA   THR  51           HA       THR  51   5.931  -9.435  -6.249
  802    HB   THR  51           HB       THR  51   7.079  -8.370  -8.834
  803    HG1  THR  51           1HG      THR  51   8.492  -9.588  -7.401
  804   1HG2  THR  51          1HG2      THR  51   5.587  -6.872  -7.192
  805   2HG2  THR  51          2HG2      THR  51   6.978  -6.257  -8.084
  806   3HG2  THR  51          3HG2      THR  51   7.153  -6.729  -6.394
  807    H    PHE  52           H        PHE  52   4.139  -8.169  -6.119
  808    HA   PHE  52           HA       PHE  52   2.197  -8.435  -8.313
  809   1HB   PHE  52          2HB       PHE  52   1.778  -7.889  -5.364
  810   2HB   PHE  52          1HB       PHE  52   0.491  -7.907  -6.565
  811    HD1  PHE  52           1HD      PHE  52  -0.008 -10.044  -7.776
  812    HD2  PHE  52           2HD      PHE  52   2.572  -9.876  -4.394
  813    HE1  PHE  52           1HE      PHE  52  -0.281 -12.468  -7.451
  814    HE2  PHE  52           2HE      PHE  52   2.302 -12.300  -4.064
  815    HZ   PHE  52           HZ       PHE  52   0.876 -13.597  -5.594
  816    H    THR  53           H        THR  53   1.830  -6.694  -9.484
  817    HA   THR  53           HA       THR  53   2.478  -4.063  -8.351
  818    HB   THR  53           HB       THR  53   2.350  -3.376 -10.860
  819    HG1  THR  53           1HG      THR  53   2.382  -4.928 -12.270
  820   1HG2  THR  53          1HG2      THR  53   4.730  -4.240 -11.210
  821   2HG2  THR  53          2HG2      THR  53   4.594  -4.860  -9.564
  822   3HG2  THR  53          3HG2      THR  53   4.426  -3.129  -9.873
  823    H    VAL  54           H        VAL  54   0.978  -2.654  -7.966
  824    HA   VAL  54           HA       VAL  54  -1.714  -3.088  -9.085
  825    HB   VAL  54           HB       VAL  54  -0.996  -1.735  -6.469
  826   1HG1  VAL  54          1HG1      VAL  54  -3.527  -2.008  -6.137
  827   2HG1  VAL  54          2HG1      VAL  54  -3.597  -2.218  -7.887
  828   3HG1  VAL  54          3HG1      VAL  54  -2.968  -0.719  -7.203
  829   1HG2  VAL  54          1HG2      VAL  54  -2.498  -3.847  -5.759
  830   2HG2  VAL  54          2HG2      VAL  54  -0.736  -3.886  -5.826
  831   3HG2  VAL  54          3HG2      VAL  54  -1.684  -4.519  -7.172
  832    H    THR  55           H        THR  55  -2.101  -1.677 -10.659
  833    HA   THR  55           HA       THR  55  -0.792   0.938 -10.560
  834    HB   THR  55           HB       THR  55  -2.303  -0.240 -12.887
  835    HG1  THR  55           1HG      THR  55  -0.223  -0.862 -13.628
  836   1HG2  THR  55          1HG2      THR  55  -0.697   1.225 -14.161
  837   2HG2  THR  55          2HG2      THR  55  -0.312   1.991 -12.617
  838   3HG2  THR  55          3HG2      THR  55  -1.958   2.061 -13.253
  839    H    GLU  56           H        GLU  56  -1.883   2.543  -9.698
  840    HA   GLU  56           HA       GLU  56  -4.564   2.588  -9.037
  841   1HB   GLU  56          2HB       GLU  56  -2.950   4.137  -8.080
  842   2HB   GLU  56          1HB       GLU  56  -2.719   4.906  -9.646
  843   1HG   GLU  56          2HG       GLU  56  -4.128   6.253  -8.201
  844   2HG   GLU  56          1HG       GLU  56  -5.020   5.693  -9.616
  Start of MODEL   17
    1   1H    MET   1          1HT       MET   1   5.794 -18.567   3.088
    2   2H    MET   1          2HT       MET   1   6.465 -19.950   2.385
    3   3H    MET   1          3HT       MET   1   5.132 -19.199   1.665
    4    HA   MET   1           HA       MET   1   7.941 -18.333   1.734
    5   1HB   MET   1          2HB       MET   1   7.126 -19.650  -0.162
    6   2HB   MET   1          1HB       MET   1   5.815 -18.507  -0.415
    7   1HG   MET   1          2HG       MET   1   7.435 -16.762  -0.951
    8   2HG   MET   1          1HG       MET   1   8.751 -17.908  -0.697
    9   1HE   MET   1          1HE       MET   1   8.249 -16.209  -3.597
   10   2HE   MET   1          2HE       MET   1   8.953 -17.537  -4.520
   11   3HE   MET   1          3HE       MET   1   9.623 -17.105  -2.947
   12    H    GLN   2           H        GLN   2   8.387 -16.178   0.877
   13    HA   GLN   2           HA       GLN   2   6.406 -14.223   1.826
   14   1HB   GLN   2          2HB       GLN   2   8.573 -14.143   2.972
   15   2HB   GLN   2          1HB       GLN   2   9.392 -13.932   1.431
   16   1HG   GLN   2          2HG       GLN   2   8.250 -11.797   1.116
   17   2HG   GLN   2          1HG       GLN   2   7.437 -12.007   2.663
   18   1HE2  GLN   2          1HE2      GLN   2  10.441 -13.290   3.066
   19   2HE2  GLN   2          2HE2      GLN   2  11.264 -11.903   3.681
   20    H    TYR   3           H        TYR   3   5.797 -12.494   0.525
   21    HA   TYR   3           HA       TYR   3   6.825 -12.506  -2.230
   22   1HB   TYR   3          2HB       TYR   3   3.912 -12.325  -1.432
   23   2HB   TYR   3          1HB       TYR   3   4.533 -12.148  -3.070
   24    HD1  TYR   3           1HD      TYR   3   4.454 -14.001  -4.442
   25    HD2  TYR   3           2HD      TYR   3   4.681 -14.584  -0.234
   26    HE1  TYR   3           1HE      TYR   3   4.273 -16.431  -4.776
   27    HE2  TYR   3           2HE      TYR   3   4.501 -17.015  -0.556
   28    HH   TYR   3           HH       TYR   3   3.619 -18.415  -3.544
   29    H    LYS   4           H        LYS   4   6.797 -10.513  -3.301
   30    HA   LYS   4           HA       LYS   4   6.466  -8.208  -1.500
   31   1HB   LYS   4          2HB       LYS   4   8.747  -8.561  -2.400
   32   2HB   LYS   4          1HB       LYS   4   8.110  -8.414  -4.032
   33   1HG   LYS   4          2HG       LYS   4   7.479  -6.117  -3.616
   34   2HG   LYS   4          1HG       LYS   4   8.000  -6.255  -1.936
   35   1HD   LYS   4          2HD       LYS   4   9.699  -5.123  -3.251
   36   2HD   LYS   4          1HD       LYS   4  10.297  -6.689  -2.699
   37   1HE   LYS   4          2HE       LYS   4  10.936  -6.365  -4.997
   38   2HE   LYS   4          1HE       LYS   4   9.722  -7.641  -4.910
   39   1HZ   LYS   4          1HZ       LYS   4   8.059  -5.835  -5.445
   40   2HZ   LYS   4          2HZ       LYS   4   9.102  -6.283  -6.699
   41   3HZ   LYS   4          3HZ       LYS   4   9.378  -4.852  -5.841
   42    H    VAL   5           H        VAL   5   5.541  -6.254  -2.390
   43    HA   VAL   5           HA       VAL   5   3.956  -6.663  -4.820
   44    HB   VAL   5           HB       VAL   5   2.817  -5.570  -2.243
   45   1HG1  VAL   5          1HG1      VAL   5   1.926  -4.545  -4.326
   46   2HG1  VAL   5          2HG1      VAL   5   0.717  -5.432  -3.397
   47   3HG1  VAL   5          3HG1      VAL   5   1.416  -6.151  -4.849
   48   1HG2  VAL   5          1HG2      VAL   5   2.345  -8.194  -3.652
   49   2HG2  VAL   5          2HG2      VAL   5   1.392  -7.593  -2.294
   50   3HG2  VAL   5          3HG2      VAL   5   3.104  -7.958  -2.078
   51    H    ILE   6           H        ILE   6   4.039  -5.015  -6.160
   52    HA   ILE   6           HA       ILE   6   5.278  -2.524  -5.275
   53    HB   ILE   6           HB       ILE   6   4.707  -3.623  -8.030
   54   1HG1  ILE   6          2HG1      ILE   6   7.299  -3.030  -6.586
   55   2HG1  ILE   6          1HG1      ILE   6   6.608  -4.628  -6.832
   56   1HG2  ILE   6          1HG2      ILE   6   6.343  -1.493  -8.452
   57   2HG2  ILE   6          2HG2      ILE   6   5.297  -0.886  -7.169
   58   3HG2  ILE   6          3HG2      ILE   6   4.594  -1.481  -8.672
   59   1HD1  ILE   6          1HD1      ILE   6   8.404  -3.299  -8.479
   60   2HD1  ILE   6          2HD1      ILE   6   6.863  -3.230  -9.333
   61   3HD1  ILE   6          3HD1      ILE   6   7.528  -4.787  -8.837
   62    H    LEU   7           H        LEU   7   3.958  -0.970  -4.614
   63    HA   LEU   7           HA       LEU   7   1.220  -0.858  -5.630
   64   1HB   LEU   7          2HB       LEU   7   2.367   0.976  -3.543
   65   2HB   LEU   7          1HB       LEU   7   0.702   0.467  -3.760
   66    HG   LEU   7           HG       LEU   7   2.961  -1.199  -2.669
   67   1HD1  LEU   7          1HD1      LEU   7   0.412  -0.589  -1.252
   68   2HD1  LEU   7          2HD1      LEU   7   1.686   0.628  -1.302
   69   3HD1  LEU   7          3HD1      LEU   7   2.006  -0.956  -0.597
   70   1HD2  LEU   7          1HD2      LEU   7   0.099  -1.954  -3.249
   71   2HD2  LEU   7          2HD2      LEU   7   1.250  -2.937  -2.339
   72   3HD2  LEU   7          3HD2      LEU   7   1.539  -2.591  -4.043
   73    H    ASN   8           H        ASN   8   1.737  -0.128  -7.733
   74    HA   ASN   8           HA       ASN   8   3.092   2.428  -8.011
   75   1HB   ASN   8          2HB       ASN   8   3.613   0.430  -9.447
   76   2HB   ASN   8          1HB       ASN   8   2.016   0.609 -10.165
   77   1HD2  ASN   8          1HD2      ASN   8   5.063   1.073 -10.827
   78   2HD2  ASN   8          2HD2      ASN   8   5.000   2.513 -11.782
   79    H    GLY   9           H        GLY   9   1.812   4.173  -7.673
   80   1HA   GLY   9          2HA       GLY   9  -0.834   4.154  -8.980
   81   2HA   GLY   9          1HA       GLY   9  -0.473   5.056  -7.517
   82    H    LYS  10           H        LYS  10  -1.488   6.734  -8.945
   83    HA   LYS  10           HA       LYS  10   0.067   7.806 -11.090
   84   1HB   LYS  10          2HB       LYS  10  -2.203   9.073  -9.542
   85   2HB   LYS  10          1HB       LYS  10  -1.586   9.594 -11.104
   86   1HG   LYS  10          2HG       LYS  10  -2.408   7.652 -12.180
   87   2HG   LYS  10          1HG       LYS  10  -2.765   6.870 -10.641
   88   1HD   LYS  10          2HD       LYS  10  -4.818   7.660 -11.627
   89   2HD   LYS  10          1HD       LYS  10  -4.460   8.616 -10.190
   90   1HE   LYS  10          2HE       LYS  10  -3.777   9.479 -12.994
   91   2HE   LYS  10          1HE       LYS  10  -5.269   9.923 -12.170
   92   1HZ   LYS  10          1HZ       LYS  10  -4.118  11.665 -11.440
   93   2HZ   LYS  10          2HZ       LYS  10  -2.625  10.997 -11.865
   94   3HZ   LYS  10          3HZ       LYS  10  -3.340  10.597 -10.384
   95    H    THR  11           H        THR  11  -0.783   9.012  -7.842
   96    HA   THR  11           HA       THR  11   1.551  10.778  -7.916
   97    HB   THR  11           HB       THR  11   0.275  11.767  -5.879
   98    HG1  THR  11           1HG      THR  11  -1.220   9.896  -5.954
   99   1HG2  THR  11          1HG2      THR  11   0.282  12.479  -8.503
  100   2HG2  THR  11          2HG2      THR  11  -0.483  13.393  -7.203
  101   3HG2  THR  11          3HG2      THR  11  -1.440  12.279  -8.179
  102    H    LEU  12           H        LEU  12   0.928   7.774  -6.943
  103    HA   LEU  12           HA       LEU  12   2.705   8.030  -4.637
  104   1HB   LEU  12          2HB       LEU  12   0.450   7.886  -3.741
  105   2HB   LEU  12          1HB       LEU  12   0.147   6.436  -4.678
  106    HG   LEU  12           HG       LEU  12   1.702   5.178  -3.356
  107   1HD1  LEU  12          1HD1      LEU  12   2.460   6.850  -1.272
  108   2HD1  LEU  12          2HD1      LEU  12   2.713   7.802  -2.733
  109   3HD1  LEU  12          3HD1      LEU  12   3.486   6.232  -2.567
  110   1HD2  LEU  12          1HD2      LEU  12   0.222   4.880  -1.720
  111   2HD2  LEU  12          2HD2      LEU  12  -0.653   6.262  -2.381
  112   3HD2  LEU  12          3HD2      LEU  12   0.506   6.495  -1.072
  113    H    LYS  13           H        LYS  13   4.187   6.465  -4.411
  114    HA   LYS  13           HA       LYS  13   3.991   4.020  -5.990
  115   1HB   LYS  13          2HB       LYS  13   6.316   5.936  -6.211
  116   2HB   LYS  13          1HB       LYS  13   6.268   4.325  -6.911
  117   1HG   LYS  13          2HG       LYS  13   4.342   5.021  -8.290
  118   2HG   LYS  13          1HG       LYS  13   4.496   6.651  -7.633
  119   1HD   LYS  13          2HD       LYS  13   6.675   5.205  -9.137
  120   2HD   LYS  13          1HD       LYS  13   5.551   6.350  -9.871
  121   1HE   LYS  13          2HE       LYS  13   7.537   7.554  -9.408
  122   2HE   LYS  13          1HE       LYS  13   6.358   8.045  -8.193
  123   1HZ   LYS  13          1HZ       LYS  13   7.644   7.278  -6.567
  124   2HZ   LYS  13          2HZ       LYS  13   8.886   7.163  -7.708
  125   3HZ   LYS  13          3HZ       LYS  13   7.938   5.808  -7.354
  126    H    GLY  14           H        GLY  14   5.215   2.301  -5.150
  127   1HA   GLY  14          2HA       GLY  14   7.242   2.537  -3.233
  128   2HA   GLY  14          1HA       GLY  14   5.716   2.400  -2.377
  129    H    GLU  15           H        GLU  15   6.838   0.466  -1.534
  130    HA   GLU  15           HA       GLU  15   6.032  -1.856  -3.091
  131   1HB   GLU  15          2HB       GLU  15   8.832  -1.532  -1.993
  132   2HB   GLU  15          1HB       GLU  15   8.183  -3.006  -2.697
  133   1HG   GLU  15          2HG       GLU  15   7.903  -1.863  -4.838
  134   2HG   GLU  15          1HG       GLU  15   8.556  -0.386  -4.131
  135    H    THR  16           H        THR  16   5.871  -3.799  -1.812
  136    HA   THR  16           HA       THR  16   6.096  -3.549   1.065
  137    HB   THR  16           HB       THR  16   3.946  -2.685   1.009
  138    HG1  THR  16           1HG      THR  16   3.422  -5.445   0.974
  139   1HG2  THR  16          1HG2      THR  16   3.703  -4.092  -1.514
  140   2HG2  THR  16          2HG2      THR  16   2.905  -2.627  -0.953
  141   3HG2  THR  16          3HG2      THR  16   2.257  -4.207  -0.515
  142    H    THR  17           H        THR  17   5.379  -5.685   2.150
  143    HA   THR  17           HA       THR  17   5.702  -7.977   0.356
  144    HB   THR  17           HB       THR  17   7.420  -8.956   1.878
  145    HG1  THR  17           1HG      THR  17   8.424  -7.621   3.349
  146   1HG2  THR  17          1HG2      THR  17   7.816  -7.107  -0.144
  147   2HG2  THR  17          2HG2      THR  17   9.014  -8.198   0.549
  148   3HG2  THR  17          3HG2      THR  17   8.849  -6.556   1.173
  149    H    THR  18           H        THR  18   4.166  -9.374   0.762
  150    HA   THR  18           HA       THR  18   3.092  -9.665   3.506
  151    HB   THR  18           HB       THR  18   1.463  -8.964   1.756
  152    HG1  THR  18           1HG      THR  18   0.829 -10.298   3.538
  153   1HG2  THR  18          1HG2      THR  18   2.251  -9.983  -0.230
  154   2HG2  THR  18          2HG2      THR  18   0.691 -10.713   0.150
  155   3HG2  THR  18          3HG2      THR  18   2.182 -11.591   0.492
  156    H    GLU  19           H        GLU  19   2.898 -11.759   4.372
  157    HA   GLU  19           HA       GLU  19   4.493 -13.810   2.981
  158   1HB   GLU  19          2HB       GLU  19   5.260 -13.052   5.241
  159   2HB   GLU  19          1HB       GLU  19   3.759 -13.667   5.915
  160   1HG   GLU  19          2HG       GLU  19   5.779 -15.352   4.452
  161   2HG   GLU  19          1HG       GLU  19   5.705 -15.176   6.203
  162    H    ALA  20           H        ALA  20   3.320 -15.341   1.969
  163    HA   ALA  20           HA       ALA  20   1.004 -16.457   3.342
  164   1HB   ALA  20          1HB       ALA  20  -0.552 -16.019   1.714
  165   2HB   ALA  20          2HB       ALA  20   0.664 -15.813   0.454
  166   3HB   ALA  20          3HB       ALA  20   0.416 -14.545   1.654
  167    H    VAL  21           H        VAL  21   0.460 -18.525   2.734
  168    HA   VAL  21           HA       VAL  21   2.463 -20.301   2.127
  169    HB   VAL  21           HB       VAL  21  -0.442 -20.772   1.465
  170   1HG1  VAL  21          1HG1      VAL  21   0.985 -22.520   0.639
  171   2HG1  VAL  21          2HG1      VAL  21   0.115 -23.114   2.054
  172   3HG1  VAL  21          3HG1      VAL  21   1.808 -22.640   2.195
  173   1HG2  VAL  21          1HG2      VAL  21   1.002 -20.752   4.091
  174   2HG2  VAL  21          2HG2      VAL  21  -0.432 -21.747   3.845
  175   3HG2  VAL  21          3HG2      VAL  21  -0.533 -19.996   3.659
  176    H    ASP  22           H        ASP  22   0.548 -18.453  -0.096
  177    HA   ASP  22           HA       ASP  22   2.232 -19.314  -2.280
  178   1HB   ASP  22          2HB       ASP  22   0.439 -20.074  -3.748
  179   2HB   ASP  22          1HB       ASP  22   0.501 -21.061  -2.293
  180    H    ALA  23           H        ALA  23   1.358 -18.241  -4.420
  181    HA   ALA  23           HA       ALA  23   1.502 -15.476  -4.039
  182   1HB   ALA  23          1HB       ALA  23   1.923 -17.013  -6.149
  183   2HB   ALA  23          2HB       ALA  23   1.538 -15.300  -6.314
  184   3HB   ALA  23          3HB       ALA  23   0.277 -16.513  -6.537
  185    H    ALA  24           H        ALA  24  -1.287 -17.560  -4.666
  186    HA   ALA  24           HA       ALA  24  -3.190 -15.496  -4.924
  187   1HB   ALA  24          1HB       ALA  24  -3.264 -18.415  -4.468
  188   2HB   ALA  24          2HB       ALA  24  -4.160 -17.423  -5.618
  189   3HB   ALA  24          3HB       ALA  24  -4.685 -17.515  -3.937
  190    H    THR  25           H        THR  25  -2.382 -17.534  -2.104
  191    HA   THR  25           HA       THR  25  -3.998 -16.319  -0.229
  192    HB   THR  25           HB       THR  25  -2.290 -17.072   1.432
  193    HG1  THR  25           1HG      THR  25  -0.796 -17.396  -0.904
  194   1HG2  THR  25          1HG2      THR  25  -2.100 -19.503   0.187
  195   2HG2  THR  25          2HG2      THR  25  -3.549 -18.793  -0.528
  196   3HG2  THR  25          3HG2      THR  25  -3.423 -18.967   1.223
  197    H    ALA  26           H        ALA  26  -0.732 -15.460  -1.296
  198    HA   ALA  26           HA       ALA  26  -0.351 -13.241   0.386
  199   1HB   ALA  26          1HB       ALA  26   1.628 -13.685  -0.616
  200   2HB   ALA  26          2HB       ALA  26   1.048 -12.534  -1.821
  201   3HB   ALA  26          3HB       ALA  26   0.868 -14.267  -2.097
  202    H    GLU  27           H        GLU  27  -1.506 -13.420  -2.994
  203    HA   GLU  27           HA       GLU  27  -2.108 -10.775  -3.413
  204   1HB   GLU  27          2HB       GLU  27  -2.219 -12.477  -5.162
  205   2HB   GLU  27          1HB       GLU  27  -3.619 -13.202  -4.386
  206   1HG   GLU  27          2HG       GLU  27  -4.899 -11.159  -4.788
  207   2HG   GLU  27          1HG       GLU  27  -3.495 -10.440  -5.575
  208    H    LYS  28           H        LYS  28  -4.179 -13.291  -2.000
  209    HA   LYS  28           HA       LYS  28  -6.436 -11.664  -1.583
  210   1HB   LYS  28          2HB       LYS  28  -5.532 -14.124  -0.076
  211   2HB   LYS  28          1HB       LYS  28  -7.132 -13.403   0.041
  212   1HG   LYS  28          2HG       LYS  28  -5.891 -14.646  -2.402
  213   2HG   LYS  28          1HG       LYS  28  -7.213 -15.298  -1.431
  214   1HD   LYS  28          2HD       LYS  28  -8.591 -13.358  -2.029
  215   2HD   LYS  28          1HD       LYS  28  -7.270 -12.733  -3.017
  216   1HE   LYS  28          2HE       LYS  28  -8.942 -13.875  -4.387
  217   2HE   LYS  28          1HE       LYS  28  -7.387 -14.705  -4.445
  218   1HZ   LYS  28          1HZ       LYS  28  -8.264 -16.531  -3.556
  219   2HZ   LYS  28          2HZ       LYS  28  -9.779 -15.862  -3.895
  220   3HZ   LYS  28          3HZ       LYS  28  -9.099 -15.677  -2.357
  221    H    VAL  29           H        VAL  29  -3.711 -12.496   0.519
  222    HA   VAL  29           HA       VAL  29  -4.585 -11.152   2.809
  223    HB   VAL  29           HB       VAL  29  -1.747 -11.600   1.864
  224   1HG1  VAL  29          1HG1      VAL  29  -1.482 -10.024   3.525
  225   2HG1  VAL  29          2HG1      VAL  29  -1.382 -11.531   4.437
  226   3HG1  VAL  29          3HG1      VAL  29  -2.879 -10.597   4.438
  227   1HG2  VAL  29          1HG2      VAL  29  -2.807 -13.254   4.033
  228   2HG2  VAL  29          2HG2      VAL  29  -1.861 -13.709   2.617
  229   3HG2  VAL  29          3HG2      VAL  29  -3.606 -13.501   2.482
  230    H    VAL  30           H        VAL  30  -2.782 -10.027   0.002
  231    HA   VAL  30           HA       VAL  30  -2.242  -7.427   0.988
  232    HB   VAL  30           HB       VAL  30  -2.576  -8.312  -1.885
  233   1HG1  VAL  30          1HG1      VAL  30  -1.614  -6.332  -2.564
  234   2HG1  VAL  30          2HG1      VAL  30  -0.819  -6.064  -1.014
  235   3HG1  VAL  30          3HG1      VAL  30  -2.552  -5.784  -1.175
  236   1HG2  VAL  30          1HG2      VAL  30  -0.437  -9.072  -1.918
  237   2HG2  VAL  30          2HG2      VAL  30  -0.799  -9.389  -0.220
  238   3HG2  VAL  30          3HG2      VAL  30   0.100  -7.941  -0.674
  239    H    LYS  31           H        LYS  31  -4.838  -8.757  -1.080
  240    HA   LYS  31           HA       LYS  31  -6.300  -6.488  -1.575
  241   1HB   LYS  31          2HB       LYS  31  -7.285  -9.270  -0.963
  242   2HB   LYS  31          1HB       LYS  31  -8.329  -7.974  -1.522
  243   1HG   LYS  31          2HG       LYS  31  -7.069  -7.807  -3.580
  244   2HG   LYS  31          1HG       LYS  31  -5.959  -9.059  -3.020
  245   1HD   LYS  31          2HD       LYS  31  -7.496 -10.119  -4.484
  246   2HD   LYS  31          1HD       LYS  31  -7.953 -10.588  -2.846
  247   1HE   LYS  31          2HE       LYS  31  -9.234  -8.308  -4.342
  248   2HE   LYS  31          1HE       LYS  31  -9.856  -9.957  -4.373
  249   1HZ   LYS  31          1HZ       LYS  31  -9.564  -9.456  -1.727
  250   2HZ   LYS  31          2HZ       LYS  31 -11.014  -9.337  -2.590
  251   3HZ   LYS  31          3HZ       LYS  31 -10.074  -7.956  -2.324
  252    H    GLN  32           H        GLN  32  -6.581  -8.639   1.219
  253    HA   GLN  32           HA       GLN  32  -8.540  -7.160   2.581
  254   1HB   GLN  32          2HB       GLN  32  -7.998  -9.452   3.162
  255   2HB   GLN  32          1HB       GLN  32  -6.387  -8.971   3.679
  256   1HG   GLN  32          2HG       GLN  32  -7.287  -7.722   5.515
  257   2HG   GLN  32          1HG       GLN  32  -8.933  -7.988   4.947
  258   1HE2  GLN  32          1HE2      GLN  32  -7.585 -10.834   4.285
  259   2HE2  GLN  32          2HE2      GLN  32  -7.845 -11.667   5.771
  260    H    PHE  33           H        PHE  33  -5.043  -6.945   2.509
  261    HA   PHE  33           HA       PHE  33  -4.533  -5.202   4.595
  262   1HB   PHE  33          2HB       PHE  33  -2.836  -6.327   3.132
  263   2HB   PHE  33          1HB       PHE  33  -3.221  -5.171   1.863
  264    HD1  PHE  33           1HD      PHE  33  -2.052  -5.353   5.378
  265    HD2  PHE  33           2HD      PHE  33  -2.024  -3.196   1.697
  266    HE1  PHE  33           1HE      PHE  33  -0.380  -3.795   6.290
  267    HE2  PHE  33           2HE      PHE  33  -0.353  -1.647   2.621
  268    HZ   PHE  33           HZ       PHE  33   0.463  -1.955   4.925
  269    H    PHE  34           H        PHE  34  -5.183  -4.390   1.226
  270    HA   PHE  34           HA       PHE  34  -5.503  -1.577   1.732
  271   1HB   PHE  34          2HB       PHE  34  -6.265  -3.205  -0.697
  272   2HB   PHE  34          1HB       PHE  34  -6.216  -1.441  -0.614
  273    HD1  PHE  34           1HD      PHE  34  -3.841  -0.847   0.833
  274    HD2  PHE  34           2HD      PHE  34  -4.518  -3.906  -2.038
  275    HE1  PHE  34           1HE      PHE  34  -1.438  -0.899   0.336
  276    HE2  PHE  34           2HE      PHE  34  -2.115  -3.963  -2.550
  277    HZ   PHE  34           HZ       PHE  34  -0.575  -2.458  -1.344
  278    H    ASN  35           H        ASN  35  -7.606  -4.336   1.410
  279    HA   ASN  35           HA       ASN  35 -10.106  -3.193   1.231
  280   1HB   ASN  35          2HB       ASN  35  -9.506  -5.662   1.302
  281   2HB   ASN  35          1HB       ASN  35  -9.402  -5.510   3.052
  282   1HD2  ASN  35          1HD2      ASN  35 -11.266  -6.629   0.757
  283   2HD2  ASN  35          2HD2      ASN  35 -12.836  -6.381   1.434
  284    H    ASP  36           H        ASP  36  -8.047  -3.665   4.013
  285    HA   ASP  36           HA       ASP  36  -9.930  -2.293   5.774
  286   1HB   ASP  36          2HB       ASP  36  -7.331  -3.700   6.412
  287   2HB   ASP  36          1HB       ASP  36  -8.419  -2.993   7.601
  288    H    ASN  37           H        ASN  37  -6.954  -1.618   4.089
  289    HA   ASN  37           HA       ASN  37  -6.257   0.587   5.831
  290   1HB   ASN  37          2HB       ASN  37  -5.181  -0.214   3.117
  291   2HB   ASN  37          1HB       ASN  37  -4.566   1.134   4.065
  292   1HD2  ASN  37          1HD2      ASN  37  -3.453  -1.530   3.123
  293   2HD2  ASN  37          2HD2      ASN  37  -2.760  -2.209   4.553
  294    H    GLY  38           H        GLY  38  -7.570   0.157   2.593
  295   1HA   GLY  38          2HA       GLY  38  -7.988   2.177   1.208
  296   2HA   GLY  38          1HA       GLY  38  -9.450   1.481   1.867
  297    H    VAL  39           H        VAL  39 -10.802   2.868   2.687
  298    HA   VAL  39           HA       VAL  39  -9.799   5.508   3.532
  299    HB   VAL  39           HB       VAL  39 -12.588   4.763   2.720
  300   1HG1  VAL  39          1HG1      VAL  39 -12.941   6.760   3.720
  301   2HG1  VAL  39          2HG1      VAL  39 -12.360   7.389   2.178
  302   3HG1  VAL  39          3HG1      VAL  39 -11.259   7.262   3.550
  303   1HG2  VAL  39          1HG2      VAL  39 -12.154   5.470   0.524
  304   2HG2  VAL  39          2HG2      VAL  39 -10.790   4.436   0.942
  305   3HG2  VAL  39          3HG2      VAL  39 -10.609   6.191   0.970
  306    H    ASP  40           H        ASP  40 -10.732   2.761   5.120
  307    HA   ASP  40           HA       ASP  40 -12.015   4.353   7.232
  308   1HB   ASP  40          2HB       ASP  40 -12.631   1.494   6.470
  309   2HB   ASP  40          1HB       ASP  40 -13.314   2.345   7.853
  310    H    GLY  41           H        GLY  41  -9.179   3.105   6.567
  311   1HA   GLY  41          2HA       GLY  41  -8.754   1.405   8.864
  312   2HA   GLY  41          1HA       GLY  41  -7.531   1.950   7.728
  313    H    GLU  42           H        GLU  42  -6.685   1.916  10.190
  314    HA   GLU  42           HA       GLU  42  -7.131   4.519  11.440
  315   1HB   GLU  42          2HB       GLU  42  -5.499   2.148  12.372
  316   2HB   GLU  42          1HB       GLU  42  -5.793   3.611  13.300
  317   1HG   GLU  42          2HG       GLU  42  -8.183   3.122  13.325
  318   2HG   GLU  42          1HG       GLU  42  -7.892   1.658  12.388
  319    H    TRP  43           H        TRP  43  -6.035   6.023  10.255
  320    HA   TRP  43           HA       TRP  43  -3.289   5.496   9.450
  321   1HB   TRP  43          2HB       TRP  43  -5.122   7.831   8.902
  322   2HB   TRP  43          1HB       TRP  43  -3.500   7.649   8.243
  323    HD1  TRP  43           HD       TRP  43  -6.443   5.107   8.357
  324    HE1  TRP  43           1HE      TRP  43  -6.828   4.262   5.957
  325    HE3  TRP  43           3HE      TRP  43  -2.945   7.932   5.955
  326    HZ2  TRP  43           2HZ      TRP  43  -5.770   4.742   3.373
  327    HZ3  TRP  43           3HZ      TRP  43  -2.689   7.683   3.529
  328    HH2  TRP  43           HH       TRP  43  -4.074   6.123   2.259
  329    H    THR  44           H        THR  44  -1.681   5.969  10.788
  330    HA   THR  44           HA       THR  44  -1.957   8.291  12.576
  331    HB   THR  44           HB       THR  44  -0.138   7.227  13.910
  332    HG1  THR  44           1HG      THR  44  -0.544   5.041  12.152
  333   1HG2  THR  44          1HG2      THR  44  -1.411   5.473  14.923
  334   2HG2  THR  44          2HG2      THR  44  -2.445   5.343  13.500
  335   3HG2  THR  44          3HG2      THR  44  -2.497   6.796  14.499
  336    H    TYR  45           H        TYR  45  -0.477   9.941  12.427
  337    HA   TYR  45           HA       TYR  45   1.513   9.678  10.270
  338   1HB   TYR  45          2HB       TYR  45  -0.283  11.351   9.908
  339   2HB   TYR  45          1HB       TYR  45   0.241  12.198  11.358
  340    HD1  TYR  45           1HD      TYR  45   2.512  10.676   8.860
  341    HD2  TYR  45           2HD      TYR  45   0.808  14.272  10.365
  342    HE1  TYR  45           1HE      TYR  45   4.099  11.984   7.513
  343    HE2  TYR  45           2HE      TYR  45   2.391  15.590   9.023
  344    HH   TYR  45           HH       TYR  45   3.777  15.366   7.064
  345    H    ASP  46           H        ASP  46   3.610  10.373  10.556
  346    HA   ASP  46           HA       ASP  46   4.386  11.087  13.309
  347   1HB   ASP  46          2HB       ASP  46   5.024   8.769  12.809
  348   2HB   ASP  46          1HB       ASP  46   5.892   9.308  11.374
  349    H    ASP  47           H        ASP  47   4.290  13.303  12.643
  350    HA   ASP  47           HA       ASP  47   5.460  14.542  10.517
  351   1HB   ASP  47          2HB       ASP  47   5.497  15.545  13.371
  352   2HB   ASP  47          1HB       ASP  47   5.691  16.536  11.929
  353    H    ALA  48           H        ALA  48   7.080  13.312  13.380
  354    HA   ALA  48           HA       ALA  48   9.531  14.520  13.247
  355   1HB   ALA  48          1HB       ALA  48   8.500  12.572  14.770
  356   2HB   ALA  48          2HB       ALA  48  10.217  12.974  14.740
  357   3HB   ALA  48          3HB       ALA  48   9.610  11.621  13.785
  358    H    THR  49           H        THR  49   8.336  11.941  11.173
  359    HA   THR  49           HA       THR  49  10.817  12.188   9.604
  360    HB   THR  49           HB       THR  49  10.627   9.791   9.032
  361    HG1  THR  49           1HG      THR  49   8.947   8.691   9.606
  362   1HG2  THR  49          1HG2      THR  49  11.356  10.812  11.601
  363   2HG2  THR  49          2HG2      THR  49  12.051   9.473  10.688
  364   3HG2  THR  49          3HG2      THR  49  10.682   9.192  11.764
  365    H    LYS  50           H        LYS  50   7.897  13.237   9.446
  366    HA   LYS  50           HA       LYS  50   6.292  13.586   7.841
  367   1HB   LYS  50          2HB       LYS  50   8.794  13.335   6.171
  368   2HB   LYS  50          1HB       LYS  50   7.242  13.814   5.497
  369   1HG   LYS  50          2HG       LYS  50   8.678  15.277   7.701
  370   2HG   LYS  50          1HG       LYS  50   8.727  15.718   5.992
  371   1HD   LYS  50          2HD       LYS  50   6.238  15.922   6.054
  372   2HD   LYS  50          1HD       LYS  50   6.314  15.674   7.801
  373   1HE   LYS  50          2HE       LYS  50   7.636  17.908   6.261
  374   2HE   LYS  50          1HE       LYS  50   6.180  18.050   7.244
  375   1HZ   LYS  50          1HZ       LYS  50   8.223  16.893   8.793
  376   2HZ   LYS  50          2HZ       LYS  50   7.435  18.371   9.022
  377   3HZ   LYS  50          3HZ       LYS  50   8.830  18.295   8.067
  378    H    THR  51           H        THR  51   6.540  10.879   8.708
  379    HA   THR  51           HA       THR  51   5.676   9.490   6.266
  380    HB   THR  51           HB       THR  51   7.274   8.345   8.559
  381    HG1  THR  51           1HG      THR  51   8.361   9.643   6.896
  382   1HG2  THR  51          1HG2      THR  51   5.594   6.777   7.476
  383   2HG2  THR  51          2HG2      THR  51   7.280   6.264   7.518
  384   3HG2  THR  51          3HG2      THR  51   6.591   6.906   6.027
  385    H    PHE  52           H        PHE  52   3.877   8.251   6.382
  386    HA   PHE  52           HA       PHE  52   2.355   8.383   8.896
  387   1HB   PHE  52          2HB       PHE  52   1.321   7.792   6.113
  388   2HB   PHE  52          1HB       PHE  52   0.358   8.100   7.552
  389    HD1  PHE  52           1HD      PHE  52  -0.483  10.214   7.885
  390    HD2  PHE  52           2HD      PHE  52   2.962   9.722   5.436
  391    HE1  PHE  52           1HE      PHE  52  -0.555  12.607   7.309
  392    HE2  PHE  52           2HE      PHE  52   2.899  12.114   4.861
  393    HZ   PHE  52           HZ       PHE  52   1.141  13.559   5.800
  394    H    THR  53           H        THR  53   1.428   6.528   9.768
  395    HA   THR  53           HA       THR  53   2.313   3.993   8.566
  396    HB   THR  53           HB       THR  53   2.019   3.138  11.012
  397    HG1  THR  53           1HG      THR  53   2.266   4.640  12.568
  398   1HG2  THR  53          1HG2      THR  53   4.378   4.190  11.558
  399   2HG2  THR  53          2HG2      THR  53   4.320   4.572   9.839
  400   3HG2  THR  53          3HG2      THR  53   4.170   2.896  10.374
  401    H    VAL  54           H        VAL  54   0.799   2.661   7.934
  402    HA   VAL  54           HA       VAL  54  -1.955   3.106   8.874
  403    HB   VAL  54           HB       VAL  54  -1.062   1.716   6.340
  404   1HG1  VAL  54          1HG1      VAL  54  -3.236   1.314   5.848
  405   2HG1  VAL  54          2HG1      VAL  54  -3.806   2.763   6.674
  406   3HG1  VAL  54          3HG1      VAL  54  -3.391   1.325   7.605
  407   1HG2  VAL  54          1HG2      VAL  54  -1.769   3.702   5.154
  408   2HG2  VAL  54          2HG2      VAL  54  -0.537   4.129   6.343
  409   3HG2  VAL  54          3HG2      VAL  54  -2.235   4.477   6.669
  410    H    THR  55           H        THR  55  -2.513   1.710  10.409
  411    HA   THR  55           HA       THR  55  -1.381  -0.997  10.329
  412    HB   THR  55           HB       THR  55  -2.864   0.317  12.606
  413    HG1  THR  55           1HG      THR  55  -0.758   0.622  13.469
  414   1HG2  THR  55          1HG2      THR  55  -1.603  -1.370  13.953
  415   2HG2  THR  55          2HG2      THR  55  -1.169  -2.157  12.434
  416   3HG2  THR  55          3HG2      THR  55  -2.863  -2.034  12.913
  417    H    GLU  56           H        GLU  56  -2.591  -2.492   9.368
  418    HA   GLU  56           HA       GLU  56  -5.370  -2.089   8.879
  419   1HB   GLU  56          2HB       GLU  56  -5.371  -4.188   7.779
  420   2HB   GLU  56          1HB       GLU  56  -3.804  -3.465   7.445
  421   1HG   GLU  56          2HG       GLU  56  -2.742  -4.891   9.048
  422   2HG   GLU  56          1HG       GLU  56  -4.298  -5.519   9.587
  423   1H    MET   1          1HT       MET   1   6.286  18.473  -2.914
  424   2H    MET   1          2HT       MET   1   6.981  19.840  -2.200
  425   3H    MET   1          3HT       MET   1   5.620  19.122  -1.499
  426    HA   MET   1           HA       MET   1   8.407  18.187  -1.530
  427   1HB   MET   1          2HB       MET   1   7.599  19.523   0.356
  428   2HB   MET   1          1HB       MET   1   6.257  18.412   0.590
  429   1HG   MET   1          2HG       MET   1   7.826  16.629   1.149
  430   2HG   MET   1          1HG       MET   1   9.172  17.742   0.914
  431   1HE   MET   1          1HE       MET   1   8.588  16.057   3.805
  432   2HE   MET   1          2HE       MET   1   9.311  17.368   4.738
  433   3HE   MET   1          3HE       MET   1   9.993  16.919   3.176
  434    H    GLN   2           H        GLN   2   8.789  16.022  -0.667
  435    HA   GLN   2           HA       GLN   2   6.774  14.117  -1.643
  436   1HB   GLN   2          2HB       GLN   2   8.955  13.983  -2.759
  437   2HB   GLN   2          1HB       GLN   2   9.747  13.753  -1.206
  438   1HG   GLN   2          2HG       GLN   2   8.548  11.645  -0.908
  439   2HG   GLN   2          1HG       GLN   2   7.763  11.875  -2.467
  440   1HE2  GLN   2          1HE2      GLN   2  10.805  13.085  -2.827
  441   2HE2  GLN   2          2HE2      GLN   2  11.601  11.679  -3.430
  442    H    TYR   3           H        TYR   3   6.105  12.403  -0.352
  443    HA   TYR   3           HA       TYR   3   7.095  12.388   2.417
  444   1HB   TYR   3          2HB       TYR   3   4.190  12.278   1.578
  445   2HB   TYR   3          1HB       TYR   3   4.783  12.087   3.225
  446    HD1  TYR   3           1HD      TYR   3   4.729  13.942   4.597
  447    HD2  TYR   3           2HD      TYR   3   5.030  14.518   0.392
  448    HE1  TYR   3           1HE      TYR   3   4.603  16.376   4.928
  449    HE2  TYR   3           2HE      TYR   3   4.905  16.954   0.711
  450    HH   TYR   3           HH       TYR   3   4.016  18.375   3.687
  451    H    LYS   4           H        LYS   4   7.002  10.398   3.488
  452    HA   LYS   4           HA       LYS   4   6.641   8.101   1.681
  453   1HB   LYS   4          2HB       LYS   4   8.917   8.400   2.615
  454   2HB   LYS   4          1HB       LYS   4   8.254   8.268   4.236
  455   1HG   LYS   4          2HG       LYS   4   7.573   5.988   3.812
  456   2HG   LYS   4          1HG       LYS   4   8.122   6.111   2.140
  457   1HD   LYS   4          2HD       LYS   4   9.773   4.939   3.478
  458   2HD   LYS   4          1HD       LYS   4  10.416   6.489   2.935
  459   1HE   LYS   4          2HE       LYS   4  11.016   6.151   5.240
  460   2HE   LYS   4          1HE       LYS   4   9.834   7.455   5.138
  461   1HZ   LYS   4          1HZ       LYS   4   8.122   5.692   5.649
  462   2HZ   LYS   4          2HZ       LYS   4   9.157   6.114   6.917
  463   3HZ   LYS   4          3HZ       LYS   4   9.409   4.677   6.063
  464    H    VAL   5           H        VAL   5   5.656   6.171   2.558
  465    HA   VAL   5           HA       VAL   5   4.047   6.617   4.967
  466    HB   VAL   5           HB       VAL   5   2.920   5.554   2.374
  467   1HG1  VAL   5          1HG1      VAL   5   1.974   4.552   4.443
  468   2HG1  VAL   5          2HG1      VAL   5   0.802   5.466   3.497
  469   3HG1  VAL   5          3HG1      VAL   5   1.497   6.168   4.959
  470   1HG2  VAL   5          1HG2      VAL   5   2.491   8.188   3.775
  471   2HG2  VAL   5          2HG2      VAL   5   1.545   7.609   2.404
  472   3HG2  VAL   5          3HG2      VAL   5   3.267   7.934   2.212
  473    H    ILE   6           H        ILE   6   4.071   4.969   6.307
  474    HA   ILE   6           HA       ILE   6   5.262   2.449   5.438
  475    HB   ILE   6           HB       ILE   6   4.680   3.562   8.184
  476   1HG1  ILE   6          2HG1      ILE   6   7.278   2.905   6.779
  477   2HG1  ILE   6          1HG1      ILE   6   6.621   4.520   7.014
  478   1HG2  ILE   6          1HG2      ILE   6   6.257   1.392   8.630
  479   2HG2  ILE   6          2HG2      ILE   6   5.216   0.810   7.332
  480   3HG2  ILE   6          3HG2      ILE   6   4.505   1.423   8.827
  481   1HD1  ILE   6          1HD1      ILE   6   8.361   3.148   8.686
  482   2HD1  ILE   6          2HD1      ILE   6   6.807   3.117   9.519
  483   3HD1  ILE   6          3HD1      ILE   6   7.516   4.656   9.034
  484    H    LEU   7           H        LEU   7   3.915   0.927   4.759
  485    HA   LEU   7           HA       LEU   7   1.161   0.882   5.736
  486   1HB   LEU   7          2HB       LEU   7   2.292  -0.979   3.665
  487   2HB   LEU   7          1HB       LEU   7   0.638  -0.430   3.859
  488    HG   LEU   7           HG       LEU   7   2.952   1.180   2.801
  489   1HD1  LEU   7          1HD1      LEU   7   0.409   0.631   1.348
  490   2HD1  LEU   7          2HD1      LEU   7   1.652  -0.617   1.415
  491   3HD1  LEU   7          3HD1      LEU   7   2.020   0.959   0.715
  492   1HD2  LEU   7          1HD2      LEU   7   0.102   2.004   3.338
  493   2HD2  LEU   7          2HD2      LEU   7   1.287   2.959   2.446
  494   3HD2  LEU   7          3HD2      LEU   7   1.544   2.607   4.154
  495    H    ASN   8           H        ASN   8   1.631   0.141   7.846
  496    HA   ASN   8           HA       ASN   8   2.918  -2.450   8.143
  497   1HB   ASN   8          2HB       ASN   8   3.466  -0.463   9.585
  498   2HB   ASN   8          1HB       ASN   8   1.856  -0.604  10.282
  499   1HD2  ASN   8          1HD2      ASN   8   4.881  -1.140  10.986
  500   2HD2  ASN   8          2HD2      ASN   8   4.771  -2.577  11.941
  501    H    GLY   9           H        GLY   9   1.601  -4.162   7.786
  502   1HA   GLY   9          2HA       GLY   9  -1.062  -4.078   9.055
  503   2HA   GLY   9          1HA       GLY   9  -0.701  -4.990   7.599
  504    H    LYS  10           H        LYS  10  -1.775  -6.641   9.010
  505    HA   LYS  10           HA       LYS  10  -0.279  -7.750  11.178
  506   1HB   LYS  10          2HB       LYS  10  -2.557  -8.960   9.597
  507   2HB   LYS  10          1HB       LYS  10  -1.975  -9.498  11.168
  508   1HG   LYS  10          2HG       LYS  10  -2.766  -7.538  12.233
  509   2HG   LYS  10          1HG       LYS  10  -3.082  -6.747  10.689
  510   1HD   LYS  10          2HD       LYS  10  -5.166  -7.486  11.647
  511   2HD   LYS  10          1HD       LYS  10  -4.812  -8.450  10.214
  512   1HE   LYS  10          2HE       LYS  10  -4.189  -9.329  13.027
  513   2HE   LYS  10          1HE       LYS  10  -5.679  -9.738  12.181
  514   1HZ   LYS  10          1HZ       LYS  10  -4.561 -11.507  11.466
  515   2HZ   LYS  10          2HZ       LYS  10  -3.059 -10.874  11.914
  516   3HZ   LYS  10          3HZ       LYS  10  -3.742 -10.458  10.424
  517    H    THR  11           H        THR  11  -1.112  -8.936   7.918
  518    HA   THR  11           HA       THR  11   1.176 -10.758   8.025
  519    HB   THR  11           HB       THR  11  -0.094 -11.717   5.969
  520    HG1  THR  11           1HG      THR  11  -1.544  -9.809   6.024
  521   1HG2  THR  11          1HG2      THR  11  -0.142 -12.427   8.594
  522   2HG2  THR  11          2HG2      THR  11  -0.910 -13.323   7.282
  523   3HG2  THR  11          3HG2      THR  11  -1.854 -12.186   8.246
  524    H    LEU  12           H        LEU  12   0.641  -7.741   7.044
  525    HA   LEU  12           HA       LEU  12   2.442  -8.041   4.762
  526   1HB   LEU  12          2HB       LEU  12   0.205  -7.842   3.836
  527   2HB   LEU  12          1HB       LEU  12  -0.075  -6.384   4.767
  528    HG   LEU  12           HG       LEU  12   1.528  -5.164   3.469
  529   1HD1  LEU  12          1HD1      LEU  12   2.275  -6.856   1.396
  530   2HD1  LEU  12          2HD1      LEU  12   2.484  -7.812   2.859
  531   3HD1  LEU  12          3HD1      LEU  12   3.298  -6.261   2.704
  532   1HD2  LEU  12          1HD2      LEU  12   0.080  -4.832   1.813
  533   2HD2  LEU  12          2HD2      LEU  12  -0.837  -6.191   2.459
  534   3HD2  LEU  12          3HD2      LEU  12   0.333  -6.453   1.167
  535    H    LYS  13           H        LYS  13   3.966  -6.512   4.559
  536    HA   LYS  13           HA       LYS  13   3.806  -4.062   6.135
  537   1HB   LYS  13          2HB       LYS  13   6.081  -6.034   6.388
  538   2HB   LYS  13          1HB       LYS  13   6.062  -4.423   7.088
  539   1HG   LYS  13          2HG       LYS  13   4.101  -5.071   8.439
  540   2HG   LYS  13          1HG       LYS  13   4.225  -6.705   7.784
  541   1HD   LYS  13          2HD       LYS  13   6.416  -5.311   9.320
  542   2HD   LYS  13          1HD       LYS  13   5.256  -6.429  10.036
  543   1HE   LYS  13          2HE       LYS  13   7.217  -7.681   9.601
  544   2HE   LYS  13          1HE       LYS  13   6.045  -8.142   8.369
  545   1HZ   LYS  13          1HZ       LYS  13   7.372  -7.408   6.763
  546   2HZ   LYS  13          2HZ       LYS  13   8.601  -7.322   7.920
  547   3HZ   LYS  13          3HZ       LYS  13   7.690  -5.946   7.553
  548    H    GLY  14           H        GLY  14   5.084  -2.374   5.312
  549   1HA   GLY  14          2HA       GLY  14   7.132  -2.659   3.424
  550   2HA   GLY  14          1HA       GLY  14   5.622  -2.485   2.546
  551    H    GLU  15           H        GLU  15   6.803  -0.579   1.720
  552    HA   GLU  15           HA       GLU  15   6.031   1.763   3.266
  553   1HB   GLU  15          2HB       GLU  15   8.838   1.369   2.207
  554   2HB   GLU  15          1HB       GLU  15   8.214   2.860   2.901
  555   1HG   GLU  15          2HG       GLU  15   7.876   1.724   5.037
  556   2HG   GLU  15          1HG       GLU  15   8.503   0.231   4.341
  557    H    THR  16           H        THR  16   5.935   3.708   1.985
  558    HA   THR  16           HA       THR  16   6.196   3.452  -0.888
  559    HB   THR  16           HB       THR  16   4.023   2.641  -0.863
  560    HG1  THR  16           1HG      THR  16   3.567   5.412  -0.835
  561   1HG2  THR  16          1HG2      THR  16   3.780   4.054   1.656
  562   2HG2  THR  16          2HG2      THR  16   2.955   2.609   1.083
  563   3HG2  THR  16          3HG2      THR  16   2.352   4.204   0.636
  564    H    THR  17           H        THR  17   5.546   5.606  -1.983
  565    HA   THR  17           HA       THR  17   5.898   7.889  -0.185
  566    HB   THR  17           HB       THR  17   7.660   8.825  -1.682
  567    HG1  THR  17           1HG      THR  17   8.652   7.464  -3.139
  568   1HG2  THR  17          1HG2      THR  17   7.984   6.968   0.345
  569   2HG2  THR  17          2HG2      THR  17   9.219   8.028  -0.331
  570   3HG2  THR  17          3HG2      THR  17   9.022   6.391  -0.958
  571    H    THR  18           H        THR  18   4.402   9.323  -0.611
  572    HA   THR  18           HA       THR  18   3.376   9.640  -3.370
  573    HB   THR  18           HB       THR  18   1.706   8.979  -1.644
  574    HG1  THR  18           1HG      THR  18   1.130  10.326  -3.435
  575   1HG2  THR  18          1HG2      THR  18   2.488   9.979   0.352
  576   2HG2  THR  18          2HG2      THR  18   0.953  10.745  -0.049
  577   3HG2  THR  18          3HG2      THR  18   2.470  11.587  -0.371
  578    H    GLU  19           H        GLU  19   3.243  11.737  -4.239
  579    HA   GLU  19           HA       GLU  19   4.868  13.748  -2.826
  580   1HB   GLU  19          2HB       GLU  19   5.649  12.972  -5.075
  581   2HB   GLU  19          1HB       GLU  19   4.173  13.624  -5.769
  582   1HG   GLU  19          2HG       GLU  19   6.212  15.259  -4.279
  583   2HG   GLU  19          1HG       GLU  19   6.159  15.084  -6.030
  584    H    ALA  20           H        ALA  20   3.719  15.307  -1.831
  585    HA   ALA  20           HA       ALA  20   1.449  16.479  -3.236
  586   1HB   ALA  20          1HB       ALA  20  -0.138  16.080  -1.631
  587   2HB   ALA  20          2HB       ALA  20   1.054  15.845  -0.352
  588   3HB   ALA  20          3HB       ALA  20   0.793  14.584  -1.557
  589    H    VAL  21           H        VAL  21   0.948  18.560  -2.634
  590    HA   VAL  21           HA       VAL  21   2.984  20.287  -2.000
  591    HB   VAL  21           HB       VAL  21   0.083  20.830  -1.379
  592   1HG1  VAL  21          1HG1      VAL  21   1.541  22.542  -0.532
  593   2HG1  VAL  21          2HG1      VAL  21   0.706  23.157  -1.958
  594   3HG1  VAL  21          3HG1      VAL  21   2.389  22.641  -2.076
  595   1HG2  VAL  21          1HG2      VAL  21   1.564  20.774  -3.983
  596   2HG2  VAL  21          2HG2      VAL  21   0.150  21.805  -3.758
  597   3HG2  VAL  21          3HG2      VAL  21   0.006  20.055  -3.573
  598    H    ASP  22           H        ASP  22   0.995  18.487   0.197
  599    HA   ASP  22           HA       ASP  22   2.669  19.308   2.404
  600   1HB   ASP  22          2HB       ASP  22   0.874  20.109   3.847
  601   2HB   ASP  22          1HB       ASP  22   0.979  21.095   2.392
  602    H    ALA  23           H        ALA  23   1.738  18.257   4.530
  603    HA   ALA  23           HA       ALA  23   1.820  15.489   4.152
  604   1HB   ALA  23          1HB       ALA  23   2.249  17.015   6.268
  605   2HB   ALA  23          2HB       ALA  23   1.820  15.312   6.426
  606   3HB   ALA  23          3HB       ALA  23   0.586  16.556   6.632
  607    H    ALA  24           H        ALA  24  -0.926  17.639   4.740
  608    HA   ALA  24           HA       ALA  24  -2.881  15.623   4.972
  609   1HB   ALA  24          1HB       ALA  24  -2.879  18.540   4.514
  610   2HB   ALA  24          2HB       ALA  24  -3.815  17.572   5.651
  611   3HB   ALA  24          3HB       ALA  24  -4.315  17.678   3.963
  612    H    THR  25           H        THR  25  -1.985  17.641   2.163
  613    HA   THR  25           HA       THR  25  -3.604  16.464   0.264
  614    HB   THR  25           HB       THR  25  -1.854  17.175  -1.373
  615    HG1  THR  25           1HG      THR  25  -0.386  17.462   0.986
  616   1HG2  THR  25          1HG2      THR  25  -1.623  19.601  -0.124
  617   2HG2  THR  25          2HG2      THR  25  -3.098  18.927   0.570
  618   3HG2  THR  25          3HG2      THR  25  -2.944  19.097  -1.179
  619    H    ALA  26           H        ALA  26  -0.375  15.526   1.378
  620    HA   ALA  26           HA       ALA  26  -0.024  13.298  -0.300
  621   1HB   ALA  26          1HB       ALA  26   1.953  13.693   0.732
  622   2HB   ALA  26          2HB       ALA  26   1.326  12.558   1.927
  623   3HB   ALA  26          3HB       ALA  26   1.184  14.295   2.200
  624    H    GLU  27           H        GLU  27  -1.221  13.506   3.065
  625    HA   GLU  27           HA       GLU  27  -1.893  10.877   3.474
  626   1HB   GLU  27          2HB       GLU  27  -1.987  12.580   5.223
  627   2HB   GLU  27          1HB       GLU  27  -3.360  13.339   4.427
  628   1HG   GLU  27          2HG       GLU  27  -4.693  11.329   4.811
  629   2HG   GLU  27          1HG       GLU  27  -3.317  10.575   5.616
  630    H    LYS  28           H        LYS  28  -3.882  13.441   2.031
  631    HA   LYS  28           HA       LYS  28  -6.173  11.870   1.583
  632   1HB   LYS  28          2HB       LYS  28  -5.188  14.308   0.091
  633   2HB   LYS  28          1HB       LYS  28  -6.803  13.625  -0.050
  634   1HG   LYS  28          2HG       LYS  28  -5.567  14.838   2.411
  635   2HG   LYS  28          1HG       LYS  28  -6.859  15.520   1.421
  636   1HD   LYS  28          2HD       LYS  28  -8.291  13.616   1.999
  637   2HD   LYS  28          1HD       LYS  28  -7.000  12.958   3.007
  638   1HE   LYS  28          2HE       LYS  28  -8.663  14.142   4.352
  639   2HE   LYS  28          1HE       LYS  28  -7.089  14.933   4.431
  640   1HZ   LYS  28          1HZ       LYS  28  -7.909  16.781   3.531
  641   2HZ   LYS  28          2HZ       LYS  28  -9.445  16.148   3.848
  642   3HZ   LYS  28          3HZ       LYS  28  -8.748  15.946   2.321
  643    H    VAL  29           H        VAL  29  -3.399  12.635  -0.479
  644    HA   VAL  29           HA       VAL  29  -4.273  11.313  -2.784
  645    HB   VAL  29           HB       VAL  29  -1.438  11.693  -1.796
  646   1HG1  VAL  29          1HG1      VAL  29  -1.187  10.109  -3.455
  647   2HG1  VAL  29          2HG1      VAL  29  -1.039  11.612  -4.364
  648   3HG1  VAL  29          3HG1      VAL  29  -2.557  10.715  -4.386
  649   1HG2  VAL  29          1HG2      VAL  29  -2.427  13.370  -3.981
  650   2HG2  VAL  29          2HG2      VAL  29  -1.490  13.802  -2.551
  651   3HG2  VAL  29          3HG2      VAL  29  -3.242  13.636  -2.440
  652    H    VAL  30           H        VAL  30  -2.537  10.144   0.049
  653    HA   VAL  30           HA       VAL  30  -2.046   7.531  -0.928
  654    HB   VAL  30           HB       VAL  30  -2.399   8.425   1.939
  655   1HG1  VAL  30          1HG1      VAL  30  -1.497   6.422   2.632
  656   2HG1  VAL  30          2HG1      VAL  30  -0.686   6.134   1.093
  657   3HG1  VAL  30          3HG1      VAL  30  -2.428   5.898   1.229
  658   1HG2  VAL  30          1HG2      VAL  30  -0.243   9.133   2.001
  659   2HG2  VAL  30          2HG2      VAL  30  -0.573   9.458   0.299
  660   3HG2  VAL  30          3HG2      VAL  30   0.283   7.989   0.766
  661    H    LYS  31           H        LYS  31  -4.639   8.926   1.102
  662    HA   LYS  31           HA       LYS  31  -6.161   6.692   1.576
  663   1HB   LYS  31          2HB       LYS  31  -7.071   9.498   0.951
  664   2HB   LYS  31          1HB       LYS  31  -8.153   8.227   1.494
  665   1HG   LYS  31          2HG       LYS  31  -6.927   8.030   3.570
  666   2HG   LYS  31          1HG       LYS  31  -5.780   9.254   3.026
  667   1HD   LYS  31          2HD       LYS  31  -7.312  10.352   4.468
  668   2HD   LYS  31          1HD       LYS  31  -7.734  10.831   2.824
  669   1HE   LYS  31          2HE       LYS  31  -9.090   8.584   4.302
  670   2HE   LYS  31          1HE       LYS  31  -9.672  10.247   4.324
  671   1HZ   LYS  31          1HZ       LYS  31  -9.355   9.739   1.683
  672   2HZ   LYS  31          2HZ       LYS  31 -10.818   9.655   2.525
  673   3HZ   LYS  31          3HZ       LYS  31  -9.911   8.252   2.274
  674    H    GLN  32           H        GLN  32  -6.351   8.849  -1.221
  675    HA   GLN  32           HA       GLN  32  -8.326   7.417  -2.610
  676   1HB   GLN  32          2HB       GLN  32  -7.721   9.695  -3.184
  677   2HB   GLN  32          1HB       GLN  32  -6.116   9.175  -3.679
  678   1HG   GLN  32          2HG       GLN  32  -7.019   7.949  -5.528
  679   2HG   GLN  32          1HG       GLN  32  -8.664   8.256  -4.982
  680   1HE2  GLN  32          1HE2      GLN  32  -7.259  11.066  -4.300
  681   2HE2  GLN  32          2HE2      GLN  32  -7.477  11.906  -5.789
  682    H    PHE  33           H        PHE  33  -4.837   7.117  -2.488
  683    HA   PHE  33           HA       PHE  33  -4.339   5.362  -4.568
  684   1HB   PHE  33          2HB       PHE  33  -2.636   6.446  -3.080
  685   2HB   PHE  33          1HB       PHE  33  -3.067   5.301  -1.819
  686    HD1  PHE  33           1HD      PHE  33  -1.845   5.453  -5.316
  687    HD2  PHE  33           2HD      PHE  33  -1.923   3.296  -1.637
  688    HE1  PHE  33           1HE      PHE  33  -0.199   3.855  -6.205
  689    HE2  PHE  33           2HE      PHE  33  -0.277   1.707  -2.536
  690    HZ   PHE  33           HZ       PHE  33   0.578   1.995  -4.828
  691    H    PHE  34           H        PHE  34  -5.057   4.567  -1.209
  692    HA   PHE  34           HA       PHE  34  -5.438   1.762  -1.720
  693   1HB   PHE  34          2HB       PHE  34  -6.195   3.409   0.698
  694   2HB   PHE  34          1HB       PHE  34  -6.188   1.643   0.615
  695    HD1  PHE  34           1HD      PHE  34  -3.807   0.993  -0.798
  696    HD2  PHE  34           2HD      PHE  34  -4.449   4.067   2.064
  697    HE1  PHE  34           1HE      PHE  34  -1.410   0.987  -0.268
  698    HE2  PHE  34           2HE      PHE  34  -2.054   4.067   2.611
  699    HZ   PHE  34           HZ       PHE  34  -0.533   2.525   1.424
  700    H    ASN  35           H        ASN  35  -7.477   4.572  -1.429
  701    HA   ASN  35           HA       ASN  35 -10.008   3.490  -1.285
  702   1HB   ASN  35          2HB       ASN  35  -9.346   5.943  -1.345
  703   2HB   ASN  35          1HB       ASN  35  -9.221   5.789  -3.094
  704   1HD2  ASN  35          1HD2      ASN  35 -11.090   6.954  -0.825
  705   2HD2  ASN  35          2HD2      ASN  35 -12.654   6.744  -1.526
  706    H    ASP  36           H        ASP  36  -7.899   3.911  -4.037
  707    HA   ASP  36           HA       ASP  36  -9.789   2.585  -5.823
  708   1HB   ASP  36          2HB       ASP  36  -7.148   3.928  -6.424
  709   2HB   ASP  36          1HB       ASP  36  -8.236   3.248  -7.630
  710    H    ASN  37           H        ASN  37  -6.855   1.838  -4.096
  711    HA   ASN  37           HA       ASN  37  -6.188  -0.383  -5.828
  712   1HB   ASN  37          2HB       ASN  37  -5.130   0.391  -3.100
  713   2HB   ASN  37          1HB       ASN  37  -4.533  -0.971  -4.040
  714   1HD2  ASN  37          1HD2      ASN  37  -3.369   1.665  -3.080
  715   2HD2  ASN  37          2HD2      ASN  37  -2.641   2.328  -4.503
  716    H    GLY  38           H        GLY  38  -7.535   0.079  -2.611
  717   1HA   GLY  38          2HA       GLY  38  -8.020  -1.930  -1.231
  718   2HA   GLY  38          1HA       GLY  38  -9.456  -1.198  -1.910
  719    H    VAL  39           H        VAL  39 -10.830  -2.553  -2.751
  720    HA   VAL  39           HA       VAL  39  -9.879  -5.216  -3.583
  721    HB   VAL  39           HB       VAL  39 -12.660  -4.404  -2.810
  722   1HG1  VAL  39          1HG1      VAL  39 -13.048  -6.391  -3.813
  723   2HG1  VAL  39          2HG1      VAL  39 -12.502  -7.034  -2.264
  724   3HG1  VAL  39          3HG1      VAL  39 -11.381  -6.935  -3.620
  725   1HG2  VAL  39          1HG2      VAL  39 -12.276  -5.120  -0.607
  726   2HG2  VAL  39          2HG2      VAL  39 -10.879  -4.120  -1.007
  727   3HG2  VAL  39          3HG2      VAL  39 -10.740  -5.878  -1.031
  728    H    ASP  40           H        ASP  40 -10.722  -2.448  -5.183
  729    HA   ASP  40           HA       ASP  40 -12.014  -4.009  -7.313
  730   1HB   ASP  40          2HB       ASP  40 -12.572  -1.135  -6.559
  731   2HB   ASP  40          1HB       ASP  40 -13.254  -1.970  -7.952
  732    H    GLY  41           H        GLY  41  -9.159  -2.829  -6.608
  733   1HA   GLY  41          2HA       GLY  41  -8.660  -1.142  -8.899
  734   2HA   GLY  41          1HA       GLY  41  -7.467  -1.715  -7.745
  735    H    GLU  42           H        GLU  42  -6.588  -1.701 -10.195
  736    HA   GLU  42           HA       GLU  42  -7.076  -4.295 -11.450
  737   1HB   GLU  42          2HB       GLU  42  -5.373  -1.963 -12.358
  738   2HB   GLU  42          1HB       GLU  42  -5.690  -3.420 -13.292
  739   1HG   GLU  42          2HG       GLU  42  -8.068  -2.873 -13.349
  740   2HG   GLU  42          1HG       GLU  42  -7.754  -1.415 -12.409
  741    H    TRP  43           H        TRP  43  -6.034  -5.823 -10.249
  742    HA   TRP  43           HA       TRP  43  -3.288  -5.364  -9.406
  743   1HB   TRP  43          2HB       TRP  43  -5.184  -7.653  -8.886
  744   2HB   TRP  43          1HB       TRP  43  -3.567  -7.511  -8.204
  745    HD1  TRP  43           HD       TRP  43  -6.447  -4.898  -8.358
  746    HE1  TRP  43           1HE      TRP  43  -6.845  -4.043  -5.966
  747    HE3  TRP  43           3HE      TRP  43  -3.053  -7.807  -5.906
  748    HZ2  TRP  43           2HZ      TRP  43  -5.836  -4.548  -3.365
  749    HZ3  TRP  43           3HZ      TRP  43  -2.825  -7.565  -3.479
  750    HH2  TRP  43           HH       TRP  43  -4.188  -5.969  -2.228
  751    H    THR  44           H        THR  44  -1.674  -5.876 -10.722
  752    HA   THR  44           HA       THR  44  -1.981  -8.190 -12.516
  753    HB   THR  44           HB       THR  44  -0.117  -7.172 -13.823
  754    HG1  THR  44           1HG      THR  44  -0.494  -4.976 -12.072
  755   1HG2  THR  44          1HG2      THR  44  -1.332  -5.387 -14.853
  756   2HG2  THR  44          2HG2      THR  44  -2.382  -5.231 -13.444
  757   3HG2  THR  44          3HG2      THR  44  -2.456  -6.682 -14.444
  758    H    TYR  45           H        TYR  45  -0.542  -9.876 -12.346
  759    HA   TYR  45           HA       TYR  45   1.422  -9.661 -10.160
  760   1HB   TYR  45          2HB       TYR  45  -0.418 -11.289  -9.824
  761   2HB   TYR  45          1HB       TYR  45   0.105 -12.148 -11.266
  762    HD1  TYR  45           1HD      TYR  45   2.376 -10.683  -8.737
  763    HD2  TYR  45           2HD      TYR  45   0.607 -14.237 -10.265
  764    HE1  TYR  45           1HE      TYR  45   3.912 -12.030  -7.367
  765    HE2  TYR  45           2HE      TYR  45   2.138 -15.593  -8.901
  766    HH   TYR  45           HH       TYR  45   3.502 -15.402  -6.924
  767    H    ASP  46           H        ASP  46   3.507 -10.406 -10.418
  768    HA   ASP  46           HA       ASP  46   4.303 -11.142 -13.157
  769   1HB   ASP  46          2HB       ASP  46   4.992  -8.839 -12.649
  770   2HB   ASP  46          1HB       ASP  46   5.824  -9.400 -11.202
  771    H    ASP  47           H        ASP  47   4.144 -13.353 -12.494
  772    HA   ASP  47           HA       ASP  47   5.253 -14.620 -10.352
  773   1HB   ASP  47          2HB       ASP  47   5.306 -15.623 -13.205
  774   2HB   ASP  47          1HB       ASP  47   5.457 -16.619 -11.761
  775    H    ALA  48           H        ALA  48   6.943 -13.430 -13.192
  776    HA   ALA  48           HA       ALA  48   9.361 -14.697 -13.024
  777   1HB   ALA  48          1HB       ALA  48   8.400 -12.726 -14.562
  778   2HB   ALA  48          2HB       ALA  48  10.106 -13.168 -14.508
  779   3HB   ALA  48          3HB       ALA  48   9.519 -11.801 -13.562
  780    H    THR  49           H        THR  49   8.200 -12.090 -10.968
  781    HA   THR  49           HA       THR  49  10.652 -12.398  -9.364
  782    HB   THR  49           HB       THR  49  10.514  -9.995  -8.794
  783    HG1  THR  49           1HG      THR  49   8.869  -8.855  -9.390
  784   1HG2  THR  49          1HG2      THR  49  11.253 -11.036 -11.352
  785   2HG2  THR  49          2HG2      THR  49  11.967  -9.714 -10.429
  786   3HG2  THR  49          3HG2      THR  49  10.620  -9.399 -11.524
  787    H    LYS  50           H        LYS  50   7.706 -13.374  -9.247
  788    HA   LYS  50           HA       LYS  50   6.069 -13.683  -7.665
  789   1HB   LYS  50          2HB       LYS  50   8.553 -13.494  -5.960
  790   2HB   LYS  50          1HB       LYS  50   6.982 -13.933  -5.308
  791   1HG   LYS  50          2HG       LYS  50   8.413 -15.433  -7.491
  792   2HG   LYS  50          1HG       LYS  50   8.426 -15.872  -5.782
  793   1HD   LYS  50          2HD       LYS  50   5.934 -16.017  -5.880
  794   2HD   LYS  50          1HD       LYS  50   6.042 -15.773  -7.624
  795   1HE   LYS  50          2HE       LYS  50   7.288 -18.037  -6.066
  796   2HE   LYS  50          1HE       LYS  50   5.842 -18.144  -7.071
  797   1HZ   LYS  50          1HZ       LYS  50   7.934 -17.035  -8.590
  798   2HZ   LYS  50          2HZ       LYS  50   7.114 -18.496  -8.831
  799   3HZ   LYS  50          3HZ       LYS  50   8.495 -18.453  -7.855
  800    H    THR  51           H        THR  51   6.397 -10.984  -8.528
  801    HA   THR  51           HA       THR  51   5.532  -9.574  -6.098
  802    HB   THR  51           HB       THR  51   7.188  -8.469  -8.369
  803    HG1  THR  51           1HG      THR  51   8.221  -9.792  -6.688
  804   1HG2  THR  51          1HG2      THR  51   5.533  -6.860  -7.308
  805   2HG2  THR  51          2HG2      THR  51   7.231  -6.388  -7.325
  806   3HG2  THR  51          3HG2      THR  51   6.505  -7.013  -5.845
  807    H    PHE  52           H        PHE  52   3.765  -8.291  -6.238
  808    HA   PHE  52           HA       PHE  52   2.276  -8.387  -8.772
  809   1HB   PHE  52          2HB       PHE  52   1.218  -7.771  -6.005
  810   2HB   PHE  52          1HB       PHE  52   0.268  -8.057  -7.459
  811    HD1  PHE  52           1HD      PHE  52  -0.619 -10.149  -7.804
  812    HD2  PHE  52           2HD      PHE  52   2.801  -9.741  -5.306
  813    HE1  PHE  52           1HE      PHE  52  -0.757 -12.539  -7.229
  814    HE2  PHE  52           2HE      PHE  52   2.672 -12.130  -4.732
  815    HZ   PHE  52           HZ       PHE  52   0.892 -13.531  -5.696
  816    H    THR  53           H        THR  53   1.407  -6.509  -9.660
  817    HA   THR  53           HA       THR  53   2.336  -3.997  -8.444
  818    HB   THR  53           HB       THR  53   2.097  -3.135 -10.894
  819    HG1  THR  53           1HG      THR  53   2.331  -4.643 -12.447
  820   1HG2  THR  53          1HG2      THR  53   4.437  -4.245 -11.407
  821   2HG2  THR  53          2HG2      THR  53   4.347  -4.625  -9.687
  822   3HG2  THR  53          3HG2      THR  53   4.245  -2.945 -10.227
  823    H    VAL  54           H        VAL  54   0.847  -2.630  -7.832
  824    HA   VAL  54           HA       VAL  54  -1.904  -3.006  -8.812
  825    HB   VAL  54           HB       VAL  54  -1.015  -1.638  -6.266
  826   1HG1  VAL  54          1HG1      VAL  54  -3.183  -1.183  -5.805
  827   2HG1  VAL  54          2HG1      VAL  54  -3.778  -2.618  -6.638
  828   3HG1  VAL  54          3HG1      VAL  54  -3.314  -1.190  -7.564
  829   1HG2  VAL  54          1HG2      VAL  54  -1.785  -3.606  -5.090
  830   2HG2  VAL  54          2HG2      VAL  54  -0.547  -4.062  -6.262
  831   3HG2  VAL  54          3HG2      VAL  54  -2.248  -4.369  -6.611
  832    H    THR  55           H        THR  55  -2.407  -1.596 -10.354
  833    HA   THR  55           HA       THR  55  -1.211   1.081 -10.258
  834    HB   THR  55           HB       THR  55  -2.692  -0.197 -12.556
  835    HG1  THR  55           1HG      THR  55  -0.582  -0.552 -13.388
  836   1HG2  THR  55          1HG2      THR  55  -1.371   1.459 -13.885
  837   2HG2  THR  55          2HG2      THR  55  -0.940   2.234 -12.360
  838   3HG2  THR  55          3HG2      THR  55  -2.630   2.152 -12.861
  839    H    GLU  56           H        GLU  56  -2.397   2.605  -9.314
  840    HA   GLU  56           HA       GLU  56  -5.192   2.271  -8.863
  841   1HB   GLU  56          2HB       GLU  56  -5.159   4.369  -7.764
  842   2HB   GLU  56          1HB       GLU  56  -3.613   3.608  -7.407
  843   1HG   GLU  56          2HG       GLU  56  -2.494   5.008  -8.994
  844   2HG   GLU  56          1HG       GLU  56  -4.026   5.674  -9.557
  Start of MODEL   18
    1   1H    MET   1          1HT       MET   1   4.744 -17.602   1.443
    2   2H    MET   1          2HT       MET   1   5.371 -18.994   2.166
    3   3H    MET   1          3HT       MET   1   5.352 -18.856   0.482
    4    HA   MET   1           HA       MET   1   7.306 -18.025   2.333
    5   1HB   MET   1          2HB       MET   1   8.618 -17.745   0.240
    6   2HB   MET   1          1HB       MET   1   7.807 -19.287   0.368
    7   1HG   MET   1          2HG       MET   1   7.335 -18.847  -1.776
    8   2HG   MET   1          1HG       MET   1   5.974 -18.011  -1.047
    9   1HE   MET   1          1HE       MET   1   9.375 -17.296  -3.264
   10   2HE   MET   1          2HE       MET   1   9.664 -17.576  -1.547
   11   3HE   MET   1          3HE       MET   1   9.881 -15.962  -2.225
   12    H    GLN   2           H        GLN   2   8.615 -15.984   0.756
   13    HA   GLN   2           HA       GLN   2   7.068 -13.699   1.731
   14   1HB   GLN   2          2HB       GLN   2   9.369 -13.908   2.539
   15   2HB   GLN   2          1HB       GLN   2   9.967 -13.892   0.886
   16   1HG   GLN   2          2HG       GLN   2   9.120 -11.619   0.602
   17   2HG   GLN   2          1HG       GLN   2   8.524 -11.634   2.258
   18   1HE2  GLN   2          1HE2      GLN   2  11.335 -13.351   2.314
   19   2HE2  GLN   2          2HE2      GLN   2  12.433 -12.084   2.720
   20    H    TYR   3           H        TYR   3   6.062 -12.349   0.405
   21    HA   TYR   3           HA       TYR   3   6.858 -12.325  -2.432
   22   1HB   TYR   3          2HB       TYR   3   4.058 -12.054  -1.311
   23   2HB   TYR   3          1HB       TYR   3   4.498 -11.988  -3.016
   24    HD1  TYR   3           1HD      TYR   3   4.037 -13.903  -4.217
   25    HD2  TYR   3           2HD      TYR   3   5.115 -14.283  -0.115
   26    HE1  TYR   3           1HE      TYR   3   3.793 -16.344  -4.380
   27    HE2  TYR   3           2HE      TYR   3   4.900 -16.726  -0.271
   28    HH   TYR   3           HH       TYR   3   3.592 -18.270  -3.140
   29    H    LYS   4           H        LYS   4   6.838 -10.336  -3.489
   30    HA   LYS   4           HA       LYS   4   6.677  -8.013  -1.680
   31   1HB   LYS   4          2HB       LYS   4   8.917  -8.418  -2.572
   32   2HB   LYS   4          1HB       LYS   4   8.288  -8.374  -4.213
   33   1HG   LYS   4          2HG       LYS   4   7.648  -6.027  -3.894
   34   2HG   LYS   4          1HG       LYS   4   8.326  -6.078  -2.265
   35   1HD   LYS   4          2HD       LYS   4   9.855  -6.556  -4.822
   36   2HD   LYS   4          1HD       LYS   4   9.885  -5.072  -3.868
   37   1HE   LYS   4          2HE       LYS   4  10.775  -7.796  -2.928
   38   2HE   LYS   4          1HE       LYS   4  11.837  -6.476  -3.412
   39   1HZ   LYS   4          1HZ       LYS   4  11.693  -6.491  -1.052
   40   2HZ   LYS   4          2HZ       LYS   4  10.003  -6.534  -1.081
   41   3HZ   LYS   4          3HZ       LYS   4  10.821  -5.148  -1.597
   42    H    VAL   5           H        VAL   5   4.767  -7.026  -1.927
   43    HA   VAL   5           HA       VAL   5   3.574  -6.884  -4.591
   44    HB   VAL   5           HB       VAL   5   2.452  -6.082  -1.902
   45   1HG1  VAL   5          1HG1      VAL   5   1.130  -6.110  -4.610
   46   2HG1  VAL   5          2HG1      VAL   5   1.505  -4.685  -3.643
   47   3HG1  VAL   5          3HG1      VAL   5   0.306  -5.846  -3.075
   48   1HG2  VAL   5          1HG2      VAL   5   2.688  -8.600  -3.168
   49   2HG2  VAL   5          2HG2      VAL   5   0.985  -8.143  -3.200
   50   3HG2  VAL   5          3HG2      VAL   5   1.853  -8.200  -1.667
   51    H    ILE   6           H        ILE   6   3.985  -5.235  -5.832
   52    HA   ILE   6           HA       ILE   6   4.984  -2.740  -4.675
   53    HB   ILE   6           HB       ILE   6   4.849  -3.560  -7.584
   54   1HG1  ILE   6          2HG1      ILE   6   7.201  -3.493  -5.682
   55   2HG1  ILE   6          1HG1      ILE   6   6.377  -4.952  -6.213
   56   1HG2  ILE   6          1HG2      ILE   6   6.623  -1.408  -6.534
   57   2HG2  ILE   6          2HG2      ILE   6   4.922  -1.046  -6.819
   58   3HG2  ILE   6          3HG2      ILE   6   5.936  -1.616  -8.144
   59   1HD1  ILE   6          1HD1      ILE   6   7.083  -4.573  -8.483
   60   2HD1  ILE   6          2HD1      ILE   6   8.484  -4.526  -7.411
   61   3HD1  ILE   6          3HD1      ILE   6   7.799  -3.025  -8.034
   62    H    LEU   7           H        LEU   7   3.838  -0.942  -4.566
   63    HA   LEU   7           HA       LEU   7   1.155  -0.934  -5.773
   64   1HB   LEU   7          2HB       LEU   7   2.059   0.879  -3.557
   65   2HB   LEU   7          1HB       LEU   7   0.428   0.378  -3.970
   66    HG   LEU   7           HG       LEU   7   2.546  -1.332  -2.680
   67   1HD1  LEU   7          1HD1      LEU   7   1.457   0.366  -1.239
   68   2HD1  LEU   7          2HD1      LEU   7   1.127  -1.294  -0.748
   69   3HD1  LEU   7          3HD1      LEU   7  -0.101  -0.369  -1.613
   70   1HD2  LEU   7          1HD2      LEU   7  -0.292  -2.058  -3.386
   71   2HD2  LEU   7          2HD2      LEU   7   0.913  -3.093  -2.620
   72   3HD2  LEU   7          3HD2      LEU   7   1.131  -2.574  -4.289
   73    H    ASN   8           H        ASN   8   1.666  -0.086  -7.799
   74    HA   ASN   8           HA       ASN   8   3.073   2.472  -7.905
   75   1HB   ASN   8          2HB       ASN   8   2.152   0.677 -10.159
   76   2HB   ASN   8          1HB       ASN   8   3.159   2.111 -10.325
   77   1HD2  ASN   8          1HD2      ASN   8   5.240   1.749 -10.470
   78   2HD2  ASN   8          2HD2      ASN   8   6.081   0.372  -9.854
   79    H    GLY   9           H        GLY   9   1.776   4.187  -7.540
   80   1HA   GLY   9          2HA       GLY   9  -0.854   4.208  -8.886
   81   2HA   GLY   9          1HA       GLY   9  -0.491   5.094  -7.413
   82    H    LYS  10           H        LYS  10  -1.508   6.791  -8.859
   83    HA   LYS  10           HA       LYS  10   0.122   7.847 -10.963
   84   1HB   LYS  10          2HB       LYS  10  -2.242   9.040  -9.512
   85   2HB   LYS  10          1HB       LYS  10  -1.501   9.722 -10.953
   86   1HG   LYS  10          2HG       LYS  10  -2.059   7.628 -12.162
   87   2HG   LYS  10          1HG       LYS  10  -2.922   7.078 -10.727
   88   1HD   LYS  10          2HD       LYS  10  -3.547   9.611 -12.244
   89   2HD   LYS  10          1HD       LYS  10  -4.398   8.080 -12.455
   90   1HE   LYS  10          2HE       LYS  10  -5.722   9.387 -10.993
   91   2HE   LYS  10          1HE       LYS  10  -4.932   8.169  -9.997
   92   1HZ   LYS  10          1HZ       LYS  10  -4.934  10.856  -9.550
   93   2HZ   LYS  10          2HZ       LYS  10  -3.397  10.575 -10.196
   94   3HZ   LYS  10          3HZ       LYS  10  -3.903   9.730  -8.820
   95    H    THR  11           H        THR  11  -0.796   9.065  -7.735
   96    HA   THR  11           HA       THR  11   1.545  10.827  -7.778
   97    HB   THR  11           HB       THR  11   0.235  11.831  -5.764
   98    HG1  THR  11           1HG      THR  11  -1.280   9.962  -5.910
   99   1HG2  THR  11          1HG2      THR  11   0.219  13.342  -7.441
  100   2HG2  THR  11          2HG2      THR  11  -1.476  12.860  -7.518
  101   3HG2  THR  11          3HG2      THR  11  -0.310  12.166  -8.644
  102    H    LEU  12           H        LEU  12   0.886   7.842  -6.801
  103    HA   LEU  12           HA       LEU  12   2.637   8.074  -4.473
  104   1HB   LEU  12          2HB       LEU  12   0.382   7.958  -3.586
  105   2HB   LEU  12          1HB       LEU  12   0.041   6.539  -4.552
  106    HG   LEU  12           HG       LEU  12   1.510   5.191  -3.239
  107   1HD1  LEU  12          1HD1      LEU  12   2.428   6.640  -1.122
  108   2HD1  LEU  12          2HD1      LEU  12   2.596   7.787  -2.450
  109   3HD1  LEU  12          3HD1      LEU  12   3.377   6.216  -2.546
  110   1HD2  LEU  12          1HD2      LEU  12   0.061   4.957  -1.564
  111   2HD2  LEU  12          2HD2      LEU  12  -0.786   6.337  -2.263
  112   3HD2  LEU  12          3HD2      LEU  12   0.369   6.584  -0.956
  113    H    LYS  13           H        LYS  13   4.096   6.476  -4.259
  114    HA   LYS  13           HA       LYS  13   3.876   4.063  -5.884
  115   1HB   LYS  13          2HB       LYS  13   6.266   5.913  -6.038
  116   2HB   LYS  13          1HB       LYS  13   6.129   4.344  -6.819
  117   1HG   LYS  13          2HG       LYS  13   4.298   5.168  -8.193
  118   2HG   LYS  13          1HG       LYS  13   4.392   6.736  -7.390
  119   1HD   LYS  13          2HD       LYS  13   6.677   7.022  -8.225
  120   2HD   LYS  13          1HD       LYS  13   6.578   5.454  -9.029
  121   1HE   LYS  13          2HE       LYS  13   4.730   6.275 -10.402
  122   2HE   LYS  13          1HE       LYS  13   4.818   7.839  -9.591
  123   1HZ   LYS  13          1HZ       LYS  13   6.588   6.686 -11.604
  124   2HZ   LYS  13          2HZ       LYS  13   7.308   7.647 -10.413
  125   3HZ   LYS  13          3HZ       LYS  13   6.088   8.288 -11.394
  126    H    GLY  14           H        GLY  14   5.011   2.304  -5.028
  127   1HA   GLY  14          2HA       GLY  14   7.020   2.514  -3.062
  128   2HA   GLY  14          1HA       GLY  14   5.468   2.334  -2.262
  129    H    GLU  15           H        GLU  15   6.645   0.406  -1.449
  130    HA   GLU  15           HA       GLU  15   5.836  -1.902  -3.005
  131   1HB   GLU  15          2HB       GLU  15   8.690  -1.580  -2.063
  132   2HB   GLU  15          1HB       GLU  15   8.011  -3.019  -2.811
  133   1HG   GLU  15          2HG       GLU  15   7.620  -1.763  -4.868
  134   2HG   GLU  15          1HG       GLU  15   8.304  -0.323  -4.119
  135    H    THR  16           H        THR  16   5.370  -3.655  -1.837
  136    HA   THR  16           HA       THR  16   5.843  -3.543   1.045
  137    HB   THR  16           HB       THR  16   3.648  -2.663   0.808
  138    HG1  THR  16           1HG      THR  16   4.024  -4.390   2.322
  139   1HG2  THR  16          1HG2      THR  16   2.801  -3.154  -1.266
  140   2HG2  THR  16          2HG2      THR  16   1.859  -4.223  -0.225
  141   3HG2  THR  16          3HG2      THR  16   3.224  -4.858  -1.138
  142    H    THR  17           H        THR  17   5.208  -5.687   2.085
  143    HA   THR  17           HA       THR  17   5.574  -7.941   0.263
  144    HB   THR  17           HB       THR  17   7.359  -8.884   1.701
  145    HG1  THR  17           1HG      THR  17   7.229  -6.337   2.935
  146   1HG2  THR  17          1HG2      THR  17   7.674  -7.024  -0.259
  147   2HG2  THR  17          2HG2      THR  17   8.977  -7.930   0.508
  148   3HG2  THR  17          3HG2      THR  17   8.574  -6.311   1.078
  149    H    THR  18           H        THR  18   4.122  -9.402   0.666
  150    HA   THR  18           HA       THR  18   3.069  -9.741   3.412
  151    HB   THR  18           HB       THR  18   1.412  -9.076   1.671
  152    HG1  THR  18           1HG      THR  18   0.818 -10.401   3.462
  153   1HG2  THR  18          1HG2      THR  18   0.662 -10.872   0.092
  154   2HG2  THR  18          2HG2      THR  18   2.198 -11.680   0.408
  155   3HG2  THR  18          3HG2      THR  18   2.181 -10.076  -0.322
  156    H    GLU  19           H        GLU  19   2.983 -11.822   4.289
  157    HA   GLU  19           HA       GLU  19   4.601 -13.833   2.865
  158   1HB   GLU  19          2HB       GLU  19   5.507 -13.112   5.028
  159   2HB   GLU  19          1HB       GLU  19   4.002 -13.555   5.820
  160   1HG   GLU  19          2HG       GLU  19   4.374 -15.893   5.227
  161   2HG   GLU  19          1HG       GLU  19   5.881 -15.450   4.426
  162    H    ALA  20           H        ALA  20   3.412 -15.368   1.888
  163    HA   ALA  20           HA       ALA  20   1.240 -16.609   3.387
  164   1HB   ALA  20          1HB       ALA  20   0.776 -15.667   0.568
  165   2HB   ALA  20          2HB       ALA  20   0.275 -14.760   1.994
  166   3HB   ALA  20          3HB       ALA  20  -0.395 -16.361   1.688
  167    H    VAL  21           H        VAL  21   0.645 -18.657   2.668
  168    HA   VAL  21           HA       VAL  21   2.652 -20.391   1.965
  169    HB   VAL  21           HB       VAL  21  -0.238 -20.883   1.267
  170   1HG1  VAL  21          1HG1      VAL  21   0.235 -23.145   1.379
  171   2HG1  VAL  21          2HG1      VAL  21   1.699 -22.896   2.332
  172   3HG1  VAL  21          3HG1      VAL  21   1.683 -22.487   0.617
  173   1HG2  VAL  21          1HG2      VAL  21  -0.473 -20.190   3.451
  174   2HG2  VAL  21          2HG2      VAL  21   1.123 -20.780   3.923
  175   3HG2  VAL  21          3HG2      VAL  21  -0.194 -21.921   3.659
  176    H    ASP  22           H        ASP  22   0.430 -18.718  -0.180
  177    HA   ASP  22           HA       ASP  22   2.155 -19.425  -2.431
  178   1HB   ASP  22          2HB       ASP  22   0.062 -19.824  -3.843
  179   2HB   ASP  22          1HB       ASP  22   0.525 -21.099  -2.721
  180    H    ALA  23           H        ALA  23   1.576 -18.143  -4.430
  181    HA   ALA  23           HA       ALA  23   1.671 -15.423  -3.863
  182   1HB   ALA  23          1HB       ALA  23   1.452 -17.076  -6.271
  183   2HB   ALA  23          2HB       ALA  23   2.467 -15.672  -5.947
  184   3HB   ALA  23          3HB       ALA  23   0.788 -15.450  -6.438
  185    H    ALA  24           H        ALA  24  -1.065 -17.452  -4.786
  186    HA   ALA  24           HA       ALA  24  -2.945 -15.362  -5.031
  187   1HB   ALA  24          1HB       ALA  24  -3.912 -17.196  -5.922
  188   2HB   ALA  24          2HB       ALA  24  -4.482 -17.473  -4.276
  189   3HB   ALA  24          3HB       ALA  24  -3.037 -18.298  -4.860
  190    H    THR  25           H        THR  25  -2.327 -17.616  -2.317
  191    HA   THR  25           HA       THR  25  -4.072 -16.475  -0.495
  192    HB   THR  25           HB       THR  25  -2.427 -17.352   1.243
  193    HG1  THR  25           1HG      THR  25  -0.576 -17.159  -0.123
  194   1HG2  THR  25          1HG2      THR  25  -4.225 -18.776   0.547
  195   2HG2  THR  25          2HG2      THR  25  -2.742 -19.722   0.676
  196   3HG2  THR  25          3HG2      THR  25  -3.341 -19.235  -0.909
  197    H    ALA  26           H        ALA  26  -0.718 -15.645  -1.271
  198    HA   ALA  26           HA       ALA  26  -0.419 -13.577   0.616
  199   1HB   ALA  26          1HB       ALA  26   1.185 -12.759  -1.404
  200   2HB   ALA  26          2HB       ALA  26   0.985 -14.460  -1.822
  201   3HB   ALA  26          3HB       ALA  26   1.628 -14.010  -0.243
  202    H    GLU  27           H        GLU  27  -1.366 -13.513  -2.827
  203    HA   GLU  27           HA       GLU  27  -1.825 -10.806  -3.094
  204   1HB   GLU  27          2HB       GLU  27  -1.801 -12.367  -4.975
  205   2HB   GLU  27          1HB       GLU  27  -3.286 -13.107  -4.395
  206   1HG   GLU  27          2HG       GLU  27  -4.480 -11.014  -4.766
  207   2HG   GLU  27          1HG       GLU  27  -2.992 -10.262  -5.335
  208    H    LYS  28           H        LYS  28  -4.108 -13.361  -2.112
  209    HA   LYS  28           HA       LYS  28  -6.358 -11.729  -1.798
  210   1HB   LYS  28          2HB       LYS  28  -5.605 -14.251  -0.308
  211   2HB   LYS  28          1HB       LYS  28  -7.204 -13.518  -0.298
  212   1HG   LYS  28          2HG       LYS  28  -5.773 -14.683  -2.677
  213   2HG   LYS  28          1HG       LYS  28  -7.171 -15.360  -1.840
  214   1HD   LYS  28          2HD       LYS  28  -8.497 -13.407  -2.484
  215   2HD   LYS  28          1HD       LYS  28  -7.098 -12.732  -3.321
  216   1HE   LYS  28          2HE       LYS  28  -7.070 -14.656  -4.828
  217   2HE   LYS  28          1HE       LYS  28  -8.462 -15.339  -3.990
  218   1HZ   LYS  28          1HZ       LYS  28  -9.872 -13.788  -4.873
  219   2HZ   LYS  28          2HZ       LYS  28  -8.780 -13.960  -6.153
  220   3HZ   LYS  28          3HZ       LYS  28  -8.658 -12.632  -5.112
  221    H    VAL  29           H        VAL  29  -3.727 -12.517   0.400
  222    HA   VAL  29           HA       VAL  29  -4.771 -11.350   2.725
  223    HB   VAL  29           HB       VAL  29  -1.884 -11.598   1.852
  224   1HG1  VAL  29          1HG1      VAL  29  -3.065 -11.009   4.561
  225   2HG1  VAL  29          2HG1      VAL  29  -2.048  -9.945   3.591
  226   3HG1  VAL  29          3HG1      VAL  29  -1.377 -11.426   4.271
  227   1HG2  VAL  29          1HG2      VAL  29  -3.683 -13.603   2.405
  228   2HG2  VAL  29          2HG2      VAL  29  -2.859 -13.374   3.947
  229   3HG2  VAL  29          3HG2      VAL  29  -1.926 -13.738   2.495
  230    H    VAL  30           H        VAL  30  -3.036 -10.005  -0.012
  231    HA   VAL  30           HA       VAL  30  -2.601  -7.426   1.076
  232    HB   VAL  30           HB       VAL  30  -2.987  -8.062  -1.846
  233   1HG1  VAL  30          1HG1      VAL  30  -1.830  -6.113  -2.302
  234   2HG1  VAL  30          2HG1      VAL  30  -1.055  -6.082  -0.719
  235   3HG1  VAL  30          3HG1      VAL  30  -2.759  -5.658  -0.874
  236   1HG2  VAL  30          1HG2      VAL  30  -0.331  -8.167  -1.594
  237   2HG2  VAL  30          2HG2      VAL  30  -1.357  -9.596  -1.462
  238   3HG2  VAL  30          3HG2      VAL  30  -0.784  -8.784  -0.005
  239    H    LYS  31           H        LYS  31  -5.175  -8.775  -1.034
  240    HA   LYS  31           HA       LYS  31  -6.712  -6.531  -1.425
  241   1HB   LYS  31          2HB       LYS  31  -7.474  -9.410  -1.054
  242   2HB   LYS  31          1HB       LYS  31  -8.717  -8.181  -1.255
  243   1HG   LYS  31          2HG       LYS  31  -8.192  -9.261  -3.365
  244   2HG   LYS  31          1HG       LYS  31  -7.764  -7.551  -3.405
  245   1HD   LYS  31          2HD       LYS  31  -5.424  -8.167  -2.916
  246   2HD   LYS  31          1HD       LYS  31  -5.886  -9.867  -2.989
  247   1HE   LYS  31          2HE       LYS  31  -6.145  -7.879  -5.240
  248   2HE   LYS  31          1HE       LYS  31  -4.881  -9.099  -5.093
  249   1HZ   LYS  31          1HZ       LYS  31  -7.789  -9.662  -5.324
  250   2HZ   LYS  31          2HZ       LYS  31  -6.558 -10.818  -5.229
  251   3HZ   LYS  31          3HZ       LYS  31  -6.662  -9.804  -6.579
  252    H    GLN  32           H        GLN  32  -6.666  -8.676   1.366
  253    HA   GLN  32           HA       GLN  32  -8.689  -7.314   2.821
  254   1HB   GLN  32          2HB       GLN  32  -8.100  -9.583   3.413
  255   2HB   GLN  32          1HB       GLN  32  -6.441  -9.123   3.740
  256   1HG   GLN  32          2HG       GLN  32  -8.758  -8.007   5.285
  257   2HG   GLN  32          1HG       GLN  32  -7.971  -9.515   5.726
  258   1HE2  GLN  32          1HE2      GLN  32  -5.409  -7.985   4.620
  259   2HE2  GLN  32          2HE2      GLN  32  -4.914  -7.099   6.012
  260    H    PHE  33           H        PHE  33  -5.225  -7.000   2.531
  261    HA   PHE  33           HA       PHE  33  -4.654  -5.221   4.589
  262   1HB   PHE  33          2HB       PHE  33  -3.009  -6.396   3.093
  263   2HB   PHE  33          1HB       PHE  33  -3.415  -5.252   1.823
  264    HD1  PHE  33           1HD      PHE  33  -2.111  -5.436   5.288
  265    HD2  PHE  33           2HD      PHE  33  -2.226  -3.261   1.620
  266    HE1  PHE  33           1HE      PHE  33  -0.369  -3.914   6.125
  267    HE2  PHE  33           2HE      PHE  33  -0.484  -1.744   2.469
  268    HZ   PHE  33           HZ       PHE  33   0.444  -2.082   4.728
  269    H    PHE  34           H        PHE  34  -5.318  -4.455   1.185
  270    HA   PHE  34           HA       PHE  34  -5.616  -1.651   1.670
  271   1HB   PHE  34          2HB       PHE  34  -6.323  -3.312  -0.750
  272   2HB   PHE  34          1HB       PHE  34  -6.311  -1.547  -0.697
  273    HD1  PHE  34           1HD      PHE  34  -3.980  -0.853   0.759
  274    HD2  PHE  34           2HD      PHE  34  -4.522  -4.028  -2.014
  275    HE1  PHE  34           1HE      PHE  34  -1.568  -0.862   0.309
  276    HE2  PHE  34           2HE      PHE  34  -2.105  -4.038  -2.480
  277    HZ   PHE  34           HZ       PHE  34  -0.634  -2.453  -1.304
  278    H    ASN  35           H        ASN  35  -7.870  -4.320   1.170
  279    HA   ASN  35           HA       ASN  35 -10.273  -2.973   0.999
  280   1HB   ASN  35          2HB       ASN  35 -10.129  -5.403   0.834
  281   2HB   ASN  35          1HB       ASN  35  -9.636  -5.517   2.519
  282   1HD2  ASN  35          1HD2      ASN  35 -12.058  -6.253   0.687
  283   2HD2  ASN  35          2HD2      ASN  35 -13.406  -5.904   1.706
  284    H    ASP  36           H        ASP  36  -8.292  -3.688   3.778
  285    HA   ASP  36           HA       ASP  36 -10.149  -2.356   5.592
  286   1HB   ASP  36          2HB       ASP  36  -7.616  -3.908   6.139
  287   2HB   ASP  36          1HB       ASP  36  -8.630  -3.186   7.384
  288    H    ASN  37           H        ASN  37  -7.098  -1.695   4.010
  289    HA   ASN  37           HA       ASN  37  -6.399   0.423   5.852
  290   1HB   ASN  37          2HB       ASN  37  -5.313  -0.301   3.118
  291   2HB   ASN  37          1HB       ASN  37  -4.712   1.047   4.075
  292   1HD2  ASN  37          1HD2      ASN  37  -3.598  -1.620   3.107
  293   2HD2  ASN  37          2HD2      ASN  37  -2.873  -2.291   4.525
  294    H    GLY  38           H        GLY  38  -7.681   0.117   2.602
  295   1HA   GLY  38          2HA       GLY  38  -8.150   2.094   1.239
  296   2HA   GLY  38          1HA       GLY  38  -9.601   1.462   1.981
  297    H    VAL  39           H        VAL  39 -10.874   2.955   2.683
  298    HA   VAL  39           HA       VAL  39  -9.883   5.620   3.138
  299    HB   VAL  39           HB       VAL  39 -12.700   4.573   3.116
  300   1HG1  VAL  39          1HG1      VAL  39 -13.095   6.536   4.169
  301   2HG1  VAL  39          2HG1      VAL  39 -12.938   7.189   2.539
  302   3HG1  VAL  39          3HG1      VAL  39 -11.567   7.247   3.647
  303   1HG2  VAL  39          1HG2      VAL  39 -10.930   5.783   1.022
  304   2HG2  VAL  39          2HG2      VAL  39 -12.689   5.837   0.894
  305   3HG2  VAL  39          3HG2      VAL  39 -11.855   4.283   0.960
  306    H    ASP  40           H        ASP  40 -11.660   3.271   5.220
  307    HA   ASP  40           HA       ASP  40 -11.446   5.234   7.367
  308   1HB   ASP  40          2HB       ASP  40 -13.010   2.659   7.193
  309   2HB   ASP  40          1HB       ASP  40 -13.015   3.747   8.578
  310    H    GLY  41           H        GLY  41  -9.079   3.660   6.498
  311   1HA   GLY  41          2HA       GLY  41  -8.607   1.705   8.549
  312   2HA   GLY  41          1HA       GLY  41  -7.408   2.360   7.440
  313    H    GLU  42           H        GLU  42  -6.621   1.936  10.002
  314    HA   GLU  42           HA       GLU  42  -6.887   4.442  11.473
  315   1HB   GLU  42          2HB       GLU  42  -5.376   1.910  12.160
  316   2HB   GLU  42          1HB       GLU  42  -5.603   3.288  13.230
  317   1HG   GLU  42          2HG       GLU  42  -8.010   2.909  13.221
  318   2HG   GLU  42          1HG       GLU  42  -7.793   1.538  12.133
  319    H    TRP  43           H        TRP  43  -5.717   5.966  10.330
  320    HA   TRP  43           HA       TRP  43  -2.963   5.340   9.592
  321   1HB   TRP  43          2HB       TRP  43  -4.638   7.780   8.995
  322   2HB   TRP  43          1HB       TRP  43  -3.033   7.455   8.353
  323    HD1  TRP  43           HD       TRP  43  -6.041   5.019   8.479
  324    HE1  TRP  43           1HE      TRP  43  -6.548   4.271   6.067
  325    HE3  TRP  43           3HE      TRP  43  -2.628   7.896   6.026
  326    HZ2  TRP  43           2HZ      TRP  43  -5.614   4.831   3.472
  327    HZ3  TRP  43           3HZ      TRP  43  -2.488   7.734   3.583
  328    HH2  TRP  43           HH       TRP  43  -3.959   6.232   2.327
  329    H    THR  44           H        THR  44  -1.336   5.848  10.877
  330    HA   THR  44           HA       THR  44  -1.649   8.085  12.761
  331    HB   THR  44           HB       THR  44   0.280   7.053  13.971
  332    HG1  THR  44           1HG      THR  44   0.993   5.874  12.032
  333   1HG2  THR  44          1HG2      THR  44  -1.216   4.699  14.151
  334   2HG2  THR  44          2HG2      THR  44  -2.372   5.991  13.825
  335   3HG2  THR  44          3HG2      THR  44  -1.284   6.109  15.208
  336    H    TYR  45           H        TYR  45  -0.316   9.837  12.563
  337    HA   TYR  45           HA       TYR  45   1.577   9.766  10.315
  338   1HB   TYR  45          2HB       TYR  45  -0.246  11.394  10.113
  339   2HB   TYR  45          1HB       TYR  45   0.238  12.136  11.633
  340    HD1  TYR  45           1HD      TYR  45   2.339  10.987   8.778
  341    HD2  TYR  45           2HD      TYR  45   0.934  14.283  11.070
  342    HE1  TYR  45           1HE      TYR  45   3.864  12.479   7.555
  343    HE2  TYR  45           2HE      TYR  45   2.455  15.785   9.854
  344    HH   TYR  45           HH       TYR  45   4.757  15.417   8.556
  345    H    ASP  46           H        ASP  46   3.659  10.484  10.500
  346    HA   ASP  46           HA       ASP  46   4.593  11.136  13.217
  347   1HB   ASP  46          2HB       ASP  46   5.262   8.848  12.624
  348   2HB   ASP  46          1HB       ASP  46   6.016   9.443  11.149
  349    H    ASP  47           H        ASP  47   4.357  13.355  12.575
  350    HA   ASP  47           HA       ASP  47   5.398  14.648  10.405
  351   1HB   ASP  47          2HB       ASP  47   5.422  15.631  13.267
  352   2HB   ASP  47          1HB       ASP  47   5.608  16.649  11.841
  353    H    ALA  48           H        ALA  48   7.144  13.491  13.223
  354    HA   ALA  48           HA       ALA  48   9.550  14.791  12.995
  355   1HB   ALA  48          1HB       ALA  48   8.675  12.927  14.642
  356   2HB   ALA  48          2HB       ALA  48  10.397  13.234  14.427
  357   3HB   ALA  48          3HB       ALA  48   9.632  11.883  13.592
  358    H    THR  49           H        THR  49   8.363  12.123  11.033
  359    HA   THR  49           HA       THR  49  10.758  12.418   9.344
  360    HB   THR  49           HB       THR  49  10.644  10.002   8.850
  361    HG1  THR  49           1HG      THR  49   8.434   9.696   9.365
  362   1HG2  THR  49          1HG2      THR  49  11.479   9.137  10.936
  363   2HG2  THR  49          2HG2      THR  49  10.809  10.515  11.808
  364   3HG2  THR  49          3HG2      THR  49  12.123  10.754  10.655
  365    H    LYS  50           H        LYS  50   7.689  13.203   9.348
  366    HA   LYS  50           HA       LYS  50   6.054  13.507   7.767
  367   1HB   LYS  50          2HB       LYS  50   8.371  13.134   5.868
  368   2HB   LYS  50          1HB       LYS  50   6.816  13.860   5.474
  369   1HG   LYS  50          2HG       LYS  50   7.620  15.347   7.622
  370   2HG   LYS  50          1HG       LYS  50   9.144  15.013   6.794
  371   1HD   LYS  50          2HD       LYS  50   8.130  15.814   4.693
  372   2HD   LYS  50          1HD       LYS  50   6.666  16.220   5.589
  373   1HE   LYS  50          2HE       LYS  50   8.090  18.185   5.236
  374   2HE   LYS  50          1HE       LYS  50   7.913  17.803   6.947
  375   1HZ   LYS  50          1HZ       LYS  50  10.222  16.823   5.387
  376   2HZ   LYS  50          2HZ       LYS  50  10.074  16.986   7.064
  377   3HZ   LYS  50          3HZ       LYS  50  10.228  18.360   6.092
  378    H    THR  51           H        THR  51   6.593  10.808   8.716
  379    HA   THR  51           HA       THR  51   5.921   9.196   6.365
  380    HB   THR  51           HB       THR  51   6.892   8.380   9.106
  381    HG1  THR  51           1HG      THR  51   8.154   8.432   6.572
  382   1HG2  THR  51          1HG2      THR  51   7.343   6.282   7.389
  383   2HG2  THR  51          2HG2      THR  51   5.702   6.797   6.999
  384   3HG2  THR  51          3HG2      THR  51   6.118   6.355   8.655
  385    H    PHE  52           H        PHE  52   4.141   7.778   6.374
  386    HA   PHE  52           HA       PHE  52   2.158   8.314   8.486
  387   1HB   PHE  52          2HB       PHE  52   1.601   7.850   5.558
  388   2HB   PHE  52          1HB       PHE  52   0.394   8.095   6.815
  389    HD1  PHE  52           1HD      PHE  52  -0.370  10.229   7.282
  390    HD2  PHE  52           2HD      PHE  52   3.310   9.742   5.203
  391    HE1  PHE  52           1HE      PHE  52  -0.270  12.658   6.899
  392    HE2  PHE  52           2HE      PHE  52   3.419  12.169   4.819
  393    HZ   PHE  52           HZ       PHE  52   1.627  13.629   5.666
  394    H    THR  53           H        THR  53   2.457   6.550   9.653
  395    HA   THR  53           HA       THR  53   2.601   3.907   8.511
  396    HB   THR  53           HB       THR  53   2.287   3.229  11.010
  397    HG1  THR  53           1HG      THR  53   3.151   5.887  11.382
  398   1HG2  THR  53          1HG2      THR  53   4.668   4.463   9.745
  399   2HG2  THR  53          2HG2      THR  53   4.389   2.801  10.271
  400   3HG2  THR  53          3HG2      THR  53   4.718   4.063  11.462
  401    H    VAL  54           H        VAL  54   1.015   2.631   7.975
  402    HA   VAL  54           HA       VAL  54  -1.692   3.219   8.980
  403    HB   VAL  54           HB       VAL  54  -0.920   1.893   6.369
  404   1HG1  VAL  54          1HG1      VAL  54  -3.480   2.206   7.807
  405   2HG1  VAL  54          2HG1      VAL  54  -2.966   0.976   6.651
  406   3HG1  VAL  54          3HG1      VAL  54  -3.510   2.554   6.078
  407   1HG2  VAL  54          1HG2      VAL  54  -0.418   4.181   6.141
  408   2HG2  VAL  54          2HG2      VAL  54  -1.858   4.670   7.034
  409   3HG2  VAL  54          3HG2      VAL  54  -2.014   3.982   5.418
  410    H    THR  55           H        THR  55  -2.246   1.815  10.510
  411    HA   THR  55           HA       THR  55  -1.212  -0.920  10.366
  412    HB   THR  55           HB       THR  55  -2.590   0.430  12.688
  413    HG1  THR  55           1HG      THR  55  -0.465   0.660  13.497
  414   1HG2  THR  55          1HG2      THR  55  -2.684  -1.922  12.978
  415   2HG2  THR  55          2HG2      THR  55  -1.381  -1.316  13.999
  416   3HG2  THR  55          3HG2      THR  55  -1.006  -2.114  12.471
  417    H    GLU  56           H        GLU  56  -2.475  -2.417   9.502
  418    HA   GLU  56           HA       GLU  56  -5.302  -1.969   9.180
  419   1HB   GLU  56          2HB       GLU  56  -3.813  -3.093   7.477
  420   2HB   GLU  56          1HB       GLU  56  -3.743  -4.480   8.555
  421   1HG   GLU  56          2HG       GLU  56  -6.262  -3.344   7.365
  422   2HG   GLU  56          1HG       GLU  56  -5.384  -4.736   6.737
  423   1H    MET   1          1HT       MET   1   5.190  17.535  -1.282
  424   2H    MET   1          2HT       MET   1   5.860  18.911  -1.996
  425   3H    MET   1          3HT       MET   1   5.815  18.773  -0.313
  426    HA   MET   1           HA       MET   1   7.773  17.894  -2.138
  427   1HB   MET   1          2HB       MET   1   9.048  17.582  -0.025
  428   2HB   MET   1          1HB       MET   1   8.278  19.145  -0.165
  429   1HG   MET   1          2HG       MET   1   7.764  18.717   1.972
  430   2HG   MET   1          1HG       MET   1   6.394  17.913   1.223
  431   1HE   MET   1          1HE       MET   1   9.745  17.115   3.488
  432   2HE   MET   1          2HE       MET   1  10.064  17.389   1.776
  433   3HE   MET   1          3HE       MET   1  10.233  15.770   2.456
  434    H    GLN   2           H        GLN   2   9.010  15.822  -0.543
  435    HA   GLN   2           HA       GLN   2   7.424  13.576  -1.540
  436   1HB   GLN   2          2HB       GLN   2   9.739  13.727  -2.315
  437   2HB   GLN   2          1HB       GLN   2  10.313  13.699  -0.653
  438   1HG   GLN   2          2HG       GLN   2   9.408  11.446  -0.381
  439   2HG   GLN   2          1HG       GLN   2   8.836  11.476  -2.046
  440   1HE2  GLN   2          1HE2      GLN   2  11.689  13.123  -2.062
  441   2HE2  GLN   2          2HE2      GLN   2  12.760  11.830  -2.452
  442    H    TYR   3           H        TYR   3   6.366  12.251  -0.228
  443    HA   TYR   3           HA       TYR   3   7.120  12.208   2.619
  444   1HB   TYR   3          2HB       TYR   3   4.330  12.006   1.459
  445   2HB   TYR   3          1HB       TYR   3   4.744  11.928   3.170
  446    HD1  TYR   3           1HD      TYR   3   4.313  13.854   4.366
  447    HD2  TYR   3           2HD      TYR   3   5.458  14.206   0.278
  448    HE1  TYR   3           1HE      TYR   3   4.127  16.300   4.525
  449    HE2  TYR   3           2HE      TYR   3   5.300  16.656   0.432
  450    HH   TYR   3           HH       TYR   3   3.990  18.230   3.283
  451    H    LYS   4           H        LYS   4   7.037  10.219   3.676
  452    HA   LYS   4           HA       LYS   4   6.846   7.902   1.866
  453   1HB   LYS   4          2HB       LYS   4   9.081   8.252   2.788
  454   2HB   LYS   4          1HB       LYS   4   8.429   8.223   4.421
  455   1HG   LYS   4          2HG       LYS   4   7.737   5.892   4.092
  456   2HG   LYS   4          1HG       LYS   4   8.437   5.926   2.473
  457   1HD   LYS   4          2HD       LYS   4   9.943   6.368   5.051
  458   2HD   LYS   4          1HD       LYS   4   9.950   4.884   4.098
  459   1HE   LYS   4          2HE       LYS   4  10.917   7.586   3.171
  460   2HE   LYS   4          1HE       LYS   4  11.941   6.239   3.670
  461   1HZ   LYS   4          1HZ       LYS   4  11.831   6.257   1.308
  462   2HZ   LYS   4          2HZ       LYS   4  10.143   6.341   1.314
  463   3HZ   LYS   4          3HZ       LYS   4  10.918   4.935   1.840
  464    H    VAL   5           H        VAL   5   4.908   6.962   2.084
  465    HA   VAL   5           HA       VAL   5   3.675   6.847   4.730
  466    HB   VAL   5           HB       VAL   5   2.572   6.074   2.026
  467   1HG1  VAL   5          1HG1      VAL   5   1.213   6.134   4.716
  468   2HG1  VAL   5          2HG1      VAL   5   1.568   4.700   3.753
  469   3HG1  VAL   5          3HG1      VAL   5   0.404   5.889   3.169
  470   1HG2  VAL   5          1HG2      VAL   5   2.851   8.585   3.296
  471   2HG2  VAL   5          2HG2      VAL   5   1.137   8.168   3.304
  472   3HG2  VAL   5          3HG2      VAL   5   2.028   8.206   1.783
  473    H    ILE   6           H        ILE   6   4.029   5.190   5.979
  474    HA   ILE   6           HA       ILE   6   4.982   2.671   4.836
  475    HB   ILE   6           HB       ILE   6   4.828   3.495   7.741
  476   1HG1  ILE   6          2HG1      ILE   6   7.203   3.371   5.873
  477   2HG1  ILE   6          1HG1      ILE   6   6.407   4.849   6.393
  478   1HG2  ILE   6          1HG2      ILE   6   6.563   1.300   6.716
  479   2HG2  ILE   6          2HG2      ILE   6   4.850   0.979   6.979
  480   3HG2  ILE   6          3HG2      ILE   6   5.858   1.526   8.316
  481   1HD1  ILE   6          1HD1      ILE   6   7.072   4.453   8.673
  482   2HD1  ILE   6          2HD1      ILE   6   8.485   4.372   7.621
  483   3HD1  ILE   6          3HD1      ILE   6   7.755   2.888   8.233
  484    H    LEU   7           H        LEU   7   3.794   0.902   4.710
  485    HA   LEU   7           HA       LEU   7   1.096   0.960   5.879
  486   1HB   LEU   7          2HB       LEU   7   1.987  -0.877   3.675
  487   2HB   LEU   7          1HB       LEU   7   0.363  -0.335   4.065
  488    HG   LEU   7           HG       LEU   7   2.540   1.321   2.805
  489   1HD1  LEU   7          1HD1      LEU   7   1.430  -0.349   1.348
  490   2HD1  LEU   7          2HD1      LEU   7   1.148   1.320   0.853
  491   3HD1  LEU   7          3HD1      LEU   7  -0.115   0.424   1.700
  492   1HD2  LEU   7          1HD2      LEU   7  -0.290   2.118   3.472
  493   2HD2  LEU   7          2HD2      LEU   7   0.950   3.123   2.721
  494   3HD2  LEU   7          3HD2      LEU   7   1.132   2.599   4.395
  495    H    ASN   8           H        ASN   8   1.558   0.100   7.912
  496    HA   ASN   8           HA       ASN   8   2.900  -2.492   8.036
  497   1HB   ASN   8          2HB       ASN   8   1.990  -0.676  10.277
  498   2HB   ASN   8          1HB       ASN   8   2.961  -2.134  10.458
  499   1HD2  ASN   8          1HD2      ASN   8   5.048  -1.822  10.633
  500   2HD2  ASN   8          2HD2      ASN   8   5.931  -0.465  10.029
  501    H    GLY   9           H        GLY   9   1.567  -4.175   7.653
  502   1HA   GLY   9          2HA       GLY   9  -1.082  -4.132   8.961
  503   2HA   GLY   9          1HA       GLY   9  -0.719  -5.026   7.495
  504    H    LYS  10           H        LYS  10  -1.796  -6.697   8.925
  505    HA   LYS  10           HA       LYS  10  -0.223  -7.794  11.052
  506   1HB   LYS  10          2HB       LYS  10  -2.595  -8.928   9.568
  507   2HB   LYS  10          1HB       LYS  10  -1.891  -9.628  11.019
  508   1HG   LYS  10          2HG       LYS  10  -2.415  -7.521  12.221
  509   2HG   LYS  10          1HG       LYS  10  -3.244  -6.951  10.772
  510   1HD   LYS  10          2HD       LYS  10  -3.952  -9.467  12.280
  511   2HD   LYS  10          1HD       LYS  10  -4.768  -7.916  12.481
  512   1HE   LYS  10          2HE       LYS  10  -6.102  -9.190  10.999
  513   2HE   LYS  10          1HE       LYS  10  -5.270  -7.991  10.014
  514   1HZ   LYS  10          1HZ       LYS  10  -5.330 -10.678   9.566
  515   2HZ   LYS  10          2HZ       LYS  10  -3.797 -10.434  10.234
  516   3HZ   LYS  10          3HZ       LYS  10  -4.264  -9.578   8.851
  517    H    THR  11           H        THR  11  -1.125  -8.990   7.811
  518    HA   THR  11           HA       THR  11   1.171 -10.807   7.887
  519    HB   THR  11           HB       THR  11  -0.135 -11.780   5.854
  520    HG1  THR  11           1HG      THR  11  -1.605  -9.874   5.979
  521   1HG2  THR  11          1HG2      THR  11  -0.210 -13.289   7.530
  522   2HG2  THR  11          2HG2      THR  11  -1.893 -12.766   7.583
  523   3HG2  THR  11          3HG2      THR  11  -0.727 -12.101   8.725
  524    H    LEU  12           H        LEU  12   0.599  -7.807   6.901
  525    HA   LEU  12           HA       LEU  12   2.375  -8.083   4.598
  526   1HB   LEU  12          2HB       LEU  12   0.138  -7.913   3.678
  527   2HB   LEU  12          1HB       LEU  12  -0.182  -6.484   4.641
  528    HG   LEU  12           HG       LEU  12   1.337  -5.174   3.348
  529   1HD1  LEU  12          1HD1      LEU  12   2.251  -6.645   1.244
  530   2HD1  LEU  12          2HD1      LEU  12   2.370  -7.795   2.575
  531   3HD1  LEU  12          3HD1      LEU  12   3.189  -6.244   2.681
  532   1HD2  LEU  12          1HD2      LEU  12  -0.083  -4.905   1.653
  533   2HD2  LEU  12          2HD2      LEU  12  -0.971  -6.263   2.340
  534   3HD2  LEU  12          3HD2      LEU  12   0.196  -6.538   1.048
  535    H    LYS  13           H        LYS  13   3.878  -6.520   4.404
  536    HA   LYS  13           HA       LYS  13   3.692  -4.103   6.026
  537   1HB   LYS  13          2HB       LYS  13   6.035  -6.011   6.215
  538   2HB   LYS  13          1HB       LYS  13   5.924  -4.437   6.994
  539   1HG   LYS  13          2HG       LYS  13   4.055  -5.217   8.342
  540   2HG   LYS  13          1HG       LYS  13   4.123  -6.788   7.539
  541   1HD   LYS  13          2HD       LYS  13   6.388  -7.128   8.406
  542   2HD   LYS  13          1HD       LYS  13   6.316  -5.558   9.209
  543   1HE   LYS  13          2HE       LYS  13   4.428  -6.335  10.555
  544   2HE   LYS  13          1HE       LYS  13   4.490  -7.899   9.746
  545   1HZ   LYS  13          1HZ       LYS  13   6.260  -6.790  11.785
  546   2HZ   LYS  13          2HZ       LYS  13   6.972  -7.768  10.603
  547   3HZ   LYS  13          3HZ       LYS  13   5.723  -8.378  11.567
  548    H    GLY  14           H        GLY  14   4.883  -2.371   5.188
  549   1HA   GLY  14          2HA       GLY  14   6.913  -2.631   3.251
  550   2HA   GLY  14          1HA       GLY  14   5.378  -2.414   2.428
  551    H    GLU  15           H        GLU  15   6.612  -0.514   1.633
  552    HA   GLU  15           HA       GLU  15   5.838   1.812   3.178
  553   1HB   GLU  15          2HB       GLU  15   8.696   1.422   2.276
  554   2HB   GLU  15          1HB       GLU  15   8.041   2.877   3.014
  555   1HG   GLU  15          2HG       GLU  15   7.590   1.631   5.066
  556   2HG   GLU  15          1HG       GLU  15   8.249   0.175   4.325
  557    H    THR  16           H        THR  16   5.430   3.576   2.002
  558    HA   THR  16           HA       THR  16   5.940   3.453  -0.872
  559    HB   THR  16           HB       THR  16   3.723   2.626  -0.666
  560    HG1  THR  16           1HG      THR  16   4.162   4.344  -2.174
  561   1HG2  THR  16          1HG2      THR  16   2.859   3.137   1.394
  562   2HG2  THR  16          2HG2      THR  16   1.958   4.230   0.342
  563   3HG2  THR  16          3HG2      THR  16   3.325   4.832   1.274
  564    H    THR  17           H        THR  17   5.373   5.611  -1.920
  565    HA   THR  17           HA       THR  17   5.768   7.856  -0.095
  566    HB   THR  17           HB       THR  17   7.596   8.755  -1.507
  567    HG1  THR  17           1HG      THR  17   7.423   6.212  -2.742
  568   1HG2  THR  17          1HG2      THR  17   7.837   6.888   0.458
  569   2HG2  THR  17          2HG2      THR  17   9.173   7.762  -0.291
  570   3HG2  THR  17          3HG2      THR  17   8.739   6.152  -0.867
  571    H    THR  18           H        THR  18   4.359   9.351  -0.516
  572    HA   THR  18           HA       THR  18   3.352   9.716  -3.277
  573    HB   THR  18           HB       THR  18   1.655   9.090  -1.559
  574    HG1  THR  18           1HG      THR  18   1.119  10.431  -3.359
  575   1HG2  THR  18          1HG2      THR  18   0.928  10.905   0.010
  576   2HG2  THR  18          2HG2      THR  18   2.487  11.676  -0.285
  577   3HG2  THR  18          3HG2      THR  18   2.421  10.072   0.445
  578    H    GLU  19           H        GLU  19   3.330  11.797  -4.155
  579    HA   GLU  19           HA       GLU  19   4.975  13.769  -2.709
  580   1HB   GLU  19          2HB       GLU  19   5.895  13.026  -4.857
  581   2HB   GLU  19          1HB       GLU  19   4.412  13.505  -5.671
  582   1HG   GLU  19          2HG       GLU  19   4.833  15.834  -5.071
  583   2HG   GLU  19          1HG       GLU  19   6.317  15.353  -4.252
  584    H    ALA  20           H        ALA  20   3.810  15.332  -1.748
  585    HA   ALA  20           HA       ALA  20   1.691  16.625  -3.276
  586   1HB   ALA  20          1HB       ALA  20   1.165  15.697  -0.464
  587   2HB   ALA  20          2HB       ALA  20   0.662  14.803  -1.899
  588   3HB   ALA  20          3HB       ALA  20   0.026  16.419  -1.601
  589    H    VAL  21           H        VAL  21   1.136  18.689  -2.567
  590    HA   VAL  21           HA       VAL  21   3.174  20.374  -1.835
  591    HB   VAL  21           HB       VAL  21   0.287  20.936  -1.177
  592   1HG1  VAL  21          1HG1      VAL  21   0.817  23.185  -1.282
  593   2HG1  VAL  21          2HG1      VAL  21   2.287  22.901  -2.215
  594   3HG1  VAL  21          3HG1      VAL  21   2.238  22.492  -0.501
  595   1HG2  VAL  21          1HG2      VAL  21   0.068  20.249  -3.364
  596   2HG2  VAL  21          2HG2      VAL  21   1.683  20.798  -3.813
  597   3HG2  VAL  21          3HG2      VAL  21   0.390  21.972  -3.567
  598    H    ASP  22           H        ASP  22   0.882  18.756   0.278
  599    HA   ASP  22           HA       ASP  22   2.592  19.420   2.554
  600   1HB   ASP  22          2HB       ASP  22   0.489  19.869   3.936
  601   2HB   ASP  22          1HB       ASP  22   0.998  21.133   2.821
  602    H    ALA  23           H        ALA  23   1.954  18.152   4.544
  603    HA   ALA  23           HA       ALA  23   1.990  15.430   3.978
  604   1HB   ALA  23          1HB       ALA  23   1.778  17.088   6.384
  605   2HB   ALA  23          2HB       ALA  23   2.762  15.660   6.074
  606   3HB   ALA  23          3HB       ALA  23   1.071  15.480   6.541
  607    H    ALA  24           H        ALA  24  -0.708  17.526   4.864
  608    HA   ALA  24           HA       ALA  24  -2.643  15.481   5.082
  609   1HB   ALA  24          1HB       ALA  24  -3.576  17.339   5.958
  610   2HB   ALA  24          2HB       ALA  24  -4.117  17.630   4.305
  611   3HB   ALA  24          3HB       ALA  24  -2.659  18.419   4.909
  612    H    THR  25           H        THR  25  -1.932  17.721   2.377
  613    HA   THR  25           HA       THR  25  -3.678  16.622   0.529
  614    HB   THR  25           HB       THR  25  -1.988  17.458  -1.184
  615    HG1  THR  25           1HG      THR  25  -0.162  17.220   0.207
  616   1HG2  THR  25          1HG2      THR  25  -3.759  18.926  -0.514
  617   2HG2  THR  25          2HG2      THR  25  -2.252  19.837  -0.622
  618   3HG2  THR  25          3HG2      THR  25  -2.886  19.362   0.955
  619    H    ALA  26           H        ALA  26  -0.356  15.710   1.353
  620    HA   ALA  26           HA       ALA  26  -0.081  13.637  -0.530
  621   1HB   ALA  26          1HB       ALA  26   1.475  12.779   1.513
  622   2HB   ALA  26          2HB       ALA  26   1.310  14.486   1.928
  623   3HB   ALA  26          3HB       ALA  26   1.964  14.019   0.358
  624    H    GLU  27           H        GLU  27  -1.077  13.596   2.898
  625    HA   GLU  27           HA       GLU  27  -1.605  10.901   3.160
  626   1HB   GLU  27          2HB       GLU  27  -1.570  12.460   5.040
  627   2HB   GLU  27          1HB       GLU  27  -3.029  13.236   4.439
  628   1HG   GLU  27          2HG       GLU  27  -4.278  11.174   4.793
  629   2HG   GLU  27          1HG       GLU  27  -2.817  10.384   5.383
  630    H    LYS  28           H        LYS  28  -3.811  13.508   2.146
  631    HA   LYS  28           HA       LYS  28  -6.096  11.933   1.799
  632   1HB   LYS  28          2HB       LYS  28  -5.261  14.437   0.321
  633   2HB   LYS  28          1HB       LYS  28  -6.877  13.741   0.288
  634   1HG   LYS  28          2HG       LYS  28  -5.453  14.872   2.686
  635   2HG   LYS  28          1HG       LYS  28  -6.822  15.583   1.831
  636   1HD   LYS  28          2HD       LYS  28  -8.203  13.663   2.455
  637   2HD   LYS  28          1HD       LYS  28  -6.832  12.953   3.311
  638   1HE   LYS  28          2HE       LYS  28  -6.779  14.877   4.819
  639   2HE   LYS  28          1HE       LYS  28  -8.142  15.594   3.961
  640   1HZ   LYS  28          1HZ       LYS  28  -9.601  14.076   4.826
  641   2HZ   LYS  28          2HZ       LYS  28  -8.524  14.223   6.120
  642   3HZ   LYS  28          3HZ       LYS  28  -8.420  12.892   5.081
  643    H    VAL  29           H        VAL  29  -3.416  12.656  -0.360
  644    HA   VAL  29           HA       VAL  29  -4.456  11.515  -2.701
  645    HB   VAL  29           HB       VAL  29  -1.576  11.693  -1.786
  646   1HG1  VAL  29          1HG1      VAL  29  -2.733  11.131  -4.513
  647   2HG1  VAL  29          2HG1      VAL  29  -1.756  10.043  -3.527
  648   3HG1  VAL  29          3HG1      VAL  29  -1.039  11.508  -4.199
  649   1HG2  VAL  29          1HG2      VAL  29  -3.318  13.740  -2.365
  650   2HG2  VAL  29          2HG2      VAL  29  -2.479  13.491  -3.895
  651   3HG2  VAL  29          3HG2      VAL  29  -1.557  13.833  -2.431
  652    H    VAL  30           H        VAL  30  -2.791  10.130   0.062
  653    HA   VAL  30           HA       VAL  30  -2.404   7.539  -1.023
  654    HB   VAL  30           HB       VAL  30  -2.815   8.186   1.894
  655   1HG1  VAL  30          1HG1      VAL  30  -1.713   6.208   2.367
  656   2HG1  VAL  30          2HG1      VAL  30  -0.916   6.159   0.795
  657   3HG1  VAL  30          3HG1      VAL  30  -2.633   5.777   0.925
  658   1HG2  VAL  30          1HG2      VAL  30  -0.156   8.225   1.681
  659   2HG2  VAL  30          2HG2      VAL  30  -1.144   9.679   1.534
  660   3HG2  VAL  30          3HG2      VAL  30  -0.571   8.853   0.086
  661    H    LYS  31           H        LYS  31  -4.975   8.950   1.051
  662    HA   LYS  31           HA       LYS  31  -6.571   6.745   1.421
  663   1HB   LYS  31          2HB       LYS  31  -7.258   9.640   1.040
  664   2HB   LYS  31          1HB       LYS  31  -8.532   8.444   1.222
  665   1HG   LYS  31          2HG       LYS  31  -8.012   9.511   3.341
  666   2HG   LYS  31          1HG       LYS  31  -7.625   7.789   3.386
  667   1HD   LYS  31          2HD       LYS  31  -5.265   8.349   2.930
  668   2HD   LYS  31          1HD       LYS  31  -5.687  10.060   2.997
  669   1HE   LYS  31          2HE       LYS  31  -6.026   8.079   5.244
  670   2HE   LYS  31          1HE       LYS  31  -4.731   9.268   5.114
  671   1HZ   LYS  31          1HZ       LYS  31  -7.627   9.902   5.306
  672   2HZ   LYS  31          2HZ       LYS  31  -6.368  11.028   5.228
  673   3HZ   LYS  31          3HZ       LYS  31  -6.514  10.016   6.575
  674    H    GLN  32           H        GLN  32  -6.433   8.887  -1.369
  675    HA   GLN  32           HA       GLN  32  -8.468   7.575  -2.854
  676   1HB   GLN  32          2HB       GLN  32  -7.815   9.828  -3.436
  677   2HB   GLN  32          1HB       GLN  32  -6.164   9.329  -3.738
  678   1HG   GLN  32          2HG       GLN  32  -8.486   8.269  -5.317
  679   2HG   GLN  32          1HG       GLN  32  -7.655   9.759  -5.747
  680   1HE2  GLN  32          1HE2      GLN  32  -5.148   8.165  -4.605
  681   2HE2  GLN  32          2HE2      GLN  32  -4.655   7.269  -5.992
  682    H    PHE  33           H        PHE  33  -5.018   7.177  -2.515
  683    HA   PHE  33           HA       PHE  33  -4.461   5.384  -4.563
  684   1HB   PHE  33          2HB       PHE  33  -2.809   6.520  -3.045
  685   2HB   PHE  33          1HB       PHE  33  -3.260   5.386  -1.781
  686    HD1  PHE  33           1HD      PHE  33  -1.904   5.538  -5.227
  687    HD2  PHE  33           2HD      PHE  33  -2.122   3.366  -1.562
  688    HE1  PHE  33           1HE      PHE  33  -0.187   3.974  -6.040
  689    HE2  PHE  33           2HE      PHE  33  -0.407   1.808  -2.386
  690    HZ   PHE  33           HZ       PHE  33   0.561   2.121  -4.632
  691    H    PHE  34           H        PHE  34  -5.191   4.636  -1.170
  692    HA   PHE  34           HA       PHE  34  -5.550   1.839  -1.660
  693   1HB   PHE  34          2HB       PHE  34  -6.250   3.517   0.751
  694   2HB   PHE  34          1HB       PHE  34  -6.281   1.752   0.697
  695    HD1  PHE  34           1HD      PHE  34  -3.948   1.003  -0.726
  696    HD2  PHE  34           2HD      PHE  34  -4.450   4.191   2.040
  697    HE1  PHE  34           1HE      PHE  34  -1.541   0.952  -0.241
  698    HE2  PHE  34           2HE      PHE  34  -2.041   4.141   2.539
  699    HZ   PHE  34           HZ       PHE  34  -0.591   2.520   1.385
  700    H    ASN  35           H        ASN  35  -7.745   4.562  -1.190
  701    HA   ASN  35           HA       ASN  35 -10.182   3.274  -1.054
  702   1HB   ASN  35          2HB       ASN  35  -9.983   5.700  -0.886
  703   2HB   ASN  35          1HB       ASN  35  -9.462   5.802  -2.564
  704   1HD2  ASN  35          1HD2      ASN  35 -11.891   6.596  -0.767
  705   2HD2  ASN  35          2HD2      ASN  35 -13.233   6.280  -1.804
  706    H    ASP  36           H        ASP  36  -8.146   3.940  -3.806
  707    HA   ASP  36           HA       ASP  36 -10.009   2.652  -5.644
  708   1HB   ASP  36          2HB       ASP  36  -7.430   4.143  -6.156
  709   2HB   ASP  36          1HB       ASP  36  -8.444   3.446  -7.416
  710    H    ASN  37           H        ASN  37  -6.997   1.919  -4.019
  711    HA   ASN  37           HA       ASN  37  -6.324  -0.217  -5.852
  712   1HB   ASN  37          2HB       ASN  37  -5.260   0.482  -3.103
  713   2HB   ASN  37          1HB       ASN  37  -4.678  -0.880  -4.051
  714   1HD2  ASN  37          1HD2      ASN  37  -3.512   1.760  -3.068
  715   2HD2  ASN  37          2HD2      ASN  37  -2.751   2.412  -4.476
  716    H    GLY  38           H        GLY  38  -7.643   0.122  -2.620
  717   1HA   GLY  38          2HA       GLY  38  -8.181  -1.843  -1.265
  718   2HA   GLY  38          1HA       GLY  38  -9.606  -1.176  -2.026
  719    H    VAL  39           H        VAL  39 -10.903  -2.638  -2.747
  720    HA   VAL  39           HA       VAL  39  -9.973  -5.327  -3.189
  721    HB   VAL  39           HB       VAL  39 -12.761  -4.211  -3.207
  722   1HG1  VAL  39          1HG1      VAL  39 -13.190  -6.163  -4.266
  723   2HG1  VAL  39          2HG1      VAL  39 -13.072  -6.820  -2.633
  724   3HG1  VAL  39          3HG1      VAL  39 -11.688  -6.912  -3.721
  725   1HG2  VAL  39          1HG2      VAL  39 -11.052  -5.464  -1.088
  726   2HG2  VAL  39          2HG2      VAL  39 -12.812  -5.474  -0.984
  727   3HG2  VAL  39          3HG2      VAL  39 -11.941  -3.941  -1.038
  728    H    ASP  40           H        ASP  40 -11.662  -2.935  -5.295
  729    HA   ASP  40           HA       ASP  40 -11.465  -4.903  -7.440
  730   1HB   ASP  40          2HB       ASP  40 -12.968  -2.291  -7.287
  731   2HB   ASP  40          1HB       ASP  40 -12.980  -3.378  -8.672
  732    H    GLY  41           H        GLY  41  -9.074  -3.387  -6.537
  733   1HA   GLY  41          2HA       GLY  41  -8.523  -1.443  -8.580
  734   2HA   GLY  41          1HA       GLY  41  -7.358  -2.128  -7.455
  735    H    GLU  42           H        GLU  42  -6.524  -1.723 -10.006
  736    HA   GLU  42           HA       GLU  42  -6.830  -4.222 -11.481
  737   1HB   GLU  42          2HB       GLU  42  -5.248  -1.729 -12.146
  738   2HB   GLU  42          1HB       GLU  42  -5.493  -3.100 -13.219
  739   1HG   GLU  42          2HG       GLU  42  -7.890  -2.663 -13.243
  740   2HG   GLU  42          1HG       GLU  42  -7.654  -1.297 -12.152
  741    H    TRP  43           H        TRP  43  -5.714  -5.773 -10.321
  742    HA   TRP  43           HA       TRP  43  -2.955  -5.216  -9.545
  743   1HB   TRP  43          2HB       TRP  43  -4.698  -7.613  -8.971
  744   2HB   TRP  43          1HB       TRP  43  -3.095  -7.327  -8.307
  745    HD1  TRP  43           HD       TRP  43  -6.041  -4.820  -8.476
  746    HE1  TRP  43           1HE      TRP  43  -6.563  -4.058  -6.070
  747    HE3  TRP  43           3HE      TRP  43  -2.734  -7.777  -5.974
  748    HZ2  TRP  43           2HZ      TRP  43  -5.681  -4.640  -3.463
  749    HZ3  TRP  43           3HZ      TRP  43  -2.625  -7.620  -3.530
  750    HH2  TRP  43           HH       TRP  43  -4.076  -6.081  -2.295
  751    H    THR  44           H        THR  44  -1.325  -5.763 -10.806
  752    HA   THR  44           HA       THR  44  -1.664  -7.993 -12.695
  753    HB   THR  44           HB       THR  44   0.306  -7.008 -13.877
  754    HG1  THR  44           1HG      THR  44   1.019  -5.845 -11.929
  755   1HG2  THR  44          1HG2      THR  44  -1.129  -4.618 -14.077
  756   2HG2  THR  44          2HG2      THR  44  -2.321  -5.881 -13.768
  757   3HG2  THR  44          3HG2      THR  44  -1.217  -6.026 -15.136
  758    H    TYR  45           H        TYR  45  -0.377  -9.777 -12.479
  759    HA   TYR  45           HA       TYR  45   1.485  -9.750 -10.205
  760   1HB   TYR  45          2HB       TYR  45  -0.380 -11.333 -10.027
  761   2HB   TYR  45          1HB       TYR  45   0.108 -12.087 -11.543
  762    HD1  TYR  45           1HD      TYR  45   2.195 -10.989  -8.657
  763    HD2  TYR  45           2HD      TYR  45   0.743 -14.251 -10.969
  764    HE1  TYR  45           1HE      TYR  45   3.667 -12.517  -7.413
  765    HE2  TYR  45           2HE      TYR  45   2.210 -15.788  -9.732
  766    HH   TYR  45           HH       TYR  45   4.501 -15.476  -8.401
  767    H    ASP  46           H        ASP  46   3.551 -10.519 -10.361
  768    HA   ASP  46           HA       ASP  46   4.507 -11.194 -13.064
  769   1HB   ASP  46          2HB       ASP  46   5.223  -8.923 -12.461
  770   2HB   ASP  46          1HB       ASP  46   5.942  -9.536 -10.974
  771    H    ASP  47           H        ASP  47   4.208 -13.406 -12.426
  772    HA   ASP  47           HA       ASP  47   5.186 -14.724 -10.241
  773   1HB   ASP  47          2HB       ASP  47   5.228 -15.708 -13.102
  774   2HB   ASP  47          1HB       ASP  47   5.369 -16.730 -11.675
  775    H    ALA  48           H        ALA  48   7.000 -13.611 -13.034
  776    HA   ALA  48           HA       ALA  48   9.370 -14.968 -12.772
  777   1HB   ALA  48          1HB       ALA  48   8.564 -13.083 -14.431
  778   2HB   ALA  48          2HB       ALA  48  10.277 -13.432 -14.192
  779   3HB   ALA  48          3HB       ALA  48   9.531 -12.063 -13.367
  780    H    THR  49           H        THR  49   8.220 -12.273 -10.826
  781    HA   THR  49           HA       THR  49  10.584 -12.625  -9.106
  782    HB   THR  49           HB       THR  49  10.520 -10.207  -8.610
  783    HG1  THR  49           1HG      THR  49   8.327  -9.848  -9.156
  784   1HG2  THR  49          1HG2      THR  49  11.407  -9.362 -10.685
  785   2HG2  THR  49          2HG2      THR  49  10.717 -10.725 -11.566
  786   3HG2  THR  49          3HG2      THR  49  12.007 -10.994 -10.395
  787    H    LYS  50           H        LYS  50   7.497 -13.334  -9.152
  788    HA   LYS  50           HA       LYS  50   5.833 -13.600  -7.593
  789   1HB   LYS  50          2HB       LYS  50   8.130 -13.283  -5.663
  790   2HB   LYS  50          1HB       LYS  50   6.555 -13.969  -5.290
  791   1HG   LYS  50          2HG       LYS  50   7.352 -15.476  -7.427
  792   2HG   LYS  50          1HG       LYS  50   8.872 -15.179  -6.578
  793   1HD   LYS  50          2HD       LYS  50   7.808 -15.955  -4.491
  794   2HD   LYS  50          1HD       LYS  50   6.347 -16.325  -5.408
  795   1HE   LYS  50          2HE       LYS  50   7.719 -18.324  -5.035
  796   2HE   LYS  50          1HE       LYS  50   7.575 -17.938  -6.748
  797   1HZ   LYS  50          1HZ       LYS  50   9.886 -17.014  -5.156
  798   2HZ   LYS  50          2HZ       LYS  50   9.758 -17.174  -6.835
  799   3HZ   LYS  50          3HZ       LYS  50   9.864 -18.552  -5.860
  800    H    THR  51           H        THR  51   6.451 -10.913  -8.534
  801    HA   THR  51           HA       THR  51   5.784  -9.284  -6.192
  802    HB   THR  51           HB       THR  51   6.814  -8.494  -8.920
  803    HG1  THR  51           1HG      THR  51   8.040  -8.576  -6.368
  804   1HG2  THR  51          1HG2      THR  51   7.291  -6.407  -7.196
  805   2HG2  THR  51          2HG2      THR  51   5.635  -6.883  -6.830
  806   3HG2  THR  51          3HG2      THR  51   6.084  -6.452  -8.480
  807    H    PHE  52           H        PHE  52   4.039  -7.826  -6.226
  808    HA   PHE  52           HA       PHE  52   2.074  -8.312  -8.367
  809   1HB   PHE  52          2HB       PHE  52   1.487  -7.835  -5.448
  810   2HB   PHE  52          1HB       PHE  52   0.295  -8.050  -6.722
  811    HD1  PHE  52           1HD      PHE  52  -0.516 -10.166  -7.200
  812    HD2  PHE  52           2HD      PHE  52   3.146  -9.768  -5.069
  813    HE1  PHE  52           1HE      PHE  52  -0.479 -12.596  -6.815
  814    HE2  PHE  52           2HE      PHE  52   3.190 -12.196  -4.683
  815    HZ   PHE  52           HZ       PHE  52   1.375 -13.613  -5.556
  816    H    THR  53           H        THR  53   2.434  -6.557  -9.529
  817    HA   THR  53           HA       THR  53   2.626  -3.917  -8.385
  818    HB   THR  53           HB       THR  53   2.363  -3.234 -10.887
  819    HG1  THR  53           1HG      THR  53   3.168  -5.912 -11.249
  820   1HG2  THR  53          1HG2      THR  53   4.697  -4.524  -9.590
  821   2HG2  THR  53          2HG2      THR  53   4.465  -2.855 -10.119
  822   3HG2  THR  53          3HG2      THR  53   4.779  -4.126 -11.306
  823    H    VAL  54           H        VAL  54   1.063  -2.604  -7.869
  824    HA   VAL  54           HA       VAL  54  -1.643  -3.126  -8.915
  825    HB   VAL  54           HB       VAL  54  -0.876  -1.819  -6.290
  826   1HG1  VAL  54          1HG1      VAL  54  -3.421  -2.069  -7.766
  827   2HG1  VAL  54          2HG1      VAL  54  -2.895  -0.853  -6.602
  828   3HG1  VAL  54          3HG1      VAL  54  -3.485  -2.416  -6.039
  829   1HG2  VAL  54          1HG2      VAL  54  -0.432  -4.118  -6.057
  830   2HG2  VAL  54          2HG2      VAL  54  -1.871  -4.573  -6.970
  831   3HG2  VAL  54          3HG2      VAL  54  -2.034  -3.880  -5.357
  832    H    THR  55           H        THR  55  -2.142  -1.709 -10.452
  833    HA   THR  55           HA       THR  55  -1.043   1.001 -10.293
  834    HB   THR  55           HB       THR  55  -2.419  -0.316 -12.634
  835    HG1  THR  55           1HG      THR  55  -0.291  -0.598 -13.413
  836   1HG2  THR  55          1HG2      THR  55  -2.454   2.037 -12.926
  837   2HG2  THR  55          2HG2      THR  55  -1.152   1.399 -13.928
  838   3HG2  THR  55          3HG2      THR  55  -0.778   2.188 -12.394
  839    H    GLU  56           H        GLU  56  -2.281   2.528  -9.446
  840    HA   GLU  56           HA       GLU  56  -5.122   2.149  -9.165
  841   1HB   GLU  56          2HB       GLU  56  -3.630   3.236  -7.441
  842   2HB   GLU  56          1HB       GLU  56  -3.512   4.620  -8.517
  843   1HG   GLU  56          2HG       GLU  56  -6.075   3.547  -7.364
  844   2HG   GLU  56          1HG       GLU  56  -5.171   4.917  -6.723
  Start of MODEL   19
    1   1H    MET   1          1HT       MET   1   7.294 -19.613   2.416
    2   2H    MET   1          2HT       MET   1   6.263 -18.395   2.979
    3   3H    MET   1          3HT       MET   1   7.939 -18.219   3.127
    4    HA   MET   1           HA       MET   1   8.227 -18.017   0.796
    5   1HB   MET   1          2HB       MET   1   6.366 -19.707   0.381
    6   2HB   MET   1          1HB       MET   1   5.240 -18.379   0.553
    7   1HG   MET   1          2HG       MET   1   5.717 -18.951  -1.775
    8   2HG   MET   1          1HG       MET   1   6.135 -17.297  -1.388
    9   1HE   MET   1          1HE       MET   1   8.287 -16.387  -1.070
   10   2HE   MET   1          2HE       MET   1   9.623 -16.850  -2.120
   11   3HE   MET   1          3HE       MET   1   9.553 -17.451  -0.466
   12    H    GLN   2           H        GLN   2   8.712 -15.921   0.774
   13    HA   GLN   2           HA       GLN   2   6.742 -13.969   1.712
   14   1HB   GLN   2          2HB       GLN   2   8.977 -13.859   2.732
   15   2HB   GLN   2          1HB       GLN   2   9.697 -13.643   1.144
   16   1HG   GLN   2          2HG       GLN   2   8.517 -11.524   0.890
   17   2HG   GLN   2          1HG       GLN   2   7.782 -11.741   2.478
   18   1HE2  GLN   2          1HE2      GLN   2  10.142 -10.169   0.894
   19   2HE2  GLN   2          2HE2      GLN   2  11.263  -9.915   2.185
   20    H    TYR   3           H        TYR   3   5.941 -12.386   0.413
   21    HA   TYR   3           HA       TYR   3   6.777 -12.450  -2.410
   22   1HB   TYR   3          2HB       TYR   3   3.991 -12.142  -1.277
   23   2HB   TYR   3          1HB       TYR   3   4.399 -11.837  -2.962
   24    HD1  TYR   3           1HD      TYR   3   4.517 -13.600  -4.511
   25    HD2  TYR   3           2HD      TYR   3   4.342 -14.479  -0.349
   26    HE1  TYR   3           1HE      TYR   3   4.182 -15.977  -5.033
   27    HE2  TYR   3           2HE      TYR   3   4.018 -16.866  -0.860
   28    HH   TYR   3           HH       TYR   3   3.942 -18.413  -2.465
   29    H    LYS   4           H        LYS   4   7.019 -10.511  -3.464
   30    HA   LYS   4           HA       LYS   4   6.905  -8.138  -1.728
   31   1HB   LYS   4          2HB       LYS   4   9.119  -8.649  -2.610
   32   2HB   LYS   4          1HB       LYS   4   8.491  -8.641  -4.251
   33   1HG   LYS   4          2HG       LYS   4   7.963  -6.266  -4.045
   34   2HG   LYS   4          1HG       LYS   4   8.585  -6.273  -2.392
   35   1HD   LYS   4          2HD       LYS   4  10.798  -6.909  -3.233
   36   2HD   LYS   4          1HD       LYS   4  10.173  -6.894  -4.885
   37   1HE   LYS   4          2HE       LYS   4  10.292  -4.533  -3.009
   38   2HE   LYS   4          1HE       LYS   4  11.378  -4.830  -4.366
   39   1HZ   LYS   4          1HZ       LYS   4   9.893  -3.468  -5.369
   40   2HZ   LYS   4          2HZ       LYS   4   8.605  -3.915  -4.370
   41   3HZ   LYS   4          3HZ       LYS   4   9.082  -4.927  -5.637
   42    H    VAL   5           H        VAL   5   5.054  -7.052  -1.987
   43    HA   VAL   5           HA       VAL   5   3.827  -6.948  -4.633
   44    HB   VAL   5           HB       VAL   5   2.733  -5.969  -1.989
   45   1HG1  VAL   5          1HG1      VAL   5   1.803  -5.745  -4.763
   46   2HG1  VAL   5          2HG1      VAL   5   1.389  -4.783  -3.344
   47   3HG1  VAL   5          3HG1      VAL   5   0.592  -6.333  -3.623
   48   1HG2  VAL   5          1HG2      VAL   5   1.186  -8.085  -2.900
   49   2HG2  VAL   5          2HG2      VAL   5   2.345  -8.121  -1.572
   50   3HG2  VAL   5          3HG2      VAL   5   2.848  -8.600  -3.192
   51    H    ILE   6           H        ILE   6   3.666  -5.155  -5.815
   52    HA   ILE   6           HA       ILE   6   5.003  -2.732  -4.821
   53    HB   ILE   6           HB       ILE   6   4.687  -3.800  -7.632
   54   1HG1  ILE   6          2HG1      ILE   6   7.141  -3.339  -5.927
   55   2HG1  ILE   6          1HG1      ILE   6   6.401  -4.903  -6.246
   56   1HG2  ILE   6          1HG2      ILE   6   4.773  -1.145  -6.990
   57   2HG2  ILE   6          2HG2      ILE   6   5.275  -1.850  -8.525
   58   3HG2  ILE   6          3HG2      ILE   6   6.471  -1.524  -7.271
   59   1HD1  ILE   6          1HD1      ILE   6   7.794  -3.089  -8.191
   60   2HD1  ILE   6          2HD1      ILE   6   6.835  -4.487  -8.685
   61   3HD1  ILE   6          3HD1      ILE   6   8.266  -4.710  -7.679
   62    H    LEU   7           H        LEU   7   3.820  -0.920  -4.623
   63    HA   LEU   7           HA       LEU   7   1.091  -0.937  -5.720
   64   1HB   LEU   7          2HB       LEU   7   2.063   0.890  -3.546
   65   2HB   LEU   7          1HB       LEU   7   0.425   0.363  -3.888
   66    HG   LEU   7           HG       LEU   7   2.618  -1.334  -2.715
   67   1HD1  LEU   7          1HD1      LEU   7   1.248  -1.317  -0.708
   68   2HD1  LEU   7          2HD1      LEU   7   0.072  -0.267  -1.502
   69   3HD1  LEU   7          3HD1      LEU   7   1.700   0.324  -1.168
   70   1HD2  LEU   7          1HD2      LEU   7   1.168  -2.635  -4.176
   71   2HD2  LEU   7          2HD2      LEU   7  -0.254  -2.015  -3.339
   72   3HD2  LEU   7          3HD2      LEU   7   0.892  -3.050  -2.484
   73    H    ASN   8           H        ASN   8   1.212   0.031  -7.691
   74    HA   ASN   8           HA       ASN   8   2.636   2.596  -7.896
   75   1HB   ASN   8          2HB       ASN   8   1.767   0.656 -10.039
   76   2HB   ASN   8          1HB       ASN   8   2.462   2.238 -10.372
   77   1HD2  ASN   8          1HD2      ASN   8   4.525   2.175 -10.840
   78   2HD2  ASN   8          2HD2      ASN   8   5.680   1.049 -10.220
   79    H    GLY   9           H        GLY   9   1.269   4.243  -7.438
   80   1HA   GLY   9          2HA       GLY   9  -1.422   4.142  -8.645
   81   2HA   GLY   9          1HA       GLY   9  -1.015   5.049  -7.198
   82    H    LYS  10           H        LYS  10  -2.150   6.742  -8.482
   83    HA   LYS  10           HA       LYS  10  -0.886   7.847 -10.779
   84   1HB   LYS  10          2HB       LYS  10  -3.022   8.819  -8.908
   85   2HB   LYS  10          1HB       LYS  10  -2.367   9.873 -10.150
   86   1HG   LYS  10          2HG       LYS  10  -4.468   8.764 -10.807
   87   2HG   LYS  10          1HG       LYS  10  -3.123   8.405 -11.887
   88   1HD   LYS  10          2HD       LYS  10  -3.670   6.539  -9.631
   89   2HD   LYS  10          1HD       LYS  10  -4.752   6.513 -11.025
   90   1HE   LYS  10          2HE       LYS  10  -2.809   6.170 -12.496
   91   2HE   LYS  10          1HE       LYS  10  -1.758   6.140 -11.087
   92   1HZ   LYS  10          1HZ       LYS  10  -3.912   4.206 -11.732
   93   2HZ   LYS  10          2HZ       LYS  10  -3.044   4.212 -10.280
   94   3HZ   LYS  10          3HZ       LYS  10  -2.245   3.911 -11.741
   95    H    THR  11           H        THR  11  -1.101   9.020  -7.405
   96    HA   THR  11           HA       THR  11   1.328  10.593  -7.901
   97    HB   THR  11           HB       THR  11   0.373  11.931  -5.894
   98    HG1  THR  11           1HG      THR  11  -1.895  11.830  -5.784
   99   1HG2  THR  11          1HG2      THR  11  -0.075  13.463  -7.416
  100   2HG2  THR  11          2HG2      THR  11  -1.528  12.590  -7.902
  101   3HG2  THR  11          3HG2      THR  11   0.019  12.219  -8.663
  102    H    LEU  12           H        LEU  12   0.753   7.765  -6.768
  103    HA   LEU  12           HA       LEU  12   2.574   8.069  -4.507
  104   1HB   LEU  12          2HB       LEU  12   0.373   8.027  -3.514
  105   2HB   LEU  12          1HB       LEU  12  -0.048   6.589  -4.418
  106    HG   LEU  12           HG       LEU  12   1.496   5.261  -3.141
  107   1HD1  LEU  12          1HD1      LEU  12   2.635   7.838  -2.558
  108   2HD1  LEU  12          2HD1      LEU  12   3.339   6.235  -2.390
  109   3HD1  LEU  12          3HD1      LEU  12   2.366   6.914  -1.083
  110   1HD2  LEU  12          1HD2      LEU  12  -0.808   6.323  -2.161
  111   2HD2  LEU  12          2HD2      LEU  12   0.343   6.743  -0.893
  112   3HD2  LEU  12          3HD2      LEU  12   0.133   5.058  -1.374
  113    H    LYS  13           H        LYS  13   4.010   6.449  -4.260
  114    HA   LYS  13           HA       LYS  13   3.680   3.967  -5.755
  115   1HB   LYS  13          2HB       LYS  13   6.066   5.788  -6.126
  116   2HB   LYS  13          1HB       LYS  13   5.934   4.154  -6.759
  117   1HG   LYS  13          2HG       LYS  13   4.024   4.841  -8.128
  118   2HG   LYS  13          1HG       LYS  13   4.177   6.484  -7.503
  119   1HD   LYS  13          2HD       LYS  13   6.422   6.642  -8.460
  120   2HD   LYS  13          1HD       LYS  13   6.277   4.994  -9.074
  121   1HE   LYS  13          2HE       LYS  13   4.380   5.679 -10.459
  122   2HE   LYS  13          1HE       LYS  13   4.524   7.326  -9.844
  123   1HZ   LYS  13          1HZ       LYS  13   5.569   6.929 -12.057
  124   2HZ   LYS  13          2HZ       LYS  13   6.703   5.929 -11.295
  125   3HZ   LYS  13          3HZ       LYS  13   6.620   7.572 -10.895
  126    H    GLY  14           H        GLY  14   4.930   2.233  -4.924
  127   1HA   GLY  14          2HA       GLY  14   6.939   2.588  -2.958
  128   2HA   GLY  14          1HA       GLY  14   5.396   2.294  -2.178
  129    H    GLU  15           H        GLU  15   6.956   0.502  -1.433
  130    HA   GLU  15           HA       GLU  15   6.335  -1.871  -3.038
  131   1HB   GLU  15          2HB       GLU  15   9.025  -1.288  -1.779
  132   2HB   GLU  15          1HB       GLU  15   8.563  -2.823  -2.493
  133   1HG   GLU  15          2HG       GLU  15   9.889  -1.675  -4.080
  134   2HG   GLU  15          1HG       GLU  15   8.225  -1.622  -4.657
  135    H    THR  16           H        THR  16   5.615  -3.560  -1.879
  136    HA   THR  16           HA       THR  16   5.929  -3.499   1.030
  137    HB   THR  16           HB       THR  16   3.778  -2.660   0.927
  138    HG1  THR  16           1HG      THR  16   3.261  -5.415   0.748
  139   1HG2  THR  16          1HG2      THR  16   3.186  -2.567  -1.303
  140   2HG2  THR  16          2HG2      THR  16   2.027  -3.712  -0.627
  141   3HG2  THR  16          3HG2      THR  16   3.415  -4.297  -1.538
  142    H    THR  17           H        THR  17   5.278  -5.632   2.045
  143    HA   THR  17           HA       THR  17   5.637  -7.897   0.234
  144    HB   THR  17           HB       THR  17   7.372  -8.848   1.759
  145    HG1  THR  17           1HG      THR  17   7.276  -6.238   2.849
  146   1HG2  THR  17          1HG2      THR  17   7.988  -6.275   0.348
  147   2HG2  THR  17          2HG2      THR  17   8.224  -7.922  -0.234
  148   3HG2  THR  17          3HG2      THR  17   9.226  -7.298   1.076
  149    H    THR  18           H        THR  18   4.196  -9.392   0.652
  150    HA   THR  18           HA       THR  18   3.090  -9.659   3.382
  151    HB   THR  18           HB       THR  18   1.450  -9.096   1.609
  152    HG1  THR  18           1HG      THR  18   0.872 -10.453   3.395
  153   1HG2  THR  18          1HG2      THR  18   0.841 -11.130   0.114
  154   2HG2  THR  18          2HG2      THR  18   2.543 -11.541   0.313
  155   3HG2  THR  18          3HG2      THR  18   2.088  -9.993  -0.397
  156    H    GLU  19           H        GLU  19   3.104 -11.684   4.356
  157    HA   GLU  19           HA       GLU  19   4.765 -13.724   3.020
  158   1HB   GLU  19          2HB       GLU  19   5.458 -12.713   5.269
  159   2HB   GLU  19          1HB       GLU  19   4.103 -13.586   5.964
  160   1HG   GLU  19          2HG       GLU  19   6.395 -14.862   4.489
  161   2HG   GLU  19          1HG       GLU  19   6.267 -14.732   6.239
  162    H    ALA  20           H        ALA  20   3.523 -15.240   2.042
  163    HA   ALA  20           HA       ALA  20   1.363 -16.435   3.607
  164   1HB   ALA  20          1HB       ALA  20   0.782 -15.919   0.743
  165   2HB   ALA  20          2HB       ALA  20   0.657 -14.570   1.875
  166   3HB   ALA  20          3HB       ALA  20  -0.311 -16.024   2.123
  167    H    VAL  21           H        VAL  21   0.766 -18.509   2.978
  168    HA   VAL  21           HA       VAL  21   2.770 -20.284   2.368
  169    HB   VAL  21           HB       VAL  21  -0.134 -20.770   1.712
  170   1HG1  VAL  21          1HG1      VAL  21   0.338 -23.072   2.057
  171   2HG1  VAL  21          2HG1      VAL  21   1.953 -22.715   2.666
  172   3HG1  VAL  21          3HG1      VAL  21   1.574 -22.449   0.965
  173   1HG2  VAL  21          1HG2      VAL  21   1.300 -20.652   4.331
  174   2HG2  VAL  21          2HG2      VAL  21  -0.063 -21.753   4.118
  175   3HG2  VAL  21          3HG2      VAL  21  -0.286 -20.018   3.890
  176    H    ASP  22           H        ASP  22   0.553 -18.716   0.122
  177    HA   ASP  22           HA       ASP  22   2.335 -19.450  -2.063
  178   1HB   ASP  22          2HB       ASP  22   0.552 -20.282  -3.510
  179   2HB   ASP  22          1HB       ASP  22   0.686 -21.266  -2.057
  180    H    ALA  23           H        ALA  23   1.666 -18.336  -4.149
  181    HA   ALA  23           HA       ALA  23   1.627 -15.603  -3.782
  182   1HB   ALA  23          1HB       ALA  23   1.789 -15.463  -6.029
  183   2HB   ALA  23          2HB       ALA  23   0.427 -16.550  -6.300
  184   3HB   ALA  23          3HB       ALA  23   2.016 -17.207  -5.909
  185    H    ALA  24           H        ALA  24  -1.099 -17.769  -4.355
  186    HA   ALA  24           HA       ALA  24  -3.054 -15.761  -4.673
  187   1HB   ALA  24          1HB       ALA  24  -3.251 -18.271  -5.167
  188   2HB   ALA  24          2HB       ALA  24  -4.659 -17.464  -4.480
  189   3HB   ALA  24          3HB       ALA  24  -3.621 -18.453  -3.452
  190    H    THR  25           H        THR  25  -2.211 -17.707  -1.788
  191    HA   THR  25           HA       THR  25  -3.876 -16.426   0.016
  192    HB   THR  25           HB       THR  25  -2.203 -17.135   1.743
  193    HG1  THR  25           1HG      THR  25  -0.298 -17.796   1.215
  194   1HG2  THR  25          1HG2      THR  25  -3.359 -19.017   1.650
  195   2HG2  THR  25          2HG2      THR  25  -2.103 -19.628   0.572
  196   3HG2  THR  25          3HG2      THR  25  -3.556 -18.884  -0.099
  197    H    ALA  26           H        ALA  26  -0.582 -15.634  -1.010
  198    HA   ALA  26           HA       ALA  26  -0.223 -13.376   0.627
  199   1HB   ALA  26          1HB       ALA  26   1.750 -13.186  -0.436
  200   2HB   ALA  26          2HB       ALA  26   0.997 -13.185  -2.031
  201   3HB   ALA  26          3HB       ALA  26   1.318 -14.711  -1.207
  202    H    GLU  27           H        GLU  27  -1.314 -13.650  -2.767
  203    HA   GLU  27           HA       GLU  27  -1.878 -11.020  -3.292
  204   1HB   GLU  27          2HB       GLU  27  -1.964 -12.868  -4.933
  205   2HB   GLU  27          1HB       GLU  27  -3.454 -13.431  -4.193
  206   1HG   GLU  27          2HG       GLU  27  -3.975 -12.211  -6.183
  207   2HG   GLU  27          1HG       GLU  27  -4.518 -11.290  -4.782
  208    H    LYS  28           H        LYS  28  -4.060 -13.465  -1.889
  209    HA   LYS  28           HA       LYS  28  -6.296 -11.813  -1.585
  210   1HB   LYS  28          2HB       LYS  28  -5.429 -14.197   0.056
  211   2HB   LYS  28          1HB       LYS  28  -7.022 -13.462   0.136
  212   1HG   LYS  28          2HG       LYS  28  -5.780 -14.796  -2.259
  213   2HG   LYS  28          1HG       LYS  28  -7.073 -15.439  -1.248
  214   1HD   LYS  28          2HD       LYS  28  -7.291 -12.866  -2.805
  215   2HD   LYS  28          1HD       LYS  28  -7.813 -14.431  -3.428
  216   1HE   LYS  28          2HE       LYS  28  -9.739 -13.349  -2.553
  217   2HE   LYS  28          1HE       LYS  28  -9.306 -14.629  -1.424
  218   1HZ   LYS  28          1HZ       LYS  28  -8.089 -12.096  -0.811
  219   2HZ   LYS  28          2HZ       LYS  28  -8.937 -13.157   0.195
  220   3HZ   LYS  28          3HZ       LYS  28  -9.778 -12.051  -0.766
  221    H    VAL  29           H        VAL  29  -3.560 -12.423   0.554
  222    HA   VAL  29           HA       VAL  29  -4.444 -11.099   2.832
  223    HB   VAL  29           HB       VAL  29  -1.641 -11.283   1.709
  224   1HG1  VAL  29          1HG1      VAL  29  -1.019 -10.893   4.161
  225   2HG1  VAL  29          2HG1      VAL  29  -2.644 -10.229   4.328
  226   3HG1  VAL  29          3HG1      VAL  29  -1.504  -9.496   3.201
  227   1HG2  VAL  29          1HG2      VAL  29  -1.708 -13.395   2.383
  228   2HG2  VAL  29          2HG2      VAL  29  -3.357 -13.181   2.968
  229   3HG2  VAL  29          3HG2      VAL  29  -1.994 -12.847   4.035
  230    H    VAL  30           H        VAL  30  -2.921  -9.837  -0.079
  231    HA   VAL  30           HA       VAL  30  -2.658  -7.169   0.820
  232    HB   VAL  30           HB       VAL  30  -3.042  -8.111  -2.024
  233   1HG1  VAL  30          1HG1      VAL  30  -1.460  -5.733  -1.136
  234   2HG1  VAL  30          2HG1      VAL  30  -3.202  -5.622  -1.383
  235   3HG1  VAL  30          3HG1      VAL  30  -2.149  -6.082  -2.722
  236   1HG2  VAL  30          1HG2      VAL  30  -0.815  -8.441  -0.164
  237   2HG2  VAL  30          2HG2      VAL  30  -0.356  -7.685  -1.691
  238   3HG2  VAL  30          3HG2      VAL  30  -1.149  -9.260  -1.690
  239    H    LYS  31           H        LYS  31  -5.199  -8.851  -1.055
  240    HA   LYS  31           HA       LYS  31  -6.908  -6.752  -1.542
  241   1HB   LYS  31          2HB       LYS  31  -7.428  -9.650  -0.992
  242   2HB   LYS  31          1HB       LYS  31  -8.773  -8.539  -1.212
  243   1HG   LYS  31          2HG       LYS  31  -8.275  -9.646  -3.289
  244   2HG   LYS  31          1HG       LYS  31  -7.882  -7.932  -3.420
  245   1HD   LYS  31          2HD       LYS  31  -5.510  -8.498  -2.962
  246   2HD   LYS  31          1HD       LYS  31  -5.956 -10.204  -2.986
  247   1HE   LYS  31          2HE       LYS  31  -6.328  -8.277  -5.274
  248   2HE   LYS  31          1HE       LYS  31  -5.019  -9.449  -5.134
  249   1HZ   LYS  31          1HZ       LYS  31  -7.888  -9.927  -5.612
  250   2HZ   LYS  31          2HZ       LYS  31  -6.932 -11.141  -4.924
  251   3HZ   LYS  31          3HZ       LYS  31  -6.553 -10.530  -6.456
  252    H    GLN  32           H        GLN  32  -6.685  -8.725   1.388
  253    HA   GLN  32           HA       GLN  32  -8.769  -7.343   2.763
  254   1HB   GLN  32          2HB       GLN  32  -8.010  -9.622   3.397
  255   2HB   GLN  32          1HB       GLN  32  -6.467  -8.949   3.901
  256   1HG   GLN  32          2HG       GLN  32  -7.829  -9.331   5.831
  257   2HG   GLN  32          1HG       GLN  32  -7.633  -7.599   5.594
  258   1HE2  GLN  32          1HE2      GLN  32  -9.777  -8.876   3.319
  259   2HE2  GLN  32          2HE2      GLN  32 -11.249  -8.474   4.121
  260    H    PHE  33           H        PHE  33  -5.296  -7.049   2.545
  261    HA   PHE  33           HA       PHE  33  -4.749  -5.204   4.532
  262   1HB   PHE  33          2HB       PHE  33  -3.097  -6.437   3.109
  263   2HB   PHE  33          1HB       PHE  33  -3.477  -5.342   1.787
  264    HD1  PHE  33           1HD      PHE  33  -2.019  -5.572   5.156
  265    HD2  PHE  33           2HD      PHE  33  -2.463  -3.194   1.641
  266    HE1  PHE  33           1HE      PHE  33  -0.278  -4.037   5.963
  267    HE2  PHE  33           2HE      PHE  33  -0.724  -1.659   2.462
  268    HZ   PHE  33           HZ       PHE  33   0.370  -2.086   4.630
  269    H    PHE  34           H        PHE  34  -5.441  -4.542   1.122
  270    HA   PHE  34           HA       PHE  34  -5.689  -1.708   1.558
  271   1HB   PHE  34          2HB       PHE  34  -6.279  -3.390  -0.875
  272   2HB   PHE  34          1HB       PHE  34  -6.346  -1.625  -0.838
  273    HD1  PHE  34           1HD      PHE  34  -4.083  -0.908   0.794
  274    HD2  PHE  34           2HD      PHE  34  -4.424  -3.950  -2.155
  275    HE1  PHE  34           1HE      PHE  34  -1.655  -0.824   0.441
  276    HE2  PHE  34           2HE      PHE  34  -1.992  -3.863  -2.526
  277    HZ   PHE  34           HZ       PHE  34  -0.611  -2.308  -1.208
  278    H    ASN  35           H        ASN  35  -7.952  -4.365   1.110
  279    HA   ASN  35           HA       ASN  35 -10.338  -2.995   0.823
  280   1HB   ASN  35          2HB       ASN  35 -10.225  -5.428   0.741
  281   2HB   ASN  35          1HB       ASN  35  -9.752  -5.495   2.435
  282   1HD2  ASN  35          1HD2      ASN  35 -12.153  -6.306   0.622
  283   2HD2  ASN  35          2HD2      ASN  35 -13.514  -5.903   1.603
  284    H    ASP  36           H        ASP  36  -8.445  -3.655   3.691
  285    HA   ASP  36           HA       ASP  36 -10.340  -2.246   5.404
  286   1HB   ASP  36          2HB       ASP  36  -7.851  -3.807   6.095
  287   2HB   ASP  36          1HB       ASP  36  -8.919  -3.049   7.272
  288    H    ASN  37           H        ASN  37  -7.186  -1.680   3.976
  289    HA   ASN  37           HA       ASN  37  -6.517   0.448   5.799
  290   1HB   ASN  37          2HB       ASN  37  -5.362  -0.310   3.107
  291   2HB   ASN  37          1HB       ASN  37  -4.763   1.029   4.077
  292   1HD2  ASN  37          1HD2      ASN  37  -3.584  -1.566   3.164
  293   2HD2  ASN  37          2HD2      ASN  37  -2.956  -2.285   4.607
  294    H    GLY  38           H        GLY  38  -7.903   0.140   2.623
  295   1HA   GLY  38          2HA       GLY  38  -8.245   2.133   1.197
  296   2HA   GLY  38          1HA       GLY  38  -9.718   1.595   1.968
  297    H    VAL  39           H        VAL  39 -10.895   3.161   2.719
  298    HA   VAL  39           HA       VAL  39  -9.798   5.789   3.027
  299    HB   VAL  39           HB       VAL  39 -12.617   4.802   3.315
  300   1HG1  VAL  39          1HG1      VAL  39 -12.695   6.791   4.496
  301   2HG1  VAL  39          2HG1      VAL  39 -13.046   7.336   2.854
  302   3HG1  VAL  39          3HG1      VAL  39 -11.426   7.536   3.525
  303   1HG2  VAL  39          1HG2      VAL  39 -12.783   6.104   1.100
  304   2HG2  VAL  39          2HG2      VAL  39 -12.040   4.504   1.089
  305   3HG2  VAL  39          3HG2      VAL  39 -11.028   5.947   1.056
  306    H    ASP  40           H        ASP  40 -11.730   3.785   5.332
  307    HA   ASP  40           HA       ASP  40 -11.078   5.697   7.400
  308   1HB   ASP  40          2HB       ASP  40 -12.786   3.210   7.459
  309   2HB   ASP  40          1HB       ASP  40 -12.614   4.348   8.792
  310    H    GLY  41           H        GLY  41  -8.908   3.911   6.357
  311   1HA   GLY  41          2HA       GLY  41  -8.348   1.934   8.307
  312   2HA   GLY  41          1HA       GLY  41  -7.178   2.657   7.214
  313    H    GLU  42           H        GLU  42  -7.016   1.953  10.111
  314    HA   GLU  42           HA       GLU  42  -6.912   4.423  11.572
  315   1HB   GLU  42          2HB       GLU  42  -5.694   1.728  12.210
  316   2HB   GLU  42          1HB       GLU  42  -5.812   3.079  13.328
  317   1HG   GLU  42          2HG       GLU  42  -8.131   1.609  12.095
  318   2HG   GLU  42          1HG       GLU  42  -7.533   1.405  13.741
  319    H    TRP  43           H        TRP  43  -5.566   5.851  10.481
  320    HA   TRP  43           HA       TRP  43  -2.786   4.999  10.058
  321   1HB   TRP  43          2HB       TRP  43  -4.174   7.467   9.016
  322   2HB   TRP  43          1HB       TRP  43  -2.570   6.907   8.575
  323    HD1  TRP  43           HD       TRP  43  -5.010   4.071   8.643
  324    HE1  TRP  43           1HE      TRP  43  -5.718   3.475   6.245
  325    HE3  TRP  43           3HE      TRP  43  -3.056   8.105   6.228
  326    HZ2  TRP  43           2HZ      TRP  43  -5.469   4.585   3.656
  327    HZ3  TRP  43           3HZ      TRP  43  -3.318   8.271   3.796
  328    HH2  TRP  43           HH       TRP  43  -4.502   6.545   2.531
  329    H    THR  44           H        THR  44  -1.175   5.781  11.259
  330    HA   THR  44           HA       THR  44  -1.702   8.121  12.969
  331    HB   THR  44           HB       THR  44   0.122   7.261  14.417
  332    HG1  THR  44           1HG      THR  44   0.026   4.986  12.733
  333   1HG2  THR  44          1HG2      THR  44  -2.443   6.307  14.337
  334   2HG2  THR  44          2HG2      THR  44  -1.270   6.016  15.621
  335   3HG2  THR  44          3HG2      THR  44  -1.473   4.835  14.327
  336    H    TYR  45           H        TYR  45  -0.257   9.847  12.870
  337    HA   TYR  45           HA       TYR  45   1.714   9.666  10.690
  338   1HB   TYR  45          2HB       TYR  45  -0.172  11.280  10.406
  339   2HB   TYR  45          1HB       TYR  45   0.420  12.156  11.811
  340    HD1  TYR  45           1HD      TYR  45   2.633  10.633   9.280
  341    HD2  TYR  45           2HD      TYR  45   0.836  14.222  10.687
  342    HE1  TYR  45           1HE      TYR  45   4.120  11.941   7.825
  343    HE2  TYR  45           2HE      TYR  45   2.319  15.541   9.235
  344    HH   TYR  45           HH       TYR  45   4.423  15.347   8.091
  345    H    ASP  46           H        ASP  46   3.794  10.354  10.953
  346    HA   ASP  46           HA       ASP  46   4.596  11.164  13.671
  347   1HB   ASP  46          2HB       ASP  46   5.249   8.832  13.242
  348   2HB   ASP  46          1HB       ASP  46   6.101   9.335  11.785
  349    H    ASP  47           H        ASP  47   4.466  13.360  12.908
  350    HA   ASP  47           HA       ASP  47   5.628  14.508  10.724
  351   1HB   ASP  47          2HB       ASP  47   5.651  15.657  13.524
  352   2HB   ASP  47          1HB       ASP  47   5.828  16.573  12.031
  353    H    ALA  48           H        ALA  48   7.239  13.427  13.649
  354    HA   ALA  48           HA       ALA  48   9.686  14.643  13.466
  355   1HB   ALA  48          1HB       ALA  48   9.934  13.393  15.279
  356   2HB   ALA  48          2HB       ALA  48  10.246  12.004  14.239
  357   3HB   ALA  48          3HB       ALA  48   8.605  12.343  14.789
  358    H    THR  49           H        THR  49   8.481  12.007  11.484
  359    HA   THR  49           HA       THR  49  10.996  12.133   9.955
  360    HB   THR  49           HB       THR  49  10.755   9.724   9.465
  361    HG1  THR  49           1HG      THR  49   8.592   9.928  11.279
  362   1HG2  THR  49          1HG2      THR  49  10.946  10.526  12.342
  363   2HG2  THR  49          2HG2      THR  49  12.240  10.087  11.228
  364   3HG2  THR  49          3HG2      THR  49  11.129   8.853  11.819
  365    H    LYS  50           H        LYS  50   8.085  13.225   9.714
  366    HA   LYS  50           HA       LYS  50   6.517  13.550   8.067
  367   1HB   LYS  50          2HB       LYS  50   8.975  13.206   6.351
  368   2HB   LYS  50          1HB       LYS  50   7.459  13.934   5.833
  369   1HG   LYS  50          2HG       LYS  50   8.067  15.354   8.099
  370   2HG   LYS  50          1HG       LYS  50   9.649  15.074   7.371
  371   1HD   LYS  50          2HD       LYS  50   7.278  16.171   5.878
  372   2HD   LYS  50          1HD       LYS  50   8.511  17.179   6.640
  373   1HE   LYS  50          2HE       LYS  50   9.026  16.952   4.304
  374   2HE   LYS  50          1HE       LYS  50  10.224  16.062   5.239
  375   1HZ   LYS  50          1HZ       LYS  50   9.344  14.034   4.585
  376   2HZ   LYS  50          2HZ       LYS  50   9.225  14.958   3.176
  377   3HZ   LYS  50          3HZ       LYS  50   7.855  14.695   4.130
  378    H    THR  51           H        THR  51   6.646  10.884   8.977
  379    HA   THR  51           HA       THR  51   5.952   9.428   6.515
  380    HB   THR  51           HB       THR  51   7.262   8.325   9.005
  381    HG1  THR  51           1HG      THR  51   8.275   8.490   6.367
  382   1HG2  THR  51          1HG2      THR  51   6.627   6.307   8.393
  383   2HG2  THR  51          2HG2      THR  51   7.444   6.531   6.846
  384   3HG2  THR  51          3HG2      THR  51   5.747   6.979   7.019
  385    H    PHE  52           H        PHE  52   4.177   8.117   6.546
  386    HA   PHE  52           HA       PHE  52   2.413   8.361   8.900
  387   1HB   PHE  52          2HB       PHE  52   1.551   7.819   6.050
  388   2HB   PHE  52          1HB       PHE  52   0.526   8.235   7.416
  389    HD1  PHE  52           1HD      PHE  52  -0.295  10.373   7.465
  390    HD2  PHE  52           2HD      PHE  52   3.455   9.662   5.584
  391    HE1  PHE  52           1HE      PHE  52  -0.181  12.742   6.802
  392    HE2  PHE  52           2HE      PHE  52   3.577  12.030   4.928
  393    HZ   PHE  52           HZ       PHE  52   1.761  13.572   5.539
  394    H    THR  53           H        THR  53   1.328   6.492   9.622
  395    HA   THR  53           HA       THR  53   2.196   3.978   8.371
  396    HB   THR  53           HB       THR  53   1.842   3.034  10.770
  397    HG1  THR  53           1HG      THR  53   2.159   4.471  12.391
  398   1HG2  THR  53          1HG2      THR  53   4.216   3.917  11.398
  399   2HG2  THR  53          2HG2      THR  53   4.205   4.492   9.730
  400   3HG2  THR  53          3HG2      THR  53   3.987   2.772  10.073
  401    H    VAL  54           H        VAL  54   0.661   2.665   7.725
  402    HA   VAL  54           HA       VAL  54  -2.105   3.208   8.576
  403    HB   VAL  54           HB       VAL  54  -1.165   1.747   6.102
  404   1HG1  VAL  54          1HG1      VAL  54  -3.264   0.996   6.075
  405   2HG1  VAL  54          2HG1      VAL  54  -3.737   2.649   5.685
  406   3HG1  VAL  54          3HG1      VAL  54  -3.764   2.097   7.361
  407   1HG2  VAL  54          1HG2      VAL  54  -1.428   3.677   4.859
  408   2HG2  VAL  54          2HG2      VAL  54  -0.705   4.292   6.345
  409   3HG2  VAL  54          3HG2      VAL  54  -2.440   4.450   6.078
  410    H    THR  55           H        THR  55  -2.806   1.829  10.088
  411    HA   THR  55           HA       THR  55  -1.723  -0.889  10.107
  412    HB   THR  55           HB       THR  55  -3.331   0.475  12.266
  413    HG1  THR  55           1HG      THR  55  -1.510   1.582  12.365
  414   1HG2  THR  55          1HG2      THR  55  -3.394  -1.880  12.580
  415   2HG2  THR  55          2HG2      THR  55  -2.211  -1.224  13.712
  416   3HG2  THR  55          3HG2      THR  55  -1.670  -2.029  12.236
  417    H    GLU  56           H        GLU  56  -2.867  -2.292   8.969
  418    HA   GLU  56           HA       GLU  56  -5.509  -2.033   8.154
  419   1HB   GLU  56          2HB       GLU  56  -3.699  -3.628   7.302
  420   2HB   GLU  56          1HB       GLU  56  -4.140  -4.677   8.641
  421   1HG   GLU  56          2HG       GLU  56  -5.997  -3.775   6.454
  422   2HG   GLU  56          1HG       GLU  56  -5.182  -5.333   6.522
  423   1H    MET   1          1HT       MET   1   7.797  19.477  -2.219
  424   2H    MET   1          2HT       MET   1   6.745  18.290  -2.806
  425   3H    MET   1          3HT       MET   1   8.419  18.072  -2.929
  426    HA   MET   1           HA       MET   1   8.658  17.861  -0.585
  427   1HB   MET   1          2HB       MET   1   6.702  19.557  -0.310
  428   2HB   MET   1          1HB       MET   1   5.676  18.138  -0.324
  429   1HG   MET   1          2HG       MET   1   7.562  19.098   1.753
  430   2HG   MET   1          1HG       MET   1   5.945  18.458   1.905
  431   1HE   MET   1          1HE       MET   1   9.686  16.029   1.134
  432   2HE   MET   1          2HE       MET   1   9.825  17.023   2.573
  433   3HE   MET   1          3HE       MET   1   9.506  17.774   1.012
  434    H    GLN   2           H        GLN   2   9.102  15.751  -0.563
  435    HA   GLN   2           HA       GLN   2   7.108  13.843  -1.536
  436   1HB   GLN   2          2HB       GLN   2   9.352  13.681  -2.520
  437   2HB   GLN   2          1HB       GLN   2  10.042  13.452  -0.920
  438   1HG   GLN   2          2HG       GLN   2   8.808  11.362  -0.680
  439   2HG   GLN   2          1HG       GLN   2   8.103  11.595  -2.280
  440   1HE2  GLN   2          1HE2      GLN   2  10.399   9.969  -0.660
  441   2HE2  GLN   2          2HE2      GLN   2  11.533   9.686  -1.932
  442    H    TYR   3           H        TYR   3   6.244  12.288  -0.241
  443    HA   TYR   3           HA       TYR   3   7.046  12.333   2.594
  444   1HB   TYR   3          2HB       TYR   3   4.268  12.092   1.425
  445   2HB   TYR   3          1HB       TYR   3   4.648  11.774   3.114
  446    HD1  TYR   3           1HD      TYR   3   4.803  13.526   4.667
  447    HD2  TYR   3           2HD      TYR   3   4.667  14.422   0.511
  448    HE1  TYR   3           1HE      TYR   3   4.516  15.908   5.198
  449    HE2  TYR   3           2HE      TYR   3   4.385  16.811   1.031
  450    HH   TYR   3           HH       TYR   3   4.236  18.347   2.636
  451    H    LYS   4           H        LYS   4   7.219  10.388   3.655
  452    HA   LYS   4           HA       LYS   4   7.075   8.018   1.916
  453   1HB   LYS   4          2HB       LYS   4   9.291   8.473   2.829
  454   2HB   LYS   4          1HB       LYS   4   8.639   8.484   4.461
  455   1HG   LYS   4          2HG       LYS   4   8.056   6.121   4.249
  456   2HG   LYS   4          1HG       LYS   4   8.701   6.111   2.606
  457   1HD   LYS   4          2HD       LYS   4  10.916   6.696   3.480
  458   2HD   LYS   4          1HD       LYS   4  10.267   6.696   5.121
  459   1HE   LYS   4          2HE       LYS   4  10.357   4.332   3.247
  460   2HE   LYS   4          1HE       LYS   4  11.429   4.604   4.621
  461   1HZ   LYS   4          1HZ       LYS   4   9.896   3.277   5.602
  462   2HZ   LYS   4          2HZ       LYS   4   8.635   3.756   4.582
  463   3HZ   LYS   4          3HZ       LYS   4   9.117   4.756   5.857
  464    H    VAL   5           H        VAL   5   5.194   6.981   2.149
  465    HA   VAL   5           HA       VAL   5   3.928   6.906   4.779
  466    HB   VAL   5           HB       VAL   5   2.850   5.954   2.120
  467   1HG1  VAL   5          1HG1      VAL   5   1.875   5.751   4.881
  468   2HG1  VAL   5          2HG1      VAL   5   1.458   4.800   3.455
  469   3HG1  VAL   5          3HG1      VAL   5   0.695   6.368   3.722
  470   1HG2  VAL   5          1HG2      VAL   5   1.339   8.105   3.009
  471   2HG2  VAL   5          2HG2      VAL   5   2.518   8.114   1.697
  472   3HG2  VAL   5          3HG2      VAL   5   3.009   8.581   3.325
  473    H    ILE   6           H        ILE   6   3.708   5.118   5.958
  474    HA   ILE   6           HA       ILE   6   4.998   2.663   4.982
  475    HB   ILE   6           HB       ILE   6   4.670   3.739   7.788
  476   1HG1  ILE   6          2HG1      ILE   6   7.134   3.216   6.121
  477   2HG1  ILE   6          1HG1      ILE   6   6.428   4.798   6.426
  478   1HG2  ILE   6          1HG2      ILE   6   4.699   1.082   7.148
  479   2HG2  ILE   6          2HG2      ILE   6   5.195   1.776   8.689
  480   3HG2  ILE   6          3HG2      ILE   6   6.401   1.421   7.453
  481   1HD1  ILE   6          1HD1      ILE   6   7.744   2.955   8.396
  482   2HD1  ILE   6          2HD1      ILE   6   6.816   4.377   8.870
  483   3HD1  ILE   6          3HD1      ILE   6   8.268   4.559   7.887
  484    H    LEU   7           H        LEU   7   3.775   0.881   4.767
  485    HA   LEU   7           HA       LEU   7   1.031   0.965   5.826
  486   1HB   LEU   7          2HB       LEU   7   1.989  -0.887   3.666
  487   2HB   LEU   7          1HB       LEU   7   0.359  -0.320   3.983
  488    HG   LEU   7           HG       LEU   7   2.610   1.322   2.842
  489   1HD1  LEU   7          1HD1      LEU   7   1.268   1.339   0.817
  490   2HD1  LEU   7          2HD1      LEU   7   0.056   0.317   1.592
  491   3HD1  LEU   7          3HD1      LEU   7   1.674  -0.311   1.282
  492   1HD2  LEU   7          1HD2      LEU   7   1.171   2.659   4.283
  493   2HD2  LEU   7          2HD2      LEU   7  -0.252   2.073   3.426
  494   3HD2  LEU   7          3HD2      LEU   7   0.929   3.080   2.588
  495    H    ASN   8           H        ASN   8   1.101  -0.009   7.797
  496    HA   ASN   8           HA       ASN   8   2.460  -2.605   8.022
  497   1HB   ASN   8          2HB       ASN   8   1.607  -0.641  10.152
  498   2HB   ASN   8          1HB       ASN   8   2.258  -2.243  10.496
  499   1HD2  ASN   8          1HD2      ASN   8   4.315  -2.231  10.993
  500   2HD2  ASN   8          2HD2      ASN   8   5.505  -1.134  10.390
  501    H    GLY   9           H        GLY   9   1.060  -4.220   7.544
  502   1HA   GLY   9          2HA       GLY   9  -1.645  -4.054   8.714
  503   2HA   GLY   9          1HA       GLY   9  -1.241  -4.971   7.271
  504    H    LYS  10           H        LYS  10  -2.434  -6.635   8.539
  505    HA   LYS  10           HA       LYS  10  -1.231  -7.770  10.855
  506   1HB   LYS  10          2HB       LYS  10  -3.362  -8.688   8.951
  507   2HB   LYS  10          1HB       LYS  10  -2.751  -9.758  10.202
  508   1HG   LYS  10          2HG       LYS  10  -4.834  -8.600  10.828
  509   2HG   LYS  10          1HG       LYS  10  -3.497  -8.274  11.927
  510   1HD   LYS  10          2HD       LYS  10  -3.968  -6.394   9.666
  511   2HD   LYS  10          1HD       LYS  10  -5.067  -6.344  11.044
  512   1HE   LYS  10          2HE       LYS  10  -3.137  -6.048  12.543
  513   2HE   LYS  10          1HE       LYS  10  -2.066  -6.042  11.148
  514   1HZ   LYS  10          1HZ       LYS  10  -4.183  -4.058  11.763
  515   2HZ   LYS  10          2HZ       LYS  10  -3.292  -4.083  10.325
  516   3HZ   LYS  10          3HZ       LYS  10  -2.508  -3.803  11.799
  517    H    THR  11           H        THR  11  -1.425  -8.937   7.475
  518    HA   THR  11           HA       THR  11   0.958 -10.570   8.004
  519    HB   THR  11           HB       THR  11  -0.002 -11.884   5.983
  520    HG1  THR  11           1HG      THR  11  -2.264 -11.727   5.842
  521   1HG2  THR  11          1HG2      THR  11  -0.507 -13.405   7.499
  522   2HG2  THR  11          2HG2      THR  11  -1.946 -12.499   7.967
  523   3HG2  THR  11          3HG2      THR  11  -0.401 -12.164   8.748
  524    H    LEU  12           H        LEU  12   0.466  -7.728   6.864
  525    HA   LEU  12           HA       LEU  12   2.311  -8.076   4.631
  526   1HB   LEU  12          2HB       LEU  12   0.126  -7.981   3.607
  527   2HB   LEU  12          1HB       LEU  12  -0.271  -6.533   4.505
  528    HG   LEU  12           HG       LEU  12   1.322  -5.242   3.251
  529   1HD1  LEU  12          1HD1      LEU  12   2.407  -7.847   2.682
  530   2HD1  LEU  12          2HD1      LEU  12   3.151  -6.263   2.525
  531   3HD1  LEU  12          3HD1      LEU  12   2.181  -6.917   1.204
  532   1HD2  LEU  12          1HD2      LEU  12  -0.993  -6.249   2.236
  533   2HD2  LEU  12          2HD2      LEU  12   0.165  -6.696   0.985
  534   3HD2  LEU  12          3HD2      LEU  12  -0.009  -5.006   1.463
  535    H    LYS  13           H        LYS  13   3.791  -6.491   4.404
  536    HA   LYS  13           HA       LYS  13   3.499  -4.003   5.895
  537   1HB   LYS  13          2HB       LYS  13   5.836  -5.881   6.301
  538   2HB   LYS  13          1HB       LYS  13   5.733  -4.242   6.932
  539   1HG   LYS  13          2HG       LYS  13   3.787  -4.886   8.274
  540   2HG   LYS  13          1HG       LYS  13   3.908  -6.532   7.649
  541   1HD   LYS  13          2HD       LYS  13   6.135  -6.745   8.637
  542   2HD   LYS  13          1HD       LYS  13   6.024  -5.094   9.251
  543   1HE   LYS  13          2HE       LYS  13   4.089  -5.733  10.609
  544   2HE   LYS  13          1HE       LYS  13   4.204  -7.382   9.996
  545   1HZ   LYS  13          1HZ       LYS  13   5.226  -7.010  12.223
  546   2HZ   LYS  13          2HZ       LYS  13   6.394  -6.039  11.478
  547   3HZ   LYS  13          3HZ       LYS  13   6.276  -7.679  11.076
  548    H    GLY  14           H        GLY  14   4.802  -2.298   5.081
  549   1HA   GLY  14          2HA       GLY  14   6.831  -2.702   3.146
  550   2HA   GLY  14          1HA       GLY  14   5.305  -2.371   2.343
  551    H    GLU  15           H        GLU  15   6.921  -0.620   1.623
  552    HA   GLU  15           HA       GLU  15   6.335   1.768   3.218
  553   1HB   GLU  15          2HB       GLU  15   9.027   1.121   1.997
  554   2HB   GLU  15          1HB       GLU  15   8.593   2.667   2.707
  555   1HG   GLU  15          2HG       GLU  15   9.868   1.486   4.309
  556   2HG   GLU  15          1HG       GLU  15   8.195   1.474   4.863
  557    H    THR  16           H        THR  16   5.672   3.475   2.050
  558    HA   THR  16           HA       THR  16   6.026   3.407  -0.855
  559    HB   THR  16           HB       THR  16   3.853   2.621  -0.784
  560    HG1  THR  16           1HG      THR  16   3.402   5.386  -0.611
  561   1HG2  THR  16          1HG2      THR  16   3.227   2.542   1.439
  562   2HG2  THR  16          2HG2      THR  16   2.106   3.715   0.745
  563   3HG2  THR  16          3HG2      THR  16   3.497   4.265   1.677
  564    H    THR  17           H        THR  17   5.441   5.554  -1.878
  565    HA   THR  17           HA       THR  17   5.829   7.809  -0.063
  566    HB   THR  17           HB       THR  17   7.609   8.719  -1.562
  567    HG1  THR  17           1HG      THR  17   7.464   6.111  -2.652
  568   1HG2  THR  17          1HG2      THR  17   8.142   6.130  -0.142
  569   2HG2  THR  17          2HG2      THR  17   8.409   7.774   0.444
  570   3HG2  THR  17          3HG2      THR  17   9.414   7.125  -0.853
  571    H    THR  18           H        THR  18   4.432   9.338  -0.500
  572    HA   THR  18           HA       THR  18   3.370   9.632  -3.246
  573    HB   THR  18           HB       THR  18   1.691   9.108  -1.497
  574    HG1  THR  18           1HG      THR  18   1.173  10.480  -3.290
  575   1HG2  THR  18          1HG2      THR  18   1.111  11.157  -0.009
  576   2HG2  THR  18          2HG2      THR  18   2.826  11.528  -0.184
  577   3HG2  THR  18          3HG2      THR  18   2.324   9.991   0.519
  578    H    GLU  19           H        GLU  19   3.448  11.657  -4.219
  579    HA   GLU  19           HA       GLU  19   5.138  13.656  -2.856
  580   1HB   GLU  19          2HB       GLU  19   5.841  12.630  -5.096
  581   2HB   GLU  19          1HB       GLU  19   4.516  13.533  -5.811
  582   1HG   GLU  19          2HG       GLU  19   6.818  14.754  -4.301
  583   2HG   GLU  19          1HG       GLU  19   6.711  14.629  -6.055
  584    H    ALA  20           H        ALA  20   3.918  15.202  -1.897
  585    HA   ALA  20           HA       ALA  20   1.814  16.449  -3.494
  586   1HB   ALA  20          1HB       ALA  20   1.177  15.948  -0.639
  587   2HB   ALA  20          2HB       ALA  20   1.035  14.604  -1.771
  588   3HB   ALA  20          3HB       ALA  20   0.107  16.080  -2.035
  589    H    VAL  21           H        VAL  21   1.258  18.538  -2.872
  590    HA   VAL  21           HA       VAL  21   3.293  20.265  -2.232
  591    HB   VAL  21           HB       VAL  21   0.392  20.820  -1.618
  592   1HG1  VAL  21          1HG1      VAL  21   0.926  23.111  -1.953
  593   2HG1  VAL  21          2HG1      VAL  21   2.542  22.715  -2.541
  594   3HG1  VAL  21          3HG1      VAL  21   2.131  22.458  -0.845
  595   1HG2  VAL  21          1HG2      VAL  21   1.861  20.669  -4.216
  596   2HG2  VAL  21          2HG2      VAL  21   0.524  21.802  -4.020
  597   3HG2  VAL  21          3HG2      VAL  21   0.254  20.073  -3.798
  598    H    ASP  22           H        ASP  22   1.003  18.756  -0.017
  599    HA   ASP  22           HA       ASP  22   2.773  19.447   2.191
  600   1HB   ASP  22          2HB       ASP  22   0.988  20.318   3.613
  601   2HB   ASP  22          1HB       ASP  22   1.167  21.299   2.163
  602    H    ALA  23           H        ALA  23   2.049  18.346   4.266
  603    HA   ALA  23           HA       ALA  23   1.953  15.615   3.898
  604   1HB   ALA  23          1HB       ALA  23   2.077  15.468   6.148
  605   2HB   ALA  23          2HB       ALA  23   0.738  16.589   6.399
  606   3HB   ALA  23          3HB       ALA  23   2.349  17.207   6.032
  607    H    ALA  24           H        ALA  24  -0.731  17.845   4.435
  608    HA   ALA  24           HA       ALA  24  -2.737  15.883   4.723
  609   1HB   ALA  24          1HB       ALA  24  -2.882  18.398   5.214
  610   2HB   ALA  24          2HB       ALA  24  -4.299  17.625   4.507
  611   3HB   ALA  24          3HB       ALA  24  -3.223  18.588   3.495
  612    H    THR  25           H        THR  25  -1.808  17.810   1.850
  613    HA   THR  25           HA       THR  25  -3.476  16.568   0.022
  614    HB   THR  25           HB       THR  25  -1.762  17.238  -1.680
  615    HG1  THR  25           1HG      THR  25   0.151  17.849  -1.125
  616   1HG2  THR  25          1HG2      THR  25  -2.874  19.145  -1.600
  617   2HG2  THR  25          2HG2      THR  25  -1.620  19.725  -0.506
  618   3HG2  THR  25          3HG2      THR  25  -3.099  19.018   0.144
  619    H    ALA  26           H        ALA  26  -0.218  15.697   1.096
  620    HA   ALA  26           HA       ALA  26   0.110  13.430  -0.535
  621   1HB   ALA  26          1HB       ALA  26   2.063  13.193   0.555
  622   2HB   ALA  26          2HB       ALA  26   1.287  13.212   2.137
  623   3HB   ALA  26          3HB       ALA  26   1.657  14.729   1.318
  624    H    GLU  27           H        GLU  27  -1.022  13.733   2.840
  625    HA   GLU  27           HA       GLU  27  -1.657  11.116   3.357
  626   1HB   GLU  27          2HB       GLU  27  -1.720  12.965   4.998
  627   2HB   GLU  27          1HB       GLU  27  -3.187  13.564   4.238
  628   1HG   GLU  27          2HG       GLU  27  -3.765  12.357   6.218
  629   2HG   GLU  27          1HG       GLU  27  -4.311  11.448   4.809
  630    H    LYS  28           H        LYS  28  -3.759  13.613   1.925
  631    HA   LYS  28           HA       LYS  28  -6.029  12.015   1.588
  632   1HB   LYS  28          2HB       LYS  28  -5.081  14.379  -0.038
  633   2HB   LYS  28          1HB       LYS  28  -6.691  13.682  -0.141
  634   1HG   LYS  28          2HG       LYS  28  -5.451  14.986   2.271
  635   2HG   LYS  28          1HG       LYS  28  -6.714  15.660   1.243
  636   1HD   LYS  28          2HD       LYS  28  -7.016  13.093   2.796
  637   2HD   LYS  28          1HD       LYS  28  -7.508  14.670   3.411
  638   1HE   LYS  28          2HE       LYS  28  -9.448  13.635   2.510
  639   2HE   LYS  28          1HE       LYS  28  -8.968  14.903   1.386
  640   1HZ   LYS  28          1HZ       LYS  28  -7.804  12.341   0.790
  641   2HZ   LYS  28          2HZ       LYS  28  -8.612  13.424  -0.227
  642   3HZ   LYS  28          3HZ       LYS  28  -9.493  12.337   0.720
  643    H    VAL  29           H        VAL  29  -3.248  12.557  -0.511
  644    HA   VAL  29           HA       VAL  29  -4.133  11.256  -2.801
  645    HB   VAL  29           HB       VAL  29  -1.341  11.372  -1.638
  646   1HG1  VAL  29          1HG1      VAL  29  -0.693  10.968  -4.082
  647   2HG1  VAL  29          2HG1      VAL  29  -2.333  10.346  -4.273
  648   3HG1  VAL  29          3HG1      VAL  29  -1.228   9.582  -3.131
  649   1HG2  VAL  29          1HG2      VAL  29  -1.348  13.485  -2.312
  650   2HG2  VAL  29          2HG2      VAL  29  -2.994  13.312  -2.921
  651   3HG2  VAL  29          3HG2      VAL  29  -1.623  12.945  -3.968
  652    H    VAL  30           H        VAL  30  -2.682   9.959   0.130
  653    HA   VAL  30           HA       VAL  30  -2.472   7.285  -0.766
  654    HB   VAL  30           HB       VAL  30  -2.872   8.235   2.072
  655   1HG1  VAL  30          1HG1      VAL  30  -1.336   5.819   1.206
  656   2HG1  VAL  30          2HG1      VAL  30  -3.083   5.751   1.428
  657   3HG1  VAL  30          3HG1      VAL  30  -2.039   6.185   2.782
  658   1HG2  VAL  30          1HG2      VAL  30  -0.612   8.511   0.245
  659   2HG2  VAL  30          2HG2      VAL  30  -0.194   7.744   1.777
  660   3HG2  VAL  30          3HG2      VAL  30  -0.948   9.338   1.765
  661    H    LYS  31           H        LYS  31  -4.997   9.027   1.074
  662    HA   LYS  31           HA       LYS  31  -6.762   6.970   1.535
  663   1HB   LYS  31          2HB       LYS  31  -7.205   9.880   0.979
  664   2HB   LYS  31          1HB       LYS  31  -8.577   8.802   1.179
  665   1HG   LYS  31          2HG       LYS  31  -8.084   9.897   3.265
  666   2HG   LYS  31          1HG       LYS  31  -7.735   8.173   3.401
  667   1HD   LYS  31          2HD       LYS  31  -5.344   8.682   2.978
  668   2HD   LYS  31          1HD       LYS  31  -5.748  10.399   2.993
  669   1HE   LYS  31          2HE       LYS  31  -6.199   8.481   5.276
  670   2HE   LYS  31          1HE       LYS  31  -4.862   9.622   5.157
  671   1HZ   LYS  31          1HZ       LYS  31  -7.724  10.167   5.591
  672   2HZ   LYS  31          2HZ       LYS  31  -6.728  11.356   4.920
  673   3HZ   LYS  31          3HZ       LYS  31  -6.387  10.739   6.456
  674    H    GLN  32           H        GLN  32  -6.451   8.937  -1.390
  675    HA   GLN  32           HA       GLN  32  -8.549   7.607  -2.795
  676   1HB   GLN  32          2HB       GLN  32  -7.726   9.867  -3.417
  677   2HB   GLN  32          1HB       GLN  32  -6.193   9.156  -3.900
  678   1HG   GLN  32          2HG       GLN  32  -7.516   9.571  -5.849
  679   2HG   GLN  32          1HG       GLN  32  -7.366   7.833  -5.608
  680   1HE2  GLN  32          1HE2      GLN  32  -9.511   9.165  -3.365
  681   2HE2  GLN  32          2HE2      GLN  32 -10.980   8.798  -4.188
  682    H    PHE  33           H        PHE  33  -5.086   7.228  -2.529
  683    HA   PHE  33           HA       PHE  33  -4.558   5.371  -4.508
  684   1HB   PHE  33          2HB       PHE  33  -2.895   6.562  -3.062
  685   2HB   PHE  33          1HB       PHE  33  -3.321   5.477  -1.745
  686    HD1  PHE  33           1HD      PHE  33  -1.809   5.670  -5.094
  687    HD2  PHE  33           2HD      PHE  33  -2.362   3.306  -1.586
  688    HE1  PHE  33           1HE      PHE  33  -0.096   4.094  -5.875
  689    HE2  PHE  33           2HE      PHE  33  -0.648   1.730  -2.381
  690    HZ   PHE  33           HZ       PHE  33   0.487   2.128  -4.533
  691    H    PHE  34           H        PHE  34  -5.313   4.725  -1.108
  692    HA   PHE  34           HA       PHE  34  -5.624   1.899  -1.548
  693   1HB   PHE  34          2HB       PHE  34  -6.209   3.595   0.875
  694   2HB   PHE  34          1HB       PHE  34  -6.317   1.832   0.836
  695    HD1  PHE  34           1HD      PHE  34  -4.048   1.059  -0.762
  696    HD2  PHE  34           2HD      PHE  34  -4.358   4.109   2.182
  697    HE1  PHE  34           1HE      PHE  34  -1.628   0.916  -0.374
  698    HE2  PHE  34           2HE      PHE  34  -1.933   3.964   2.588
  699    HZ   PHE  34           HZ       PHE  34  -0.572   2.374   1.290
  700    H    ASN  35           H        ASN  35  -7.829   4.609  -1.130
  701    HA   ASN  35           HA       ASN  35 -10.251   3.298  -0.881
  702   1HB   ASN  35          2HB       ASN  35 -10.078   5.727  -0.795
  703   2HB   ASN  35          1HB       ASN  35  -9.581   5.784  -2.483
  704   1HD2  ASN  35          1HD2      ASN  35 -11.986   6.652  -0.704
  705   2HD2  ASN  35          2HD2      ASN  35 -13.343   6.282  -1.704
  706    H    ASP  36           H        ASP  36  -8.301   3.912  -3.720
  707    HA   ASP  36           HA       ASP  36 -10.206   2.548  -5.460
  708   1HB   ASP  36          2HB       ASP  36  -7.671   4.048  -6.114
  709   2HB   ASP  36          1HB       ASP  36  -8.739   3.318  -7.308
  710    H    ASN  37           H        ASN  37  -7.085   1.907  -3.989
  711    HA   ASN  37           HA       ASN  37  -6.443  -0.238  -5.802
  712   1HB   ASN  37          2HB       ASN  37  -5.309   0.492  -3.094
  713   2HB   ASN  37          1HB       ASN  37  -4.728  -0.861  -4.056
  714   1HD2  ASN  37          1HD2      ASN  37  -3.499   1.705  -3.124
  715   2HD2  ASN  37          2HD2      ASN  37  -2.835   2.409  -4.557
  716    H    GLY  38           H        GLY  38  -7.866   0.104  -2.647
  717   1HA   GLY  38          2HA       GLY  38  -8.275  -1.880  -1.224
  718   2HA   GLY  38          1HA       GLY  38  -9.724  -1.306  -2.017
  719    H    VAL  39           H        VAL  39 -10.927  -2.843  -2.784
  720    HA   VAL  39           HA       VAL  39  -9.893  -5.496  -3.077
  721    HB   VAL  39           HB       VAL  39 -12.682  -4.442  -3.404
  722   1HG1  VAL  39          1HG1      VAL  39 -12.792  -6.427  -4.588
  723   2HG1  VAL  39          2HG1      VAL  39 -13.179  -6.963  -2.951
  724   3HG1  VAL  39          3HG1      VAL  39 -11.555  -7.205  -3.599
  725   1HG2  VAL  39          1HG2      VAL  39 -12.910  -5.740  -1.194
  726   2HG2  VAL  39          2HG2      VAL  39 -12.130  -4.158  -1.170
  727   3HG2  VAL  39          3HG2      VAL  39 -11.152  -5.625  -1.124
  728    H    ASP  40           H        ASP  40 -11.740  -3.446  -5.409
  729    HA   ASP  40           HA       ASP  40 -11.106  -5.374  -7.468
  730   1HB   ASP  40          2HB       ASP  40 -12.751  -2.847  -7.550
  731   2HB   ASP  40          1HB       ASP  40 -12.588  -3.988  -8.881
  732    H    GLY  41           H        GLY  41  -8.909  -3.641  -6.393
  733   1HA   GLY  41          2HA       GLY  41  -8.272  -1.678  -8.336
  734   2HA   GLY  41          1HA       GLY  41  -7.135  -2.431  -7.226
  735    H    GLU  42           H        GLU  42  -6.917  -1.731 -10.119
  736    HA   GLU  42           HA       GLU  42  -6.853  -4.202 -11.580
  737   1HB   GLU  42          2HB       GLU  42  -5.559  -1.538 -12.199
  738   2HB   GLU  42          1HB       GLU  42  -5.694  -2.884 -13.320
  739   1HG   GLU  42          2HG       GLU  42  -7.994  -1.358 -12.120
  740   2HG   GLU  42          1HG       GLU  42  -7.367  -1.170 -13.756
  741    H    TRP  43           H        TRP  43  -5.556  -5.661 -10.470
  742    HA   TRP  43           HA       TRP  43  -2.764  -4.878 -10.008
  743   1HB   TRP  43          2HB       TRP  43  -4.225  -7.312  -8.986
  744   2HB   TRP  43          1HB       TRP  43  -2.614  -6.791  -8.522
  745    HD1  TRP  43           HD       TRP  43  -4.985  -3.896  -8.625
  746    HE1  TRP  43           1HE      TRP  43  -5.712  -3.283  -6.237
  747    HE3  TRP  43           3HE      TRP  43  -3.163  -7.976  -6.183
  748    HZ2  TRP  43           2HZ      TRP  43  -5.527  -4.399  -3.643
  749    HZ3  TRP  43           3HZ      TRP  43  -3.463  -8.135  -3.755
  750    HH2  TRP  43           HH       TRP  43  -4.625  -6.381  -2.506
  751    H    THR  44           H        THR  44  -1.154  -5.698 -11.186
  752    HA   THR  44           HA       THR  44  -1.714  -8.025 -12.903
  753    HB   THR  44           HB       THR  44   0.149  -7.209 -14.325
  754    HG1  THR  44           1HG      THR  44   0.084  -4.930 -12.643
  755   1HG2  THR  44          1HG2      THR  44  -2.393  -6.195 -14.281
  756   2HG2  THR  44          2HG2      THR  44  -1.193  -5.933 -15.547
  757   3HG2  THR  44          3HG2      THR  44  -1.386  -4.746 -14.258
  758    H    TYR  45           H        TYR  45  -0.313  -9.787 -12.786
  759    HA   TYR  45           HA       TYR  45   1.631  -9.654 -10.579
  760   1HB   TYR  45          2HB       TYR  45  -0.299 -11.222 -10.320
  761   2HB   TYR  45          1HB       TYR  45   0.293 -12.112 -11.718
  762    HD1  TYR  45           1HD      TYR  45   2.503 -10.643  -9.156
  763    HD2  TYR  45           2HD      TYR  45   0.641 -14.187 -10.589
  764    HE1  TYR  45           1HE      TYR  45   3.939 -11.986  -7.680
  765    HE2  TYR  45           2HE      TYR  45   2.071 -15.540  -9.117
  766    HH   TYR  45           HH       TYR  45   4.163 -15.400  -7.943
  767    H    ASP  46           H        ASP  46   3.696 -10.393 -10.811
  768    HA   ASP  46           HA       ASP  46   4.516 -11.222 -13.516
  769   1HB   ASP  46          2HB       ASP  46   5.220  -8.907 -13.078
  770   2HB   ASP  46          1HB       ASP  46   6.039  -9.428 -11.610
  771    H    ASP  47           H        ASP  47   4.321 -13.414 -12.759
  772    HA   ASP  47           HA       ASP  47   5.424 -14.589 -10.557
  773   1HB   ASP  47          2HB       ASP  47   5.460 -15.738 -13.357
  774   2HB   ASP  47          1HB       ASP  47   5.592 -16.659 -11.862
  775    H    ALA  48           H        ALA  48   7.105 -13.549 -13.460
  776    HA   ALA  48           HA       ALA  48   9.516 -14.824 -13.242
  777   1HB   ALA  48          1HB       ALA  48   9.822 -13.581 -15.050
  778   2HB   ALA  48          2HB       ALA  48  10.153 -12.200 -14.004
  779   3HB   ALA  48          3HB       ALA  48   8.514 -12.498 -14.579
  780    H    THR  49           H        THR  49   8.350 -12.155 -11.280
  781    HA   THR  49           HA       THR  49  10.837 -12.346  -9.712
  782    HB   THR  49           HB       THR  49  10.650  -9.931  -9.224
  783    HG1  THR  49           1HG      THR  49   8.509 -10.082 -11.069
  784   1HG2  THR  49          1HG2      THR  49  10.863 -10.738 -12.101
  785   2HG2  THR  49          2HG2      THR  49  12.150 -10.330 -10.968
  786   3HG2  THR  49          3HG2      THR  49  11.078  -9.068 -11.574
  787    H    LYS  50           H        LYS  50   7.898 -13.364  -9.515
  788    HA   LYS  50           HA       LYS  50   6.293 -13.649  -7.894
  789   1HB   LYS  50          2HB       LYS  50   8.734 -13.371  -6.138
  790   2HB   LYS  50          1HB       LYS  50   7.191 -14.058  -5.644
  791   1HG   LYS  50          2HG       LYS  50   7.796 -15.500  -7.896
  792   2HG   LYS  50          1HG       LYS  50   9.377 -15.253  -7.151
  793   1HD   LYS  50          2HD       LYS  50   6.966 -16.291  -5.683
  794   2HD   LYS  50          1HD       LYS  50   8.182 -17.330  -6.425
  795   1HE   LYS  50          2HE       LYS  50   8.678 -17.104  -4.084
  796   2HE   LYS  50          1HE       LYS  50   9.904 -16.244  -5.009
  797   1HZ   LYS  50          1HZ       LYS  50   9.071 -14.200  -4.365
  798   2HZ   LYS  50          2HZ       LYS  50   8.893 -15.120  -2.959
  799   3HZ   LYS  50          3HZ       LYS  50   7.553 -14.818  -3.944
  800    H    THR  51           H        THR  51   6.499 -10.990  -8.796
  801    HA   THR  51           HA       THR  51   5.814  -9.517  -6.344
  802    HB   THR  51           HB       THR  51   7.182  -8.447  -8.818
  803    HG1  THR  51           1HG      THR  51   8.152  -8.636  -6.164
  804   1HG2  THR  51          1HG2      THR  51   6.588  -6.413  -8.211
  805   2HG2  THR  51          2HG2      THR  51   7.380  -6.656  -6.655
  806   3HG2  THR  51          3HG2      THR  51   5.675  -7.062  -6.849
  807    H    PHE  52           H        PHE  52   4.071  -8.161  -6.399
  808    HA   PHE  52           HA       PHE  52   2.335  -8.367  -8.776
  809   1HB   PHE  52          2HB       PHE  52   1.446  -7.801  -5.940
  810   2HB   PHE  52          1HB       PHE  52   0.429  -8.192  -7.319
  811    HD1  PHE  52           1HD      PHE  52  -0.442 -10.311  -7.382
  812    HD2  PHE  52           2HD      PHE  52   3.299  -9.692  -5.448
  813    HE1  PHE  52           1HE      PHE  52  -0.395 -12.682  -6.717
  814    HE2  PHE  52           2HE      PHE  52   3.353 -12.061  -4.790
  815    HZ   PHE  52           HZ       PHE  52   1.506 -13.558  -5.426
  816    H    THR  53           H        THR  53   1.306  -6.469  -9.514
  817    HA   THR  53           HA       THR  53   2.218  -3.977  -8.251
  818    HB   THR  53           HB       THR  53   1.921  -3.026 -10.656
  819    HG1  THR  53           1HG      THR  53   2.225  -4.470 -12.272
  820   1HG2  THR  53          1HG2      THR  53   4.282  -3.967 -11.249
  821   2HG2  THR  53          2HG2      THR  53   4.233  -4.542  -9.582
  822   3HG2  THR  53          3HG2      THR  53   4.062  -2.818  -9.927
  823    H    VAL  54           H        VAL  54   0.705  -2.627  -7.628
  824    HA   VAL  54           HA       VAL  54  -2.061  -3.104  -8.518
  825    HB   VAL  54           HB       VAL  54  -1.120  -1.666  -6.030
  826   1HG1  VAL  54          1HG1      VAL  54  -3.200  -0.864  -6.033
  827   2HG1  VAL  54          2HG1      VAL  54  -3.720  -2.505  -5.649
  828   3HG1  VAL  54          3HG1      VAL  54  -3.708  -1.951  -7.324
  829   1HG2  VAL  54          1HG2      VAL  54  -1.446  -3.589  -4.789
  830   2HG2  VAL  54          2HG2      VAL  54  -0.717  -4.221  -6.266
  831   3HG2  VAL  54          3HG2      VAL  54  -2.460  -4.336  -6.024
  832    H    THR  55           H        THR  55  -2.704  -1.708 -10.038
  833    HA   THR  55           HA       THR  55  -1.556   0.983 -10.042
  834    HB   THR  55           HB       THR  55  -3.168  -0.341 -12.222
  835    HG1  THR  55           1HG      THR  55  -1.373  -1.493 -12.296
  836   1HG2  THR  55          1HG2      THR  55  -3.167   2.014 -12.536
  837   2HG2  THR  55          2HG2      THR  55  -1.983   1.331 -13.652
  838   3HG2  THR  55          3HG2      THR  55  -1.445   2.120 -12.168
  839    H    GLU  56           H        GLU  56  -2.682   2.411  -8.915
  840    HA   GLU  56           HA       GLU  56  -5.338   2.216  -8.136
  841   1HB   GLU  56          2HB       GLU  56  -3.505   3.769  -7.263
  842   2HB   GLU  56          1HB       GLU  56  -3.901   4.827  -8.607
  843   1HG   GLU  56          2HG       GLU  56  -5.811   3.973  -6.445
  844   2HG   GLU  56          1HG       GLU  56  -4.955   5.510  -6.502
  Start of MODEL   20
    1   1H    MET   1          1HT       MET   1   6.615 -19.531   1.940
    2   2H    MET   1          2HT       MET   1   5.335 -18.732   1.175
    3   3H    MET   1          3HT       MET   1   5.969 -18.122   2.619
    4    HA   MET   1           HA       MET   1   8.173 -17.984   1.316
    5   1HB   MET   1          2HB       MET   1   6.844 -19.229  -0.587
    6   2HB   MET   1          1HB       MET   1   6.281 -17.614  -0.982
    7   1HG   MET   1          2HG       MET   1   8.889 -17.106  -0.873
    8   2HG   MET   1          1HG       MET   1   8.965 -18.815  -1.286
    9   1HE   MET   1          1HE       MET   1   7.819 -15.173  -3.329
   10   2HE   MET   1          2HE       MET   1   7.153 -15.708  -1.785
   11   3HE   MET   1          3HE       MET   1   6.249 -15.968  -3.271
   12    H    GLN   2           H        GLN   2   8.704 -15.813   0.483
   13    HA   GLN   2           HA       GLN   2   6.844 -13.809   1.529
   14   1HB   GLN   2          2HB       GLN   2   9.117 -13.756   2.439
   15   2HB   GLN   2          1HB       GLN   2   9.777 -13.595   0.817
   16   1HG   GLN   2          2HG       GLN   2   8.671 -11.433   0.579
   17   2HG   GLN   2          1HG       GLN   2   8.007 -11.594   2.203
   18   1HE2  GLN   2          1HE2      GLN   2   9.059 -10.477   3.664
   19   2HE2  GLN   2          2HE2      GLN   2  10.751 -10.122   3.663
   20    H    TYR   3           H        TYR   3   5.858 -12.367   0.223
   21    HA   TYR   3           HA       TYR   3   6.628 -12.392  -2.622
   22   1HB   TYR   3          2HB       TYR   3   3.901 -12.074  -1.362
   23   2HB   TYR   3          1HB       TYR   3   4.227 -11.725  -3.056
   24    HD1  TYR   3           1HD      TYR   3   4.324 -13.458  -4.657
   25    HD2  TYR   3           2HD      TYR   3   4.247 -14.426  -0.516
   26    HE1  TYR   3           1HE      TYR   3   3.986 -15.824  -5.229
   27    HE2  TYR   3           2HE      TYR   3   3.903 -16.798  -1.072
   28    HH   TYR   3           HH       TYR   3   3.380 -17.858  -4.390
   29    H    LYS   4           H        LYS   4   6.758 -10.461  -3.728
   30    HA   LYS   4           HA       LYS   4   6.882  -8.084  -2.006
   31   1HB   LYS   4          2HB       LYS   4   8.951  -8.715  -3.206
   32   2HB   LYS   4          1HB       LYS   4   8.102  -8.543  -4.736
   33   1HG   LYS   4          2HG       LYS   4   7.752  -6.168  -4.275
   34   2HG   LYS   4          1HG       LYS   4   8.608  -6.344  -2.741
   35   1HD   LYS   4          2HD       LYS   4  10.627  -7.024  -3.952
   36   2HD   LYS   4          1HD       LYS   4   9.769  -6.841  -5.483
   37   1HE   LYS   4          2HE       LYS   4  11.159  -4.893  -5.021
   38   2HE   LYS   4          1HE       LYS   4   9.449  -4.463  -5.026
   39   1HZ   LYS   4          1HZ       LYS   4  11.136  -4.916  -2.622
   40   2HZ   LYS   4          2HZ       LYS   4   9.481  -4.570  -2.594
   41   3HZ   LYS   4          3HZ       LYS   4  10.574  -3.421  -3.182
   42    H    VAL   5           H        VAL   5   4.987  -7.039  -2.034
   43    HA   VAL   5           HA       VAL   5   3.487  -6.884  -4.532
   44    HB   VAL   5           HB       VAL   5   2.708  -6.005  -1.748
   45   1HG1  VAL   5          1HG1      VAL   5   0.967  -6.234  -4.198
   46   2HG1  VAL   5          2HG1      VAL   5   1.623  -4.716  -3.587
   47   3HG1  VAL   5          3HG1      VAL   5   0.495  -5.648  -2.603
   48   1HG2  VAL   5          1HG2      VAL   5   2.148  -8.117  -1.368
   49   2HG2  VAL   5          2HG2      VAL   5   2.771  -8.572  -2.953
   50   3HG2  VAL   5          3HG2      VAL   5   1.083  -8.097  -2.774
   51    H    ILE   6           H        ILE   6   3.946  -5.306  -5.839
   52    HA   ILE   6           HA       ILE   6   5.025  -2.786  -4.832
   53    HB   ILE   6           HB       ILE   6   4.771  -3.832  -7.657
   54   1HG1  ILE   6          2HG1      ILE   6   7.140  -3.584  -5.793
   55   2HG1  ILE   6          1HG1      ILE   6   6.404  -5.078  -6.362
   56   1HG2  ILE   6          1HG2      ILE   6   6.617  -1.618  -7.123
   57   2HG2  ILE   6          2HG2      ILE   6   4.909  -1.208  -6.972
   58   3HG2  ILE   6          3HG2      ILE   6   5.521  -1.890  -8.477
   59   1HD1  ILE   6          1HD1      ILE   6   8.036  -3.097  -7.907
   60   2HD1  ILE   6          2HD1      ILE   6   7.027  -4.306  -8.701
   61   3HD1  ILE   6          3HD1      ILE   6   8.344  -4.811  -7.641
   62    H    LEU   7           H        LEU   7   3.855  -0.985  -4.699
   63    HA   LEU   7           HA       LEU   7   1.172  -0.957  -5.912
   64   1HB   LEU   7          2HB       LEU   7   2.082   0.861  -3.700
   65   2HB   LEU   7          1HB       LEU   7   0.447   0.384  -4.122
   66    HG   LEU   7           HG       LEU   7   2.519  -1.384  -2.836
   67   1HD1  LEU   7          1HD1      LEU   7   1.482   0.449  -1.447
   68   2HD1  LEU   7          2HD1      LEU   7   1.261  -1.193  -0.849
   69   3HD1  LEU   7          3HD1      LEU   7  -0.062  -0.369  -1.677
   70   1HD2  LEU   7          1HD2      LEU   7   0.872  -3.086  -2.766
   71   2HD2  LEU   7          2HD2      LEU   7   0.923  -2.503  -4.429
   72   3HD2  LEU   7          3HD2      LEU   7  -0.382  -1.994  -3.359
   73    H    ASN   8           H        ASN   8   1.432   0.016  -7.887
   74    HA   ASN   8           HA       ASN   8   3.017   2.482  -8.013
   75   1HB   ASN   8          2HB       ASN   8   2.165   0.493 -10.098
   76   2HB   ASN   8          1HB       ASN   8   2.748   2.093 -10.541
   77   1HD2  ASN   8          1HD2      ASN   8   4.734   1.938 -11.236
   78   2HD2  ASN   8          2HD2      ASN   8   5.999   1.006 -10.516
   79    H    GLY   9           H        GLY   9   1.856   4.263  -7.691
   80   1HA   GLY   9          2HA       GLY   9  -0.745   4.454  -9.062
   81   2HA   GLY   9          1HA       GLY   9  -0.362   5.293  -7.563
   82    H    LYS  10           H        LYS  10  -1.260   7.030  -9.173
   83    HA   LYS  10           HA       LYS  10   0.632   7.981 -11.104
   84   1HB   LYS  10          2HB       LYS  10  -1.883   9.202  -9.964
   85   2HB   LYS  10          1HB       LYS  10  -0.889  10.004 -11.167
   86   1HG   LYS  10          2HG       LYS  10  -2.729   8.962 -12.268
   87   2HG   LYS  10          1HG       LYS  10  -1.259   8.084 -12.687
   88   1HD   LYS  10          2HD       LYS  10  -1.806   6.346 -11.089
   89   2HD   LYS  10          1HD       LYS  10  -3.228   7.247 -10.558
   90   1HE   LYS  10          2HE       LYS  10  -4.176   7.055 -12.812
   91   2HE   LYS  10          1HE       LYS  10  -2.760   6.137 -13.324
   92   1HZ   LYS  10          1HZ       LYS  10  -4.375   4.547 -12.835
   93   2HZ   LYS  10          2HZ       LYS  10  -4.878   5.335 -11.426
   94   3HZ   LYS  10          3HZ       LYS  10  -3.381   4.548 -11.466
   95    H    THR  11           H        THR  11  -0.517   9.125  -7.943
   96    HA   THR  11           HA       THR  11   1.777  10.930  -7.770
   97    HB   THR  11           HB       THR  11   0.376  11.828  -5.804
   98    HG1  THR  11           1HG      THR  11  -1.893  11.371  -6.136
   99   1HG2  THR  11          1HG2      THR  11  -1.412  12.702  -7.627
  100   2HG2  THR  11          2HG2      THR  11  -0.082  12.202  -8.671
  101   3HG2  THR  11          3HG2      THR  11   0.195  13.389  -7.396
  102    H    LEU  12           H        LEU  12   1.036   7.870  -6.887
  103    HA   LEU  12           HA       LEU  12   2.761   8.054  -4.534
  104   1HB   LEU  12          2HB       LEU  12   0.467   7.936  -3.717
  105   2HB   LEU  12          1HB       LEU  12   0.186   6.492  -4.670
  106    HG   LEU  12           HG       LEU  12   1.660   5.206  -3.302
  107   1HD1  LEU  12          1HD1      LEU  12   3.466   6.220  -2.501
  108   2HD1  LEU  12          2HD1      LEU  12   2.440   6.829  -1.200
  109   3HD1  LEU  12          3HD1      LEU  12   2.722   7.808  -2.635
  110   1HD2  LEU  12          1HD2      LEU  12   0.446   6.589  -1.055
  111   2HD2  LEU  12          2HD2      LEU  12   0.170   4.959  -1.664
  112   3HD2  LEU  12          3HD2      LEU  12  -0.683   6.325  -2.382
  113    H    LYS  13           H        LYS  13   4.222   6.485  -4.308
  114    HA   LYS  13           HA       LYS  13   4.033   4.057  -5.914
  115   1HB   LYS  13          2HB       LYS  13   6.506   5.794  -5.964
  116   2HB   LYS  13          1HB       LYS  13   6.253   4.293  -6.842
  117   1HG   LYS  13          2HG       LYS  13   5.886   5.823  -8.497
  118   2HG   LYS  13          1HG       LYS  13   4.245   5.598  -7.891
  119   1HD   LYS  13          2HD       LYS  13   4.659   7.950  -8.187
  120   2HD   LYS  13          1HD       LYS  13   4.544   7.600  -6.464
  121   1HE   LYS  13          2HE       LYS  13   6.975   7.598  -6.288
  122   2HE   LYS  13          1HE       LYS  13   7.109   7.902  -8.019
  123   1HZ   LYS  13          1HZ       LYS  13   6.454  10.059  -7.783
  124   2HZ   LYS  13          2HZ       LYS  13   7.226   9.845  -6.294
  125   3HZ   LYS  13          3HZ       LYS  13   5.538   9.767  -6.391
  126    H    GLY  14           H        GLY  14   5.101   2.296  -4.981
  127   1HA   GLY  14          2HA       GLY  14   7.019   2.577  -2.906
  128   2HA   GLY  14          1HA       GLY  14   5.427   2.312  -2.220
  129    H    GLU  15           H        GLU  15   6.936   0.479  -1.430
  130    HA   GLU  15           HA       GLU  15   6.279  -1.868  -3.044
  131   1HB   GLU  15          2HB       GLU  15   9.012  -1.342  -1.852
  132   2HB   GLU  15          1HB       GLU  15   8.500  -2.864  -2.563
  133   1HG   GLU  15          2HG       GLU  15   9.805  -1.758  -4.183
  134   2HG   GLU  15          1HG       GLU  15   8.128  -1.625  -4.709
  135    H    THR  16           H        THR  16   5.581  -3.561  -1.863
  136    HA   THR  16           HA       THR  16   6.004  -3.511   1.030
  137    HB   THR  16           HB       THR  16   3.882  -2.617   1.046
  138    HG1  THR  16           1HG      THR  16   3.291  -5.356   0.866
  139   1HG2  THR  16          1HG2      THR  16   2.052  -3.167  -0.412
  140   2HG2  THR  16          2HG2      THR  16   3.029  -4.391  -1.218
  141   3HG2  THR  16          3HG2      THR  16   3.456  -2.690  -1.365
  142    H    THR  17           H        THR  17   5.375  -5.637   2.064
  143    HA   THR  17           HA       THR  17   5.614  -7.891   0.213
  144    HB   THR  17           HB       THR  17   7.429  -8.869   1.606
  145    HG1  THR  17           1HG      THR  17   7.549  -6.271   2.730
  146   1HG2  THR  17          1HG2      THR  17   8.573  -6.280   0.801
  147   2HG2  THR  17          2HG2      THR  17   7.734  -7.192  -0.452
  148   3HG2  THR  17          3HG2      THR  17   9.085  -7.921   0.413
  149    H    THR  18           H        THR  18   4.138  -9.328   0.671
  150    HA   THR  18           HA       THR  18   3.196  -9.673   3.454
  151    HB   THR  18           HB       THR  18   1.467  -9.055   1.778
  152    HG1  THR  18           1HG      THR  18   0.964 -10.433   3.565
  153   1HG2  THR  18          1HG2      THR  18   2.135  -9.967  -0.262
  154   2HG2  THR  18          2HG2      THR  18   0.739 -10.930   0.224
  155   3HG2  THR  18          3HG2      THR  18   2.368 -11.573   0.431
  156    H    GLU  19           H        GLU  19   3.132 -11.772   4.330
  157    HA   GLU  19           HA       GLU  19   4.766 -13.756   2.883
  158   1HB   GLU  19          2HB       GLU  19   5.677 -13.032   5.047
  159   2HB   GLU  19          1HB       GLU  19   4.185 -13.510   5.844
  160   1HG   GLU  19          2HG       GLU  19   4.593 -15.834   5.227
  161   2HG   GLU  19          1HG       GLU  19   6.083 -15.358   4.415
  162    H    ALA  20           H        ALA  20   3.531 -15.233   1.865
  163    HA   ALA  20           HA       ALA  20   1.372 -16.491   3.382
  164   1HB   ALA  20          1HB       ALA  20  -0.303 -16.057   1.897
  165   2HB   ALA  20          2HB       ALA  20   0.800 -15.858   0.536
  166   3HB   ALA  20          3HB       ALA  20   0.637 -14.574   1.733
  167    H    VAL  21           H        VAL  21   0.795 -18.551   2.697
  168    HA   VAL  21           HA       VAL  21   2.814 -20.279   2.005
  169    HB   VAL  21           HB       VAL  21  -0.097 -20.776   1.381
  170   1HG1  VAL  21          1HG1      VAL  21   1.414 -22.458   0.490
  171   2HG1  VAL  21          2HG1      VAL  21   0.473 -23.117   1.828
  172   3HG1  VAL  21          3HG1      VAL  21   2.157 -22.656   2.077
  173   1HG2  VAL  21          1HG2      VAL  21  -0.018 -21.825   3.734
  174   2HG2  VAL  21          2HG2      VAL  21  -0.169 -20.073   3.597
  175   3HG2  VAL  21          3HG2      VAL  21   1.393 -20.796   3.980
  176    H    ASP  22           H        ASP  22   0.730 -18.475  -0.138
  177    HA   ASP  22           HA       ASP  22   2.432 -19.183  -2.368
  178   1HB   ASP  22          2HB       ASP  22   0.661 -19.993  -3.830
  179   2HB   ASP  22          1HB       ASP  22   0.789 -21.013  -2.404
  180    H    ALA  23           H        ALA  23   1.418 -18.124  -4.471
  181    HA   ALA  23           HA       ALA  23   1.492 -15.365  -4.059
  182   1HB   ALA  23          1HB       ALA  23   1.579 -17.055  -6.251
  183   2HB   ALA  23          2HB       ALA  23   1.712 -15.297  -6.274
  184   3HB   ALA  23          3HB       ALA  23   0.145 -16.066  -6.524
  185    H    ALA  24           H        ALA  24  -1.279 -17.504  -4.580
  186    HA   ALA  24           HA       ALA  24  -3.232 -15.477  -4.718
  187   1HB   ALA  24          1HB       ALA  24  -3.342 -18.395  -4.012
  188   2HB   ALA  24          2HB       ALA  24  -3.949 -17.578  -5.452
  189   3HB   ALA  24          3HB       ALA  24  -4.779 -17.378  -3.908
  190    H    THR  25           H        THR  25  -2.235 -17.517  -1.952
  191    HA   THR  25           HA       THR  25  -3.805 -16.348  -0.004
  192    HB   THR  25           HB       THR  25  -1.984 -17.036   1.581
  193    HG1  THR  25           1HG      THR  25  -0.621 -17.332  -0.822
  194   1HG2  THR  25          1HG2      THR  25  -3.047 -18.968   1.521
  195   2HG2  THR  25          2HG2      THR  25  -1.886 -19.486   0.296
  196   3HG2  THR  25          3HG2      THR  25  -3.426 -18.774  -0.191
  197    H    ALA  26           H        ALA  26  -0.618 -15.394  -1.216
  198    HA   ALA  26           HA       ALA  26  -0.226 -13.175   0.462
  199   1HB   ALA  26          1HB       ALA  26   1.298 -12.368  -1.355
  200   2HB   ALA  26          2HB       ALA  26   0.763 -13.733  -2.335
  201   3HB   ALA  26          3HB       ALA  26   1.618 -14.017  -0.820
  202    H    GLU  27           H        GLU  27  -1.520 -13.359  -2.871
  203    HA   GLU  27           HA       GLU  27  -2.216 -10.723  -3.217
  204   1HB   GLU  27          2HB       GLU  27  -2.326 -12.398  -4.997
  205   2HB   GLU  27          1HB       GLU  27  -3.691 -13.164  -4.198
  206   1HG   GLU  27          2HG       GLU  27  -5.017 -11.144  -4.527
  207   2HG   GLU  27          1HG       GLU  27  -3.649 -10.381  -5.336
  208    H    LYS  28           H        LYS  28  -4.168 -13.340  -1.801
  209    HA   LYS  28           HA       LYS  28  -6.472 -11.824  -1.298
  210   1HB   LYS  28          2HB       LYS  28  -5.373 -14.209   0.203
  211   2HB   LYS  28          1HB       LYS  28  -6.995 -13.563   0.405
  212   1HG   LYS  28          2HG       LYS  28  -5.845 -14.771  -2.101
  213   2HG   LYS  28          1HG       LYS  28  -7.053 -15.492  -1.035
  214   1HD   LYS  28          2HD       LYS  28  -8.595 -13.661  -1.553
  215   2HD   LYS  28          1HD       LYS  28  -7.387 -12.950  -2.626
  216   1HE   LYS  28          2HE       LYS  28  -8.682 -15.657  -2.946
  217   2HE   LYS  28          1HE       LYS  28  -9.050 -14.212  -3.889
  218   1HZ   LYS  28          1HZ       LYS  28  -7.439 -14.777  -5.274
  219   2HZ   LYS  28          2HZ       LYS  28  -7.038 -16.122  -4.330
  220   3HZ   LYS  28          3HZ       LYS  28  -6.298 -14.630  -4.032
  221    H    VAL  29           H        VAL  29  -3.601 -12.452   0.654
  222    HA   VAL  29           HA       VAL  29  -4.421 -11.110   2.969
  223    HB   VAL  29           HB       VAL  29  -1.637 -11.532   1.866
  224   1HG1  VAL  29          1HG1      VAL  29  -2.591 -10.394   4.460
  225   2HG1  VAL  29          2HG1      VAL  29  -1.303  -9.829   3.398
  226   3HG1  VAL  29          3HG1      VAL  29  -1.067 -11.275   4.379
  227   1HG2  VAL  29          1HG2      VAL  29  -3.368 -13.433   2.675
  228   2HG2  VAL  29          2HG2      VAL  29  -2.594 -13.038   4.209
  229   3HG2  VAL  29          3HG2      VAL  29  -1.618 -13.566   2.838
  230    H    VAL  30           H        VAL  30  -2.873  -9.968   0.016
  231    HA   VAL  30           HA       VAL  30  -2.385  -7.330   0.966
  232    HB   VAL  30           HB       VAL  30  -2.861  -8.106  -1.913
  233   1HG1  VAL  30          1HG1      VAL  30  -1.784  -6.156  -2.493
  234   2HG1  VAL  30          2HG1      VAL  30  -0.899  -6.067  -0.970
  235   3HG1  VAL  30          3HG1      VAL  30  -2.613  -5.658  -1.018
  236   1HG2  VAL  30          1HG2      VAL  30  -0.944  -9.242  -2.020
  237   2HG2  VAL  30          2HG2      VAL  30  -0.950  -9.255  -0.257
  238   3HG2  VAL  30          3HG2      VAL  30  -0.075  -7.996  -1.127
  239    H    LYS  31           H        LYS  31  -4.966  -8.808  -1.030
  240    HA   LYS  31           HA       LYS  31  -6.593  -6.656  -1.473
  241   1HB   LYS  31          2HB       LYS  31  -7.465  -9.442  -0.687
  242   2HB   LYS  31          1HB       LYS  31  -8.529  -8.221  -1.362
  243   1HG   LYS  31          2HG       LYS  31  -6.320  -9.732  -2.691
  244   2HG   LYS  31          1HG       LYS  31  -8.012  -9.580  -3.163
  245   1HD   LYS  31          2HD       LYS  31  -7.365  -7.029  -3.357
  246   2HD   LYS  31          1HD       LYS  31  -5.746  -7.703  -3.560
  247   1HE   LYS  31          2HE       LYS  31  -8.161  -8.437  -5.209
  248   2HE   LYS  31          1HE       LYS  31  -6.880  -7.336  -5.712
  249   1HZ   LYS  31          1HZ       LYS  31  -5.307  -9.199  -5.456
  250   2HZ   LYS  31          2HZ       LYS  31  -6.477  -9.486  -6.642
  251   3HZ   LYS  31          3HZ       LYS  31  -6.605 -10.233  -5.131
  252    H    GLN  32           H        GLN  32  -6.612  -8.759   1.364
  253    HA   GLN  32           HA       GLN  32  -8.547  -7.299   2.803
  254   1HB   GLN  32          2HB       GLN  32  -8.224  -9.462   3.582
  255   2HB   GLN  32          1HB       GLN  32  -6.479  -9.339   3.546
  256   1HG   GLN  32          2HG       GLN  32  -8.144  -7.763   5.478
  257   2HG   GLN  32          1HG       GLN  32  -7.648  -9.419   5.811
  258   1HE2  GLN  32          1HE2      GLN  32  -5.151  -8.295   4.059
  259   2HE2  GLN  32          2HE2      GLN  32  -4.163  -7.652   5.311
  260    H    PHE  33           H        PHE  33  -5.068  -6.997   2.507
  261    HA   PHE  33           HA       PHE  33  -4.515  -5.234   4.584
  262   1HB   PHE  33          2HB       PHE  33  -2.858  -6.377   3.060
  263   2HB   PHE  33          1HB       PHE  33  -3.251  -5.180   1.832
  264    HD1  PHE  33           1HD      PHE  33  -2.079  -5.449   5.345
  265    HD2  PHE  33           2HD      PHE  33  -1.980  -3.231   1.696
  266    HE1  PHE  33           1HE      PHE  33  -0.374  -3.951   6.296
  267    HE2  PHE  33           2HE      PHE  33  -0.276  -1.739   2.656
  268    HZ   PHE  33           HZ       PHE  33   0.528  -2.103   4.959
  269    H    PHE  34           H        PHE  34  -5.075  -4.383   1.191
  270    HA   PHE  34           HA       PHE  34  -5.444  -1.602   1.715
  271   1HB   PHE  34          2HB       PHE  34  -6.147  -3.218  -0.736
  272   2HB   PHE  34          1HB       PHE  34  -6.114  -1.454  -0.647
  273    HD1  PHE  34           1HD      PHE  34  -3.780  -0.834   0.849
  274    HD2  PHE  34           2HD      PHE  34  -4.358  -3.915  -2.020
  275    HE1  PHE  34           1HE      PHE  34  -1.364  -0.873   0.420
  276    HE2  PHE  34           2HE      PHE  34  -1.937  -3.960  -2.463
  277    HZ   PHE  34           HZ       PHE  34  -0.445  -2.442  -1.223
  278    H    ASN  35           H        ASN  35  -7.631  -4.305   1.225
  279    HA   ASN  35           HA       ASN  35 -10.072  -3.034   1.041
  280   1HB   ASN  35          2HB       ASN  35  -9.764  -5.478   0.915
  281   2HB   ASN  35          1HB       ASN  35  -9.402  -5.520   2.638
  282   1HD2  ASN  35          1HD2      ASN  35 -11.592  -6.522   0.730
  283   2HD2  ASN  35          2HD2      ASN  35 -13.050  -6.166   1.587
  284    H    ASP  36           H        ASP  36  -8.087  -3.676   3.836
  285    HA   ASP  36           HA       ASP  36  -9.982  -2.355   5.623
  286   1HB   ASP  36          2HB       ASP  36  -7.425  -3.857   6.219
  287   2HB   ASP  36          1HB       ASP  36  -8.463  -3.127   7.441
  288    H    ASN  37           H        ASN  37  -6.976  -1.659   4.007
  289    HA   ASN  37           HA       ASN  37  -6.269   0.477   5.826
  290   1HB   ASN  37          2HB       ASN  37  -5.194  -0.258   3.095
  291   2HB   ASN  37          1HB       ASN  37  -4.581   1.077   4.062
  292   1HD2  ASN  37          1HD2      ASN  37  -3.547  -1.649   3.090
  293   2HD2  ASN  37          2HD2      ASN  37  -2.813  -2.310   4.509
  294    H    GLY  38           H        GLY  38  -7.570   0.165   2.577
  295   1HA   GLY  38          2HA       GLY  38  -7.972   2.219   1.248
  296   2HA   GLY  38          1HA       GLY  38  -9.443   1.527   1.893
  297    H    VAL  39           H        VAL  39 -10.775   2.928   2.728
  298    HA   VAL  39           HA       VAL  39  -9.722   5.515   3.665
  299    HB   VAL  39           HB       VAL  39 -12.501   4.856   2.754
  300   1HG1  VAL  39          1HG1      VAL  39 -11.194   7.281   3.786
  301   2HG1  VAL  39          2HG1      VAL  39 -12.894   6.813   3.802
  302   3HG1  VAL  39          3HG1      VAL  39 -12.186   7.515   2.347
  303   1HG2  VAL  39          1HG2      VAL  39 -10.758   6.510   1.046
  304   2HG2  VAL  39          2HG2      VAL  39 -11.968   5.305   0.606
  305   3HG2  VAL  39          3HG2      VAL  39 -10.362   4.795   1.122
  306    H    ASP  40           H        ASP  40 -10.739   2.754   5.153
  307    HA   ASP  40           HA       ASP  40 -12.059   4.307   7.274
  308   1HB   ASP  40          2HB       ASP  40 -12.638   1.455   6.457
  309   2HB   ASP  40          1HB       ASP  40 -13.361   2.285   7.833
  310    H    GLY  41           H        GLY  41  -9.196   3.116   6.673
  311   1HA   GLY  41          2HA       GLY  41  -8.817   1.390   8.963
  312   2HA   GLY  41          1HA       GLY  41  -7.572   1.942   7.854
  313    H    GLU  42           H        GLU  42  -6.731   1.922  10.294
  314    HA   GLU  42           HA       GLU  42  -7.213   4.534  11.536
  315   1HB   GLU  42          2HB       GLU  42  -5.648   2.145  12.539
  316   2HB   GLU  42          1HB       GLU  42  -5.933   3.625  13.442
  317   1HG   GLU  42          2HG       GLU  42  -8.333   3.185  13.416
  318   2HG   GLU  42          1HG       GLU  42  -8.052   1.704  12.503
  319    H    TRP  43           H        TRP  43  -6.048   6.026  10.421
  320    HA   TRP  43           HA       TRP  43  -3.293   5.418   9.684
  321   1HB   TRP  43          2HB       TRP  43  -5.077   7.751   9.000
  322   2HB   TRP  43          1HB       TRP  43  -3.430   7.546   8.417
  323    HD1  TRP  43           HD       TRP  43  -6.314   4.936   8.501
  324    HE1  TRP  43           1HE      TRP  43  -6.622   4.051   6.098
  325    HE3  TRP  43           3HE      TRP  43  -2.882   7.865   6.115
  326    HZ2  TRP  43           2HZ      TRP  43  -5.546   4.537   3.536
  327    HZ3  TRP  43           3HZ      TRP  43  -2.580   7.597   3.693
  328    HH2  TRP  43           HH       TRP  43  -3.890   5.968   2.429
  329    H    THR  44           H        THR  44  -1.651   5.992  10.917
  330    HA   THR  44           HA       THR  44  -1.963   8.300  12.721
  331    HB   THR  44           HB       THR  44  -0.047   7.273  13.989
  332    HG1  THR  44           1HG      THR  44  -0.608   4.965  12.458
  333   1HG2  THR  44          1HG2      THR  44  -1.378   6.025  15.308
  334   2HG2  THR  44          2HG2      THR  44  -2.068   5.129  13.955
  335   3HG2  THR  44          3HG2      THR  44  -2.641   6.758  14.318
  336    H    TYR  45           H        TYR  45  -0.525   9.989  12.546
  337    HA   TYR  45           HA       TYR  45   1.420   9.776  10.344
  338   1HB   TYR  45          2HB       TYR  45  -0.368  11.382   9.925
  339   2HB   TYR  45          1HB       TYR  45  -0.002  12.211  11.433
  340    HD1  TYR  45           1HD      TYR  45   2.213  10.971   8.690
  341    HD2  TYR  45           2HD      TYR  45   0.802  14.314  10.911
  342    HE1  TYR  45           1HE      TYR  45   3.798  12.426   7.497
  343    HE2  TYR  45           2HE      TYR  45   2.382  15.778   9.724
  344    HH   TYR  45           HH       TYR  45   3.621  15.810   7.600
  345    H    ASP  46           H        ASP  46   3.473  10.632  10.532
  346    HA   ASP  46           HA       ASP  46   4.334  11.386  13.245
  347   1HB   ASP  46          2HB       ASP  46   5.105   9.110  12.712
  348   2HB   ASP  46          1HB       ASP  46   5.865   9.708  11.241
  349    H    ASP  47           H        ASP  47   4.029  13.579  12.554
  350    HA   ASP  47           HA       ASP  47   5.006  14.860  10.357
  351   1HB   ASP  47          2HB       ASP  47   5.004  15.912  13.191
  352   2HB   ASP  47          1HB       ASP  47   5.132  16.902  11.739
  353    H    ALA  48           H        ALA  48   6.851  13.878  13.191
  354    HA   ALA  48           HA       ALA  48   9.169  15.309  12.890
  355   1HB   ALA  48          1HB       ALA  48   9.288  14.062  14.770
  356   2HB   ALA  48          2HB       ALA  48  10.210  12.988  13.717
  357   3HB   ALA  48          3HB       ALA  48   8.504  12.668  14.027
  358    H    THR  49           H        THR  49   8.179  12.460  11.075
  359    HA   THR  49           HA       THR  49  10.473  12.916   9.283
  360    HB   THR  49           HB       THR  49  10.628  10.480   8.920
  361    HG1  THR  49           1HG      THR  49   8.601  10.435  10.885
  362   1HG2  THR  49          1HG2      THR  49  11.076   9.997  11.558
  363   2HG2  THR  49          2HG2      THR  49  11.211  11.753  11.478
  364   3HG2  THR  49          3HG2      THR  49  12.226  10.744  10.449
  365    H    LYS  50           H        LYS  50   7.361  13.377   9.372
  366    HA   LYS  50           HA       LYS  50   5.630  13.399   7.879
  367   1HB   LYS  50          2HB       LYS  50   8.011  13.344   6.049
  368   2HB   LYS  50          1HB       LYS  50   6.388  13.289   5.395
  369   1HG   LYS  50          2HG       LYS  50   6.874  15.531   5.304
  370   2HG   LYS  50          1HG       LYS  50   5.993  15.409   6.820
  371   1HD   LYS  50          2HD       LYS  50   8.006  16.830   6.955
  372   2HD   LYS  50          1HD       LYS  50   8.045  15.463   8.072
  373   1HE   LYS  50          2HE       LYS  50   9.526  14.256   6.573
  374   2HE   LYS  50          1HE       LYS  50   9.418  15.555   5.385
  375   1HZ   LYS  50          1HZ       LYS  50  11.459  15.571   6.791
  376   2HZ   LYS  50          2HZ       LYS  50  10.485  15.935   8.125
  377   3HZ   LYS  50          3HZ       LYS  50  10.575  17.015   6.827
  378    H    THR  51           H        THR  51   6.565  10.855   8.979
  379    HA   THR  51           HA       THR  51   5.985   8.978   6.824
  380    HB   THR  51           HB       THR  51   6.918   8.485   9.654
  381    HG1  THR  51           1HG      THR  51   8.487   9.477   8.341
  382   1HG2  THR  51          1HG2      THR  51   5.665   6.628   8.214
  383   2HG2  THR  51          2HG2      THR  51   7.020   6.267   9.283
  384   3HG2  THR  51          3HG2      THR  51   7.289   6.455   7.549
  385    H    PHE  52           H        PHE  52   4.176   7.807   6.682
  386    HA   PHE  52           HA       PHE  52   2.150   8.161   8.792
  387   1HB   PHE  52          2HB       PHE  52   1.736   7.546   5.855
  388   2HB   PHE  52          1HB       PHE  52   0.463   7.768   7.050
  389    HD1  PHE  52           1HD      PHE  52  -0.458   9.862   7.381
  390    HD2  PHE  52           2HD      PHE  52   3.333   9.531   5.476
  391    HE1  PHE  52           1HE      PHE  52  -0.503  12.271   6.880
  392    HE2  PHE  52           2HE      PHE  52   3.295  11.938   4.975
  393    HZ   PHE  52           HZ       PHE  52   1.377  13.313   5.678
  394    H    THR  53           H        THR  53   1.487   6.370   9.846
  395    HA   THR  53           HA       THR  53   2.305   3.786   8.717
  396    HB   THR  53           HB       THR  53   1.961   3.021  11.180
  397    HG1  THR  53           1HG      THR  53   1.171   5.267  11.669
  398   1HG2  THR  53          1HG2      THR  53   4.279   4.557  10.108
  399   2HG2  THR  53          2HG2      THR  53   4.114   2.823  10.391
  400   3HG2  THR  53          3HG2      THR  53   4.292   3.928  11.757
  401    H    VAL  54           H        VAL  54   0.572   3.334   7.503
  402    HA   VAL  54           HA       VAL  54  -2.109   3.395   8.599
  403    HB   VAL  54           HB       VAL  54  -1.151   2.251   5.965
  404   1HG1  VAL  54          1HG1      VAL  54  -3.464   2.349   5.276
  405   2HG1  VAL  54          2HG1      VAL  54  -3.928   3.049   6.827
  406   3HG1  VAL  54          3HG1      VAL  54  -3.332   1.392   6.752
  407   1HG2  VAL  54          1HG2      VAL  54  -0.636   4.613   6.084
  408   2HG2  VAL  54          2HG2      VAL  54  -2.279   4.973   6.611
  409   3HG2  VAL  54          3HG2      VAL  54  -1.991   4.353   4.986
  410    H    THR  55           H        THR  55  -2.864   1.806   9.843
  411    HA   THR  55           HA       THR  55  -1.448  -0.704   9.959
  412    HB   THR  55           HB       THR  55  -3.918   0.038  11.518
  413    HG1  THR  55           1HG      THR  55  -2.499   1.638  11.996
  414   1HG2  THR  55          1HG2      THR  55  -3.424  -2.231  11.867
  415   2HG2  THR  55          2HG2      THR  55  -2.734  -1.379  13.248
  416   3HG2  THR  55          3HG2      THR  55  -1.687  -1.924  11.935
  417    H    GLU  56           H        GLU  56  -2.559  -2.736  10.006
  418    HA   GLU  56           HA       GLU  56  -4.363  -2.972   7.721
  419   1HB   GLU  56          2HB       GLU  56  -2.469  -4.481   7.850
  420   2HB   GLU  56          1HB       GLU  56  -3.024  -5.096   9.398
  421   1HG   GLU  56          2HG       GLU  56  -5.013  -6.004   8.307
  422   2HG   GLU  56          1HG       GLU  56  -4.435  -5.389   6.757
  423   1H    MET   1          1HT       MET   1   7.113  19.417  -1.753
  424   2H    MET   1          2HT       MET   1   5.803  18.650  -1.007
  425   3H    MET   1          3HT       MET   1   6.444  18.023  -2.441
  426    HA   MET   1           HA       MET   1   8.626  17.832  -1.108
  427   1HB   MET   1          2HB       MET   1   7.300  19.111   0.776
  428   2HB   MET   1          1HB       MET   1   6.692  17.508   1.164
  429   1HG   MET   1          2HG       MET   1   9.289  16.937   1.091
  430   2HG   MET   1          1HG       MET   1   9.401  18.644   1.504
  431   1HE   MET   1          1HE       MET   1   8.138  15.032   3.531
  432   2HE   MET   1          2HE       MET   1   7.506  15.583   1.978
  433   3HE   MET   1          3HE       MET   1   6.588  15.866   3.452
  434    H    GLN   2           H        GLN   2   9.091  15.649  -0.267
  435    HA   GLN   2           HA       GLN   2   7.198  13.691  -1.339
  436   1HB   GLN   2          2HB       GLN   2   9.482  13.583  -2.218
  437   2HB   GLN   2          1HB       GLN   2  10.115  13.406  -0.588
  438   1HG   GLN   2          2HG       GLN   2   8.953  11.271  -0.364
  439   2HG   GLN   2          1HG       GLN   2   8.315  11.448  -1.999
  440   1HE2  GLN   2          1HE2      GLN   2   9.363  10.305  -3.443
  441   2HE2  GLN   2          2HE2      GLN   2  11.045   9.910  -3.419
  442    H    TYR   3           H        TYR   3   6.160  12.273  -0.048
  443    HA   TYR   3           HA       TYR   3   6.889  12.280   2.807
  444   1HB   TYR   3          2HB       TYR   3   4.174  12.028   1.509
  445   2HB   TYR   3          1HB       TYR   3   4.468  11.672   3.208
  446    HD1  TYR   3           1HD      TYR   3   4.583  13.403   4.810
  447    HD2  TYR   3           2HD      TYR   3   4.589  14.371   0.668
  448    HE1  TYR   3           1HE      TYR   3   4.294  15.777   5.376
  449    HE2  TYR   3           2HE      TYR   3   4.294  16.752   1.219
  450    HH   TYR   3           HH       TYR   3   3.751  17.824   4.530
  451    H    LYS   4           H        LYS   4   6.957  10.348   3.914
  452    HA   LYS   4           HA       LYS   4   7.048   7.967   2.194
  453   1HB   LYS   4          2HB       LYS   4   9.114   8.549   3.423
  454   2HB   LYS   4          1HB       LYS   4   8.240   8.396   4.940
  455   1HG   LYS   4          2HG       LYS   4   7.839   6.031   4.474
  456   2HG   LYS   4          1HG       LYS   4   8.720   6.186   2.954
  457   1HD   LYS   4          2HD       LYS   4  10.738   6.817   4.192
  458   2HD   LYS   4          1HD       LYS   4   9.854   6.655   5.711
  459   1HE   LYS   4          2HE       LYS   4  11.202   4.673   5.269
  460   2HE   LYS   4          1HE       LYS   4   9.483   4.287   5.248
  461   1HZ   LYS   4          1HZ       LYS   4  11.214   4.698   2.869
  462   2HZ   LYS   4          2HZ       LYS   4   9.551   4.392   2.817
  463   3HZ   LYS   4          3HZ       LYS   4  10.608   3.217   3.420
  464    H    VAL   5           H        VAL   5   5.127   6.970   2.196
  465    HA   VAL   5           HA       VAL   5   3.589   6.850   4.672
  466    HB   VAL   5           HB       VAL   5   2.827   5.991   1.877
  467   1HG1  VAL   5          1HG1      VAL   5   1.058   6.262   4.301
  468   2HG1  VAL   5          2HG1      VAL   5   1.687   4.729   3.700
  469   3HG1  VAL   5          3HG1      VAL   5   0.595   5.687   2.700
  470   1HG2  VAL   5          1HG2      VAL   5   2.325   8.116   1.489
  471   2HG2  VAL   5          2HG2      VAL   5   2.938   8.555   3.083
  472   3HG2  VAL   5          3HG2      VAL   5   1.241   8.122   2.880
  473    H    ILE   6           H        ILE   6   3.992   5.262   5.984
  474    HA   ILE   6           HA       ILE   6   5.023   2.716   4.992
  475    HB   ILE   6           HB       ILE   6   4.754   3.769   7.812
  476   1HG1  ILE   6          2HG1      ILE   6   7.145   3.463   5.983
  477   2HG1  ILE   6          1HG1      ILE   6   6.436   4.975   6.542
  478   1HG2  ILE   6          1HG2      ILE   6   6.553   1.511   7.305
  479   2HG2  ILE   6          2HG2      ILE   6   4.837   1.142   7.129
  480   3HG2  ILE   6          3HG2      ILE   6   5.446   1.809   8.644
  481   1HD1  ILE   6          1HD1      ILE   6   7.996   2.954   8.110
  482   2HD1  ILE   6          2HD1      ILE   6   7.007   4.187   8.890
  483   3HD1  ILE   6          3HD1      ILE   6   8.350   4.661   7.848
  484    H    LEU   7           H        LEU   7   3.812   0.945   4.842
  485    HA   LEU   7           HA       LEU   7   1.111   0.982   6.018
  486   1HB   LEU   7          2HB       LEU   7   2.008  -0.857   3.817
  487   2HB   LEU   7          1HB       LEU   7   0.379  -0.341   4.217
  488    HG   LEU   7           HG       LEU   7   2.512   1.375   2.961
  489   1HD1  LEU   7          1HD1      LEU   7   1.450  -0.433   1.557
  490   2HD1  LEU   7          2HD1      LEU   7   1.276   1.214   0.955
  491   3HD1  LEU   7          3HD1      LEU   7  -0.076   0.423   1.764
  492   1HD2  LEU   7          1HD2      LEU   7   0.907   3.117   2.868
  493   2HD2  LEU   7          2HD2      LEU   7   0.921   2.533   4.532
  494   3HD2  LEU   7          3HD2      LEU   7  -0.380   2.055   3.443
  495    H    ASN   8           H        ASN   8   1.320   0.004   7.997
  496    HA   ASN   8           HA       ASN   8   2.841  -2.501   8.145
  497   1HB   ASN   8          2HB       ASN   8   2.009  -0.492  10.216
  498   2HB   ASN   8          1HB       ASN   8   2.547  -2.105  10.668
  499   1HD2  ASN   8          1HD2      ASN   8   4.526  -1.999  11.391
  500   2HD2  ASN   8          2HD2      ASN   8   5.824  -1.097  10.689
  501    H    GLY   9           H        GLY   9   1.644  -4.252   7.806
  502   1HA   GLY   9          2HA       GLY   9  -0.982  -4.381   9.139
  503   2HA   GLY   9          1HA       GLY   9  -0.597  -5.230   7.646
  504    H    LYS  10           H        LYS  10  -1.560  -6.942   9.241
  505    HA   LYS  10           HA       LYS  10   0.282  -7.939  11.199
  506   1HB   LYS  10          2HB       LYS  10  -2.247  -9.098  10.024
  507   2HB   LYS  10          1HB       LYS  10  -1.290  -9.925  11.240
  508   1HG   LYS  10          2HG       LYS  10  -3.120  -8.839  12.316
  509   2HG   LYS  10          1HG       LYS  10  -1.634  -7.996  12.755
  510   1HD   LYS  10          2HD       LYS  10  -2.117  -6.246  11.150
  511   2HD   LYS  10          1HD       LYS  10  -3.553  -7.114  10.600
  512   1HE   LYS  10          2HE       LYS  10  -4.526  -6.897  12.840
  513   2HE   LYS  10          1HE       LYS  10  -3.097  -6.014  13.372
  514   1HZ   LYS  10          1HZ       LYS  10  -4.664  -4.385  12.860
  515   2HZ   LYS  10          2HZ       LYS  10  -5.167  -5.158  11.443
  516   3HZ   LYS  10          3HZ       LYS  10  -3.653  -4.408  11.504
  517    H    THR  11           H        THR  11  -0.852  -9.056   8.022
  518    HA   THR  11           HA       THR  11   1.402 -10.916   7.882
  519    HB   THR  11           HB       THR  11   0.006 -11.781   5.897
  520    HG1  THR  11           1HG      THR  11  -2.254 -11.268   6.197
  521   1HG2  THR  11          1HG2      THR  11  -1.829 -12.610   7.694
  522   2HG2  THR  11          2HG2      THR  11  -0.501 -12.143   8.756
  523   3HG2  THR  11          3HG2      THR  11  -0.235 -13.336   7.485
  524    H    LEU  12           H        LEU  12   0.748  -7.838   6.990
  525    HA   LEU  12           HA       LEU  12   2.499  -8.065   4.660
  526   1HB   LEU  12          2HB       LEU  12   0.222  -7.892   3.812
  527   2HB   LEU  12          1HB       LEU  12  -0.037  -6.440   4.761
  528    HG   LEU  12           HG       LEU  12   1.486  -5.191   3.412
  529   1HD1  LEU  12          1HD1      LEU  12   3.279  -6.250   2.638
  530   2HD1  LEU  12          2HD1      LEU  12   2.256  -6.834   1.323
  531   3HD1  LEU  12          3HD1      LEU  12   2.493  -7.820   2.762
  532   1HD2  LEU  12          1HD2      LEU  12   0.271  -6.546   1.150
  533   2HD2  LEU  12          2HD2      LEU  12   0.026  -4.908   1.755
  534   3HD2  LEU  12          3HD2      LEU  12  -0.871  -6.253   2.460
  535    H    LYS  13           H        LYS  13   4.002  -6.533   4.456
  536    HA   LYS  13           HA       LYS  13   3.849  -4.100   6.060
  537   1HB   LYS  13          2HB       LYS  13   6.280  -5.896   6.144
  538   2HB   LYS  13          1HB       LYS  13   6.049  -4.390   7.019
  539   1HG   LYS  13          2HG       LYS  13   5.622  -5.911   8.668
  540   2HG   LYS  13          1HG       LYS  13   3.997  -5.645   8.038
  541   1HD   LYS  13          2HD       LYS  13   4.348  -8.007   8.340
  542   2HD   LYS  13          1HD       LYS  13   4.266  -7.655   6.615
  543   1HE   LYS  13          2HE       LYS  13   6.699  -7.712   6.473
  544   2HE   LYS  13          1HE       LYS  13   6.801  -8.020   8.206
  545   1HZ   LYS  13          1HZ       LYS  13   6.097 -10.160   7.961
  546   2HZ   LYS  13          2HZ       LYS  13   6.894  -9.964   6.482
  547   3HZ   LYS  13          3HZ       LYS  13   5.209  -9.845   6.555
  548    H    GLY  14           H        GLY  14   4.973  -2.367   5.141
  549   1HA   GLY  14          2HA       GLY  14   6.913  -2.694   3.094
  550   2HA   GLY  14          1HA       GLY  14   5.337  -2.390   2.384
  551    H    GLU  15           H        GLU  15   6.902  -0.596   1.618
  552    HA   GLU  15           HA       GLU  15   6.279   1.768   3.222
  553   1HB   GLU  15          2HB       GLU  15   9.015   1.176   2.068
  554   2HB   GLU  15          1HB       GLU  15   8.531   2.710   2.773
  555   1HG   GLU  15          2HG       GLU  15   9.785   1.573   4.411
  556   2HG   GLU  15          1HG       GLU  15   8.099   1.481   4.914
  557    H    THR  16           H        THR  16   5.638   3.477   2.032
  558    HA   THR  16           HA       THR  16   6.101   3.416  -0.855
  559    HB   THR  16           HB       THR  16   3.958   2.574  -0.901
  560    HG1  THR  16           1HG      THR  16   3.433   5.327  -0.729
  561   1HG2  THR  16          1HG2      THR  16   2.123   3.169   0.531
  562   2HG2  THR  16          2HG2      THR  16   3.116   4.370   1.351
  563   3HG2  THR  16          3HG2      THR  16   3.501   2.657   1.505
  564    H    THR  17           H        THR  17   5.539   5.558  -1.898
  565    HA   THR  17           HA       THR  17   5.806   7.805  -0.044
  566    HB   THR  17           HB       THR  17   7.664   8.739  -1.411
  567    HG1  THR  17           1HG      THR  17   7.738   6.138  -2.532
  568   1HG2  THR  17          1HG2      THR  17   8.734   6.121  -0.588
  569   2HG2  THR  17          2HG2      THR  17   7.898   7.054   0.652
  570   3HG2  THR  17          3HG2      THR  17   9.281   7.751  -0.194
  571    H    THR  18           H        THR  18   4.372   9.277  -0.520
  572    HA   THR  18           HA       THR  18   3.479   9.645  -3.317
  573    HB   THR  18           HB       THR  18   1.712   9.070  -1.665
  574    HG1  THR  18           1HG      THR  18   1.266  10.458  -3.459
  575   1HG2  THR  18          1HG2      THR  18   2.374   9.966   0.383
  576   2HG2  THR  18          2HG2      THR  18   1.007  10.961  -0.122
  577   3HG2  THR  18          3HG2      THR  18   2.653  11.565  -0.306
  578    H    GLU  19           H        GLU  19   3.477  11.743  -4.194
  579    HA   GLU  19           HA       GLU  19   5.138  13.688  -2.722
  580   1HB   GLU  19          2HB       GLU  19   6.063  12.943  -4.874
  581   2HB   GLU  19          1HB       GLU  19   4.595  13.457  -5.693
  582   1HG   GLU  19          2HG       GLU  19   5.050  15.769  -5.071
  583   2HG   GLU  19          1HG       GLU  19   6.516  15.258  -4.236
  584    H    ALA  20           H        ALA  20   3.925  15.195  -1.722
  585    HA   ALA  20           HA       ALA  20   1.821  16.506  -3.269
  586   1HB   ALA  20          1HB       ALA  20   0.113  16.111  -1.809
  587   2HB   ALA  20          2HB       ALA  20   1.192  15.886  -0.432
  588   3HB   ALA  20          3HB       ALA  20   1.016  14.607  -1.632
  589    H    VAL  21           H        VAL  21   1.284  18.579  -2.593
  590    HA   VAL  21           HA       VAL  21   3.333  20.257  -1.872
  591    HB   VAL  21           HB       VAL  21   0.428  20.824  -1.289
  592   1HG1  VAL  21          1HG1      VAL  21   1.966  22.470  -0.375
  593   2HG1  VAL  21          2HG1      VAL  21   1.060  23.151  -1.727
  594   3HG1  VAL  21          3HG1      VAL  21   2.736  22.648  -1.952
  595   1HG2  VAL  21          1HG2      VAL  21   0.565  21.871  -3.640
  596   2HG2  VAL  21          2HG2      VAL  21   0.369  20.123  -3.506
  597   3HG2  VAL  21          3HG2      VAL  21   1.954  20.808  -3.867
  598    H    ASP  22           H        ASP  22   1.176  18.505   0.240
  599    HA   ASP  22           HA       ASP  22   2.863  19.172   2.495
  600   1HB   ASP  22          2HB       ASP  22   1.091  20.024   3.933
  601   2HB   ASP  22          1HB       ASP  22   1.265  21.041   2.508
  602    H    ALA  23           H        ALA  23   1.794  18.138   4.584
  603    HA   ALA  23           HA       ALA  23   1.808  15.378   4.172
  604   1HB   ALA  23          1HB       ALA  23   1.905  17.065   6.365
  605   2HB   ALA  23          2HB       ALA  23   1.994  15.305   6.388
  606   3HB   ALA  23          3HB       ALA  23   0.443  16.112   6.618
  607    H    ALA  24           H        ALA  24  -0.918  17.584   4.654
  608    HA   ALA  24           HA       ALA  24  -2.921  15.605   4.764
  609   1HB   ALA  24          1HB       ALA  24  -2.950  18.524   4.056
  610   2HB   ALA  24          2HB       ALA  24  -3.598  17.722   5.488
  611   3HB   ALA  24          3HB       ALA  24  -4.409  17.542   3.932
  612    H    THR  25           H        THR  25  -1.837  17.619   2.013
  613    HA   THR  25           HA       THR  25  -3.407  16.489   0.042
  614    HB   THR  25           HB       THR  25  -1.546  17.131  -1.517
  615    HG1  THR  25           1HG      THR  25  -0.211  17.394   0.906
  616   1HG2  THR  25          1HG2      THR  25  -2.563  19.091  -1.470
  617   2HG2  THR  25          2HG2      THR  25  -1.409  19.579  -0.230
  618   3HG2  THR  25          3HG2      THR  25  -2.971  18.904   0.235
  619    H    ALA  26           H        ALA  26  -0.260  15.458   1.299
  620    HA   ALA  26           HA       ALA  26   0.100  13.230  -0.374
  621   1HB   ALA  26          1HB       ALA  26   1.580  12.385   1.465
  622   2HB   ALA  26          2HB       ALA  26   1.063  13.762   2.437
  623   3HB   ALA  26          3HB       ALA  26   1.945  14.026   0.933
  624    H    GLU  27           H        GLU  27  -1.235  13.446   2.941
  625    HA   GLU  27           HA       GLU  27  -2.001  10.827   3.276
  626   1HB   GLU  27          2HB       GLU  27  -2.094  12.505   5.055
  627   2HB   GLU  27          1HB       GLU  27  -3.429  13.304   4.238
  628   1HG   GLU  27          2HG       GLU  27  -4.808  11.317   4.546
  629   2HG   GLU  27          1HG       GLU  27  -3.471  10.521   5.374
  630    H    LYS  28           H        LYS  28  -3.867  13.490   1.833
  631    HA   LYS  28           HA       LYS  28  -6.200  12.031   1.298
  632   1HB   LYS  28          2HB       LYS  28  -5.022  14.389  -0.186
  633   2HB   LYS  28          1HB       LYS  28  -6.658  13.782  -0.411
  634   1HG   LYS  28          2HG       LYS  28  -5.513  14.962   2.111
  635   2HG   LYS  28          1HG       LYS  28  -6.688  15.710   1.026
  636   1HD   LYS  28          2HD       LYS  28  -8.281  13.920   1.524
  637   2HD   LYS  28          1HD       LYS  28  -7.107  13.180   2.612
  638   1HE   LYS  28          2HE       LYS  28  -8.341  15.916   2.916
  639   2HE   LYS  28          1HE       LYS  28  -8.757  14.481   3.851
  640   1HZ   LYS  28          1HZ       LYS  28  -7.151  15.006   5.260
  641   2HZ   LYS  28          2HZ       LYS  28  -6.704  16.342   4.322
  642   3HZ   LYS  28          3HZ       LYS  28  -5.997  14.832   4.036
  643    H    VAL  29           H        VAL  29  -3.289  12.589  -0.613
  644    HA   VAL  29           HA       VAL  29  -4.107  11.265  -2.941
  645    HB   VAL  29           HB       VAL  29  -1.330  11.620  -1.797
  646   1HG1  VAL  29          1HG1      VAL  29  -2.274  10.506  -4.406
  647   2HG1  VAL  29          2HG1      VAL  29  -1.015   9.911  -3.325
  648   3HG1  VAL  29          3HG1      VAL  29  -0.731  11.349  -4.301
  649   1HG2  VAL  29          1HG2      VAL  29  -3.003  13.563  -2.630
  650   2HG2  VAL  29          2HG2      VAL  29  -2.216  13.150  -4.153
  651   3HG2  VAL  29          3HG2      VAL  29  -1.247  13.653  -2.769
  652    H    VAL  30           H        VAL  30  -2.629  10.087   0.035
  653    HA   VAL  30           HA       VAL  30  -2.192   7.438  -0.909
  654    HB   VAL  30           HB       VAL  30  -2.690   8.226   1.964
  655   1HG1  VAL  30          1HG1      VAL  30  -1.668   6.250   2.557
  656   2HG1  VAL  30          2HG1      VAL  30  -0.766   6.140   1.047
  657   3HG1  VAL  30          3HG1      VAL  30  -2.490   5.773   1.071
  658   1HG2  VAL  30          1HG2      VAL  30  -0.748   9.315   2.099
  659   2HG2  VAL  30          2HG2      VAL  30  -0.728   9.328   0.335
  660   3HG2  VAL  30          3HG2      VAL  30   0.104   8.048   1.217
  661    H    LYS  31           H        LYS  31  -4.765   8.980   1.051
  662    HA   LYS  31           HA       LYS  31  -6.449   6.867   1.471
  663   1HB   LYS  31          2HB       LYS  31  -7.241   9.673   0.673
  664   2HB   LYS  31          1HB       LYS  31  -8.345   8.479   1.332
  665   1HG   LYS  31          2HG       LYS  31  -6.119   9.935   2.693
  666   2HG   LYS  31          1HG       LYS  31  -7.821   9.825   3.140
  667   1HD   LYS  31          2HD       LYS  31  -7.238   7.258   3.343
  668   2HD   LYS  31          1HD       LYS  31  -5.607   7.893   3.569
  669   1HE   LYS  31          2HE       LYS  31  -8.027   8.686   5.184
  670   2HE   LYS  31          1HE       LYS  31  -6.780   7.555   5.704
  671   1HZ   LYS  31          1HZ       LYS  31  -5.158   9.379   5.472
  672   2HZ   LYS  31          2HZ       LYS  31  -6.338   9.694   6.639
  673   3HZ   LYS  31          3HZ       LYS  31  -6.426  10.444   5.128
  674    H    GLN  32           H        GLN  32  -6.376   8.970  -1.366
  675    HA   GLN  32           HA       GLN  32  -8.326   7.557  -2.833
  676   1HB   GLN  32          2HB       GLN  32  -7.941   9.711  -3.605
  677   2HB   GLN  32          1HB       GLN  32  -6.198   9.546  -3.547
  678   1HG   GLN  32          2HG       GLN  32  -7.874   8.010  -5.502
  679   2HG   GLN  32          1HG       GLN  32  -7.334   9.653  -5.826
  680   1HE2  GLN  32          1HE2      GLN  32  -4.889   8.469  -4.040
  681   2HE2  GLN  32          2HE2      GLN  32  -3.901   7.803  -5.278
  682    H    PHE  33           H        PHE  33  -4.862   7.170  -2.487
  683    HA   PHE  33           HA       PHE  33  -4.322   5.394  -4.557
  684   1HB   PHE  33          2HB       PHE  33  -2.658   6.497  -3.009
  685   2HB   PHE  33          1HB       PHE  33  -3.097   5.310  -1.787
  686    HD1  PHE  33           1HD      PHE  33  -1.870   5.551  -5.283
  687    HD2  PHE  33           2HD      PHE  33  -1.877   3.329  -1.633
  688    HE1  PHE  33           1HE      PHE  33  -0.189   4.010  -6.210
  689    HE2  PHE  33           2HE      PHE  33  -0.196   1.797  -2.570
  690    HZ   PHE  33           HZ       PHE  33   0.649   2.141  -4.859
  691    H    PHE  34           H        PHE  34  -4.948   4.558  -1.172
  692    HA   PHE  34           HA       PHE  34  -5.379   1.786  -1.703
  693   1HB   PHE  34          2HB       PHE  34  -6.077   3.419   0.739
  694   2HB   PHE  34          1HB       PHE  34  -6.086   1.653   0.651
  695    HD1  PHE  34           1HD      PHE  34  -3.748   0.977  -0.813
  696    HD2  PHE  34           2HD      PHE  34  -4.289   4.073   2.049
  697    HE1  PHE  34           1HE      PHE  34  -1.337   0.959  -0.350
  698    HE2  PHE  34           2HE      PHE  34  -1.876   4.059   2.526
  699    HZ   PHE  34           HZ       PHE  34  -0.402   2.505   1.306
  700    H    ASN  35           H        ASN  35  -7.507   4.542  -1.243
  701    HA   ASN  35           HA       ASN  35  -9.979   3.329  -1.093
  702   1HB   ASN  35          2HB       ASN  35  -9.615   5.766  -0.963
  703   2HB   ASN  35          1HB       ASN  35  -9.227   5.800  -2.679
  704   1HD2  ASN  35          1HD2      ASN  35 -11.419   6.854  -0.804
  705   2HD2  ASN  35          2HD2      ASN  35 -12.872   6.532  -1.681
  706    H    ASP  36           H        ASP  36  -7.939   3.924  -3.859
  707    HA   ASP  36           HA       ASP  36  -9.840   2.649  -5.675
  708   1HB   ASP  36          2HB       ASP  36  -7.240   4.087  -6.232
  709   2HB   ASP  36          1HB       ASP  36  -8.277   3.383  -7.470
  710    H    ASN  37           H        ASN  37  -6.877   1.879  -4.017
  711    HA   ASN  37           HA       ASN  37  -6.195  -0.274  -5.826
  712   1HB   ASN  37          2HB       ASN  37  -5.142   0.436  -3.079
  713   2HB   ASN  37          1HB       ASN  37  -4.548  -0.914  -4.036
  714   1HD2  ASN  37          1HD2      ASN  37  -3.462   1.787  -3.050
  715   2HD2  ASN  37          2HD2      ASN  37  -2.692   2.430  -4.458
  716    H    GLY  38           H        GLY  38  -7.535   0.071  -2.594
  717   1HA   GLY  38          2HA       GLY  38  -8.006  -1.972  -1.271
  718   2HA   GLY  38          1HA       GLY  38  -9.450  -1.245  -1.938
  719    H    VAL  39           H        VAL  39 -10.803  -2.613  -2.792
  720    HA   VAL  39           HA       VAL  39  -9.800  -5.226  -3.714
  721    HB   VAL  39           HB       VAL  39 -12.574  -4.498  -2.842
  722   1HG1  VAL  39          1HG1      VAL  39 -11.312  -6.954  -3.856
  723   2HG1  VAL  39          2HG1      VAL  39 -13.000  -6.446  -3.895
  724   3HG1  VAL  39          3HG1      VAL  39 -12.331  -7.165  -2.431
  725   1HG2  VAL  39          1HG2      VAL  39 -10.898  -6.196  -1.109
  726   2HG2  VAL  39          2HG2      VAL  39 -12.083  -4.960  -0.686
  727   3HG2  VAL  39          3HG2      VAL  39 -10.458  -4.489  -1.179
  728    H    ASP  40           H        ASP  40 -10.729  -2.441  -5.216
  729    HA   ASP  40           HA       ASP  40 -12.057  -3.962  -7.354
  730   1HB   ASP  40          2HB       ASP  40 -12.577  -1.096  -6.546
  731   2HB   ASP  40          1HB       ASP  40 -13.299  -1.908  -7.932
  732    H    GLY  41           H        GLY  41  -9.173  -2.839  -6.712
  733   1HA   GLY  41          2HA       GLY  41  -8.722  -1.124  -8.997
  734   2HA   GLY  41          1HA       GLY  41  -7.505  -1.705  -7.872
  735    H    GLU  42           H        GLU  42  -6.631  -1.708 -10.298
  736    HA   GLU  42           HA       GLU  42  -7.157  -4.306 -11.548
  737   1HB   GLU  42          2HB       GLU  42  -5.521  -1.956 -12.527
  738   2HB   GLU  42          1HB       GLU  42  -5.830  -3.430 -13.436
  739   1HG   GLU  42          2HG       GLU  42  -8.218  -2.932 -13.444
  740   2HG   GLU  42          1HG       GLU  42  -7.914  -1.458 -12.526
  741    H    TRP  43           H        TRP  43  -6.043  -5.827 -10.417
  742    HA   TRP  43           HA       TRP  43  -3.286  -5.285  -9.642
  743   1HB   TRP  43          2HB       TRP  43  -5.136  -7.575  -8.984
  744   2HB   TRP  43          1HB       TRP  43  -3.493  -7.409  -8.376
  745    HD1  TRP  43           HD       TRP  43  -6.312  -4.729  -8.503
  746    HE1  TRP  43           1HE      TRP  43  -6.632  -3.837  -6.103
  747    HE3  TRP  43           3HE      TRP  43  -2.986  -7.741  -6.067
  748    HZ2  TRP  43           2HZ      TRP  43  -5.603  -4.348  -3.525
  749    HZ3  TRP  43           3HZ      TRP  43  -2.712  -7.480  -3.642
  750    HH2  TRP  43           HH       TRP  43  -3.998  -5.818  -2.396
  751    H    THR  44           H        THR  44  -1.641  -5.900 -10.850
  752    HA   THR  44           HA       THR  44  -1.984  -8.201 -12.660
  753    HB   THR  44           HB       THR  44  -0.025  -7.220 -13.900
  754    HG1  THR  44           1HG      THR  44  -0.552  -4.897 -12.376
  755   1HG2  THR  44          1HG2      THR  44  -1.308  -5.940 -15.237
  756   2HG2  THR  44          2HG2      THR  44  -1.995  -5.027 -13.895
  757   3HG2  THR  44          3HG2      THR  44  -2.602  -6.642 -14.265
  758    H    TYR  45           H        TYR  45  -0.590  -9.921 -12.465
  759    HA   TYR  45           HA       TYR  45   1.328  -9.757 -10.235
  760   1HB   TYR  45          2HB       TYR  45  -0.503 -11.319  -9.843
  761   2HB   TYR  45          1HB       TYR  45  -0.137 -12.157 -11.345
  762    HD1  TYR  45           1HD      TYR  45   2.068 -10.971  -8.570
  763    HD2  TYR  45           2HD      TYR  45   0.609 -14.278 -10.812
  764    HE1  TYR  45           1HE      TYR  45   3.601 -12.464  -7.356
  765    HE2  TYR  45           2HE      TYR  45   2.136 -15.779  -9.603
  766    HH   TYR  45           HH       TYR  45   3.343 -15.842  -7.462
  767    H    ASP  46           H        ASP  46   3.362 -10.662 -10.395
  768    HA   ASP  46           HA       ASP  46   4.242 -11.438 -13.094
  769   1HB   ASP  46          2HB       ASP  46   5.060  -9.180 -12.551
  770   2HB   ASP  46          1HB       ASP  46   5.785  -9.797 -11.069
  771    H    ASP  47           H        ASP  47   3.874 -13.622 -12.409
  772    HA   ASP  47           HA       ASP  47   4.789 -14.927 -10.198
  773   1HB   ASP  47          2HB       ASP  47   4.803 -15.980 -13.032
  774   2HB   ASP  47          1HB       ASP  47   4.886 -16.971 -11.580
  775    H    ALA  48           H        ALA  48   6.698 -13.992 -13.007
  776    HA   ALA  48           HA       ALA  48   8.976 -15.477 -12.673
  777   1HB   ALA  48          1HB       ALA  48   9.151 -14.233 -14.550
  778   2HB   ALA  48          2HB       ALA  48  10.085 -13.182 -13.485
  779   3HB   ALA  48          3HB       ALA  48   8.391 -12.820 -13.818
  780    H    THR  49           H        THR  49   8.029 -12.606 -10.871
  781    HA   THR  49           HA       THR  49  10.287 -13.116  -9.047
  782    HB   THR  49           HB       THR  49  10.495 -10.685  -8.681
  783    HG1  THR  49           1HG      THR  49   8.498 -10.589 -10.676
  784   1HG2  THR  49          1HG2      THR  49  10.994 -10.213 -11.313
  785   2HG2  THR  49          2HG2      THR  49  11.082 -11.972 -11.231
  786   3HG2  THR  49          3HG2      THR  49  12.108 -10.987 -10.187
  787    H    LYS  50           H        LYS  50   7.165 -13.500  -9.181
  788    HA   LYS  50           HA       LYS  50   5.414 -13.481  -7.711
  789   1HB   LYS  50          2HB       LYS  50   7.770 -13.483  -5.849
  790   2HB   LYS  50          1HB       LYS  50   6.139 -13.387  -5.217
  791   1HG   LYS  50          2HG       LYS  50   6.569 -15.641  -5.120
  792   2HG   LYS  50          1HG       LYS  50   5.713 -15.497  -6.648
  793   1HD   LYS  50          2HD       LYS  50   7.692 -16.968  -6.755
  794   2HD   LYS  50          1HD       LYS  50   7.781 -15.603  -7.871
  795   1HE   LYS  50          2HE       LYS  50   9.269 -14.432  -6.351
  796   2HE   LYS  50          1HE       LYS  50   9.112 -15.727  -5.166
  797   1HZ   LYS  50          1HZ       LYS  50  11.171 -15.794  -6.542
  798   2HZ   LYS  50          2HZ       LYS  50  10.207 -16.133  -7.890
  799   3HZ   LYS  50          3HZ       LYS  50  10.254 -17.215  -6.590
  800    H    THR  51           H        THR  51   6.427 -10.960  -8.798
  801    HA   THR  51           HA       THR  51   5.861  -9.070  -6.652
  802    HB   THR  51           HB       THR  51   6.846  -8.599  -9.468
  803    HG1  THR  51           1HG      THR  51   8.371  -9.629  -8.132
  804   1HG2  THR  51          1HG2      THR  51   5.617  -6.713  -8.045
  805   2HG2  THR  51          2HG2      THR  51   6.996  -6.384  -9.094
  806   3HG2  THR  51          3HG2      THR  51   7.235  -6.578  -7.357
  807    H    PHE  52           H        PHE  52   4.079  -7.854  -6.534
  808    HA   PHE  52           HA       PHE  52   2.075  -8.158  -8.672
  809   1HB   PHE  52          2HB       PHE  52   1.636  -7.534  -5.741
  810   2HB   PHE  52          1HB       PHE  52   0.374  -7.724  -6.955
  811    HD1  PHE  52           1HD      PHE  52  -0.592  -9.797  -7.300
  812    HD2  PHE  52           2HD      PHE  52   3.178  -9.557  -5.341
  813    HE1  PHE  52           1HE      PHE  52  -0.704 -12.204  -6.800
  814    HE2  PHE  52           2HE      PHE  52   3.075 -11.963  -4.842
  815    HZ   PHE  52           HZ       PHE  52   1.133 -13.291  -5.572
  816    H    THR  53           H        THR  53   1.470  -6.353  -9.735
  817    HA   THR  53           HA       THR  53   2.335  -3.789  -8.594
  818    HB   THR  53           HB       THR  53   2.045  -3.017 -11.063
  819    HG1  THR  53           1HG      THR  53   1.207  -5.242 -11.563
  820   1HG2  THR  53          1HG2      THR  53   4.310  -4.609  -9.959
  821   2HG2  THR  53          2HG2      THR  53   4.191  -2.871 -10.243
  822   3HG2  THR  53          3HG2      THR  53   4.361  -3.979 -11.606
  823    H    VAL  54           H        VAL  54   0.599  -3.295  -7.405
  824    HA   VAL  54           HA       VAL  54  -2.069  -3.290  -8.539
  825    HB   VAL  54           HB       VAL  54  -1.121  -2.171  -5.891
  826   1HG1  VAL  54          1HG1      VAL  54  -3.444  -2.213  -5.236
  827   2HG1  VAL  54          2HG1      VAL  54  -3.905  -2.901  -6.793
  828   3HG1  VAL  54          3HG1      VAL  54  -3.269  -1.258  -6.709
  829   1HG2  VAL  54          1HG2      VAL  54  -0.662  -4.544  -6.004
  830   2HG2  VAL  54          2HG2      VAL  54  -2.305  -4.864  -6.556
  831   3HG2  VAL  54          3HG2      VAL  54  -2.026  -4.252  -4.925
  832    H    THR  55           H        THR  55  -2.767  -1.684  -9.793
  833    HA   THR  55           HA       THR  55  -1.290   0.790  -9.890
  834    HB   THR  55           HB       THR  55  -3.754   0.108 -11.483
  835    HG1  THR  55           1HG      THR  55  -2.368  -1.526 -11.941
  836   1HG2  THR  55          1HG2      THR  55  -3.200   2.364 -11.824
  837   2HG2  THR  55          2HG2      THR  55  -2.511   1.495 -13.196
  838   3HG2  THR  55          3HG2      THR  55  -1.471   2.016 -11.868
  839    H    GLU  56           H        GLU  56  -2.350   2.848  -9.952
  840    HA   GLU  56           HA       GLU  56  -4.181   3.128  -7.692
  841   1HB   GLU  56          2HB       GLU  56  -2.248   4.591  -7.793
  842   2HB   GLU  56          1HB       GLU  56  -2.766   5.219  -9.350
  843   1HG   GLU  56          2HG       GLU  56  -4.748   6.173  -8.286
  844   2HG   GLU  56          1HG       GLU  56  -4.207   5.547  -6.728
  Start of MODEL   21
    1   1H    MET   1          1HT       MET   1   5.182 -18.341   2.462
    2   2H    MET   1          2HT       MET   1   6.608 -18.648   3.319
    3   3H    MET   1          3HT       MET   1   6.111 -19.709   2.100
    4    HA   MET   1           HA       MET   1   7.974 -18.054   1.584
    5   1HB   MET   1          2HB       MET   1   6.873 -19.501  -0.056
    6   2HB   MET   1          1HB       MET   1   5.537 -18.366  -0.182
    7   1HG   MET   1          2HG       MET   1   7.039 -18.157  -2.073
    8   2HG   MET   1          1HG       MET   1   7.037 -16.684  -1.105
    9   1HE   MET   1          1HE       MET   1  10.085 -17.536  -3.123
   10   2HE   MET   1          2HE       MET   1  10.373 -16.140  -2.084
   11   3HE   MET   1          3HE       MET   1   8.790 -16.377  -2.824
   12    H    GLN   2           H        GLN   2   8.396 -15.956   0.802
   13    HA   GLN   2           HA       GLN   2   6.431 -13.949   1.675
   14   1HB   GLN   2          2HB       GLN   2   8.585 -13.852   2.840
   15   2HB   GLN   2          1HB       GLN   2   9.424 -13.708   1.302
   16   1HG   GLN   2          2HG       GLN   2   8.313 -11.572   0.893
   17   2HG   GLN   2          1HG       GLN   2   7.475 -11.716   2.435
   18   1HE2  GLN   2          1HE2      GLN   2  10.465 -13.017   2.923
   19   2HE2  GLN   2          2HE2      GLN   2  11.292 -11.618   3.501
   20    H    TYR   3           H        TYR   3   5.848 -12.263   0.310
   21    HA   TYR   3           HA       TYR   3   6.870 -12.420  -2.447
   22   1HB   TYR   3          2HB       TYR   3   3.992 -12.039  -1.596
   23   2HB   TYR   3          1HB       TYR   3   4.579 -11.892  -3.249
   24    HD1  TYR   3           1HD      TYR   3   4.419 -13.740  -4.629
   25    HD2  TYR   3           2HD      TYR   3   4.618 -14.336  -0.420
   26    HE1  TYR   3           1HE      TYR   3   4.101 -16.155  -4.961
   27    HE2  TYR   3           2HE      TYR   3   4.302 -16.753  -0.740
   28    HH   TYR   3           HH       TYR   3   3.739 -18.130  -3.955
   29    H    LYS   4           H        LYS   4   7.022 -10.479  -3.576
   30    HA   LYS   4           HA       LYS   4   6.932  -8.102  -1.853
   31   1HB   LYS   4          2HB       LYS   4   9.118  -8.686  -2.858
   32   2HB   LYS   4          1HB       LYS   4   8.410  -8.519  -4.458
   33   1HG   LYS   4          2HG       LYS   4   7.967  -6.154  -4.014
   34   2HG   LYS   4          1HG       LYS   4   8.683  -6.327  -2.411
   35   1HD   LYS   4          2HD       LYS   4  10.817  -6.970  -3.450
   36   2HD   LYS   4          1HD       LYS   4  10.094  -6.756  -5.045
   37   1HE   LYS   4          2HE       LYS   4  11.394  -4.800  -4.458
   38   2HE   LYS   4          1HE       LYS   4   9.682  -4.389  -4.520
   39   1HZ   LYS   4          1HZ       LYS   4  10.149  -5.129  -1.916
   40   2HZ   LYS   4          2HZ       LYS   4   9.945  -3.555  -2.494
   41   3HZ   LYS   4          3HZ       LYS   4  11.500  -4.201  -2.338
   42    H    VAL   5           H        VAL   5   5.094  -7.011  -2.067
   43    HA   VAL   5           HA       VAL   5   3.749  -6.929  -4.660
   44    HB   VAL   5           HB       VAL   5   2.817  -5.867  -1.985
   45   1HG1  VAL   5          1HG1      VAL   5   1.587  -5.965  -4.703
   46   2HG1  VAL   5          2HG1      VAL   5   1.567  -4.671  -3.506
   47   3HG1  VAL   5          3HG1      VAL   5   0.559  -6.098  -3.276
   48   1HG2  VAL   5          1HG2      VAL   5   3.150  -8.400  -2.274
   49   2HG2  VAL   5          2HG2      VAL   5   1.762  -8.313  -3.358
   50   3HG2  VAL   5          3HG2      VAL   5   1.595  -7.827  -1.671
   51    H    ILE   6           H        ILE   6   3.722  -5.183  -5.927
   52    HA   ILE   6           HA       ILE   6   5.098  -2.779  -4.961
   53    HB   ILE   6           HB       ILE   6   4.676  -3.860  -7.742
   54   1HG1  ILE   6          2HG1      ILE   6   7.180  -3.182  -6.190
   55   2HG1  ILE   6          1HG1      ILE   6   6.524  -4.801  -6.395
   56   1HG2  ILE   6          1HG2      ILE   6   5.209  -1.102  -6.877
   57   2HG2  ILE   6          2HG2      ILE   6   4.538  -1.712  -8.392
   58   3HG2  ILE   6          3HG2      ILE   6   6.283  -1.721  -8.131
   59   1HD1  ILE   6          1HD1      ILE   6   7.741  -3.007  -8.463
   60   2HD1  ILE   6          2HD1      ILE   6   6.779  -4.423  -8.888
   61   3HD1  ILE   6          3HD1      ILE   6   8.263  -4.611  -7.953
   62    H    LEU   7           H        LEU   7   3.863  -1.153  -4.384
   63    HA   LEU   7           HA       LEU   7   1.167  -0.904  -5.473
   64   1HB   LEU   7          2HB       LEU   7   2.592   0.332  -3.121
   65   2HB   LEU   7          1HB       LEU   7   1.035   0.911  -3.663
   66    HG   LEU   7           HG       LEU   7   1.602  -1.895  -2.731
   67   1HD1  LEU   7          1HD1      LEU   7   1.340   0.399  -1.200
   68   2HD1  LEU   7          2HD1      LEU   7   1.122  -1.262  -0.649
   69   3HD1  LEU   7          3HD1      LEU   7  -0.271  -0.319  -1.178
   70   1HD2  LEU   7          1HD2      LEU   7  -0.464  -2.470  -3.378
   71   2HD2  LEU   7          2HD2      LEU   7  -0.379  -1.054  -4.424
   72   3HD2  LEU   7          3HD2      LEU   7  -1.157  -0.937  -2.848
   73    H    ASN   8           H        ASN   8   1.814  -0.248  -7.543
   74    HA   ASN   8           HA       ASN   8   3.251   2.265  -7.839
   75   1HB   ASN   8          2HB       ASN   8   3.852   0.318  -9.222
   76   2HB   ASN   8          1HB       ASN   8   2.230   0.306  -9.901
   77   1HD2  ASN   8          1HD2      ASN   8   5.169   0.914 -10.757
   78   2HD2  ASN   8          2HD2      ASN   8   4.971   2.286 -11.792
   79    H    GLY   9           H        GLY   9   2.034   4.064  -7.618
   80   1HA   GLY   9          2HA       GLY   9  -0.566   4.118  -9.024
   81   2HA   GLY   9          1HA       GLY   9  -0.231   5.026  -7.559
   82    H    LYS  10           H        LYS  10  -1.116   6.732  -9.073
   83    HA   LYS  10           HA       LYS  10   0.728   7.715 -11.071
   84   1HB   LYS  10          2HB       LYS  10  -1.802   8.956  -9.967
   85   2HB   LYS  10          1HB       LYS  10  -0.914   9.522 -11.373
   86   1HG   LYS  10          2HG       LYS  10  -1.406   7.444 -12.541
   87   2HG   LYS  10          1HG       LYS  10  -2.267   6.843 -11.122
   88   1HD   LYS  10          2HD       LYS  10  -3.007   9.290 -12.728
   89   2HD   LYS  10          1HD       LYS  10  -3.811   7.722 -12.814
   90   1HE   LYS  10          2HE       LYS  10  -4.416   7.920 -10.440
   91   2HE   LYS  10          1HE       LYS  10  -3.643   9.502 -10.383
   92   1HZ   LYS  10          1HZ       LYS  10  -6.073   8.717 -11.880
   93   2HZ   LYS  10          2HZ       LYS  10  -5.232  10.147 -12.211
   94   3HZ   LYS  10          3HZ       LYS  10  -5.919   9.905 -10.685
   95    H    THR  11           H        THR  11  -0.640   8.963  -8.041
   96    HA   THR  11           HA       THR  11   1.551  10.876  -7.816
   97    HB   THR  11           HB       THR  11   0.036  11.656  -5.863
   98    HG1  THR  11           1HG      THR  11  -2.212  11.076  -6.392
   99   1HG2  THR  11          1HG2      THR  11  -0.278  12.085  -8.731
  100   2HG2  THR  11          2HG2      THR  11  -0.207  13.248  -7.407
  101   3HG2  THR  11          3HG2      THR  11  -1.725  12.432  -7.785
  102    H    LEU  12           H        LEU  12   0.891   7.787  -6.871
  103    HA   LEU  12           HA       LEU  12   2.578   8.081  -4.496
  104   1HB   LEU  12          2HB       LEU  12   0.289   7.796  -3.750
  105   2HB   LEU  12          1HB       LEU  12   0.116   6.357  -4.738
  106    HG   LEU  12           HG       LEU  12   1.599   5.123  -3.336
  107   1HD1  LEU  12          1HD1      LEU  12   3.336   6.199  -2.463
  108   2HD1  LEU  12          2HD1      LEU  12   2.242   6.768  -1.200
  109   3HD1  LEU  12          3HD1      LEU  12   2.534   7.756  -2.625
  110   1HD2  LEU  12          1HD2      LEU  12   0.062   4.787  -1.766
  111   2HD2  LEU  12          2HD2      LEU  12  -0.811   6.152  -2.463
  112   3HD2  LEU  12          3HD2      LEU  12   0.279   6.405  -1.101
  113    H    LYS  13           H        LYS  13   4.223   6.735  -4.347
  114    HA   LYS  13           HA       LYS  13   4.335   4.367  -6.093
  115   1HB   LYS  13          2HB       LYS  13   6.612   6.299  -5.593
  116   2HB   LYS  13          1HB       LYS  13   6.670   4.865  -6.606
  117   1HG   LYS  13          2HG       LYS  13   4.800   7.147  -7.159
  118   2HG   LYS  13          1HG       LYS  13   6.450   7.095  -7.782
  119   1HD   LYS  13          2HD       LYS  13   4.372   4.960  -8.255
  120   2HD   LYS  13          1HD       LYS  13   4.749   6.260  -9.389
  121   1HE   LYS  13          2HE       LYS  13   7.099   5.464  -9.435
  122   2HE   LYS  13          1HE       LYS  13   6.624   4.107  -8.414
  123   1HZ   LYS  13          1HZ       LYS  13   6.158   4.551 -11.242
  124   2HZ   LYS  13          2HZ       LYS  13   4.851   3.903 -10.389
  125   3HZ   LYS  13          3HZ       LYS  13   6.340   3.102 -10.386
  126    H    GLY  14           H        GLY  14   4.913   2.541  -4.978
  127   1HA   GLY  14          2HA       GLY  14   6.768   2.668  -2.793
  128   2HA   GLY  14          1HA       GLY  14   5.119   2.439  -2.245
  129    H    GLU  15           H        GLU  15   6.720   0.568  -1.482
  130    HA   GLU  15           HA       GLU  15   5.960  -1.741  -3.107
  131   1HB   GLU  15          2HB       GLU  15   8.735  -1.401  -1.950
  132   2HB   GLU  15          1HB       GLU  15   8.145  -2.781  -2.865
  133   1HG   GLU  15          2HG       GLU  15   9.272  -1.712  -4.511
  134   2HG   GLU  15          1HG       GLU  15   7.706  -0.923  -4.691
  135    H    THR  16           H        THR  16   5.407  -3.514  -1.916
  136    HA   THR  16           HA       THR  16   5.839  -3.427   0.976
  137    HB   THR  16           HB       THR  16   3.689  -2.566   0.964
  138    HG1  THR  16           1HG      THR  16   3.168  -5.327   0.856
  139   1HG2  THR  16          1HG2      THR  16   3.366  -4.013  -1.567
  140   2HG2  THR  16          2HG2      THR  16   2.738  -2.445  -1.060
  141   3HG2  THR  16          3HG2      THR  16   1.931  -3.926  -0.547
  142    H    THR  17           H        THR  17   5.193  -5.566   2.025
  143    HA   THR  17           HA       THR  17   5.454  -7.843   0.206
  144    HB   THR  17           HB       THR  17   7.264  -8.821   1.583
  145    HG1  THR  17           1HG      THR  17   8.304  -7.542   3.084
  146   1HG2  THR  17          1HG2      THR  17   7.551  -6.958  -0.386
  147   2HG2  THR  17          2HG2      THR  17   8.853  -7.915   0.322
  148   3HG2  THR  17          3HG2      THR  17   8.530  -6.286   0.919
  149    H    THR  18           H        THR  18   3.976  -9.287   0.689
  150    HA   THR  18           HA       THR  18   2.986  -9.545   3.468
  151    HB   THR  18           HB       THR  18   1.258  -8.993   1.807
  152    HG1  THR  18           1HG      THR  18   0.877 -10.546   3.565
  153   1HG2  THR  18          1HG2      THR  18   2.282 -11.420   0.392
  154   2HG2  THR  18          2HG2      THR  18   1.959  -9.809  -0.250
  155   3HG2  THR  18          3HG2      THR  18   0.619 -10.865   0.195
  156    H    GLU  19           H        GLU  19   2.924 -11.593   4.421
  157    HA   GLU  19           HA       GLU  19   4.568 -13.633   3.074
  158   1HB   GLU  19          2HB       GLU  19   5.370 -12.747   5.269
  159   2HB   GLU  19          1HB       GLU  19   3.913 -13.383   6.017
  160   1HG   GLU  19          2HG       GLU  19   5.952 -15.058   4.573
  161   2HG   GLU  19          1HG       GLU  19   5.921 -14.804   6.316
  162    H    ALA  20           H        ALA  20   3.453 -15.285   2.195
  163    HA   ALA  20           HA       ALA  20   1.237 -16.433   3.687
  164   1HB   ALA  20          1HB       ALA  20  -0.424 -16.072   2.149
  165   2HB   ALA  20          2HB       ALA  20   0.709 -15.845   0.816
  166   3HB   ALA  20          3HB       ALA  20   0.491 -14.570   2.015
  167    H    VAL  21           H        VAL  21   0.631 -18.499   3.030
  168    HA   VAL  21           HA       VAL  21   2.630 -20.281   2.440
  169    HB   VAL  21           HB       VAL  21  -0.269 -20.732   1.738
  170   1HG1  VAL  21          1HG1      VAL  21   0.160 -23.036   1.996
  171   2HG1  VAL  21          2HG1      VAL  21   1.745 -22.741   2.709
  172   3HG1  VAL  21          3HG1      VAL  21   1.474 -22.411   0.999
  173   1HG2  VAL  21          1HG2      VAL  21  -0.204 -21.765   4.134
  174   2HG2  VAL  21          2HG2      VAL  21  -0.452 -20.031   3.922
  175   3HG2  VAL  21          3HG2      VAL  21   1.140 -20.646   4.367
  176    H    ASP  22           H        ASP  22   0.697 -18.473   0.171
  177    HA   ASP  22           HA       ASP  22   2.449 -19.300  -1.971
  178   1HB   ASP  22          2HB       ASP  22   0.740 -20.144  -3.465
  179   2HB   ASP  22          1HB       ASP  22   0.736 -21.084  -1.978
  180    H    ALA  23           H        ALA  23   1.760 -18.201  -4.099
  181    HA   ALA  23           HA       ALA  23   1.758 -15.452  -3.689
  182   1HB   ALA  23          1HB       ALA  23   0.705 -16.404  -6.277
  183   2HB   ALA  23          2HB       ALA  23   2.292 -17.011  -5.802
  184   3HB   ALA  23          3HB       ALA  23   2.012 -15.274  -5.928
  185    H    ALA  24           H        ALA  24  -0.926 -17.615  -4.470
  186    HA   ALA  24           HA       ALA  24  -2.856 -15.582  -4.824
  187   1HB   ALA  24          1HB       ALA  24  -4.108 -17.910  -3.759
  188   2HB   ALA  24          2HB       ALA  24  -2.812 -18.427  -4.838
  189   3HB   ALA  24          3HB       ALA  24  -4.075 -17.347  -5.430
  190    H    THR  25           H        THR  25  -2.157 -17.660  -1.991
  191    HA   THR  25           HA       THR  25  -3.914 -16.500  -0.203
  192    HB   THR  25           HB       THR  25  -2.346 -17.288   1.550
  193    HG1  THR  25           1HG      THR  25  -0.358 -17.766   1.133
  194   1HG2  THR  25          1HG2      THR  25  -2.048 -19.693   0.630
  195   2HG2  THR  25          2HG2      THR  25  -3.041 -19.100  -0.701
  196   3HG2  THR  25          3HG2      THR  25  -3.664 -19.063   0.949
  197    H    ALA  26           H        ALA  26  -0.595 -15.601  -1.039
  198    HA   ALA  26           HA       ALA  26  -0.353 -13.410   0.710
  199   1HB   ALA  26          1HB       ALA  26   0.970 -14.016  -1.930
  200   2HB   ALA  26          2HB       ALA  26   1.623 -14.263  -0.310
  201   3HB   ALA  26          3HB       ALA  26   1.396 -12.628  -0.930
  202    H    GLU  27           H        GLU  27  -1.287 -13.564  -2.739
  203    HA   GLU  27           HA       GLU  27  -1.835 -10.892  -3.149
  204   1HB   GLU  27          2HB       GLU  27  -1.790 -12.565  -4.943
  205   2HB   GLU  27          1HB       GLU  27  -3.271 -13.279  -4.320
  206   1HG   GLU  27          2HG       GLU  27  -3.156 -10.411  -5.173
  207   2HG   GLU  27          1HG       GLU  27  -3.425 -11.709  -6.333
  208    H    LYS  28           H        LYS  28  -3.971 -13.440  -1.921
  209    HA   LYS  28           HA       LYS  28  -6.282 -11.862  -1.653
  210   1HB   LYS  28          2HB       LYS  28  -5.405 -14.310  -0.110
  211   2HB   LYS  28          1HB       LYS  28  -7.017 -13.612  -0.035
  212   1HG   LYS  28          2HG       LYS  28  -5.702 -14.759  -2.488
  213   2HG   LYS  28          1HG       LYS  28  -6.964 -15.527  -1.523
  214   1HD   LYS  28          2HD       LYS  28  -8.491 -13.699  -2.063
  215   2HD   LYS  28          1HD       LYS  28  -7.228 -12.917  -3.014
  216   1HE   LYS  28          2HE       LYS  28  -7.173 -14.842  -4.524
  217   2HE   LYS  28          1HE       LYS  28  -8.424 -15.632  -3.566
  218   1HZ   LYS  28          1HZ       LYS  28  -9.990 -13.988  -4.184
  219   2HZ   LYS  28          2HZ       LYS  28  -9.224 -14.475  -5.611
  220   3HZ   LYS  28          3HZ       LYS  28  -8.806 -13.005  -4.887
  221    H    VAL  29           H        VAL  29  -3.640 -12.592   0.575
  222    HA   VAL  29           HA       VAL  29  -4.654 -11.313   2.843
  223    HB   VAL  29           HB       VAL  29  -1.763 -11.570   1.989
  224   1HG1  VAL  29          1HG1      VAL  29  -1.851 -11.635   4.739
  225   2HG1  VAL  29          2HG1      VAL  29  -3.022 -10.382   4.326
  226   3HG1  VAL  29          3HG1      VAL  29  -1.358 -10.259   3.749
  227   1HG2  VAL  29          1HG2      VAL  29  -2.693 -13.351   4.083
  228   2HG2  VAL  29          2HG2      VAL  29  -1.815 -13.715   2.598
  229   3HG2  VAL  29          3HG2      VAL  29  -3.572 -13.583   2.573
  230    H    VAL  30           H        VAL  30  -2.819 -10.070   0.105
  231    HA   VAL  30           HA       VAL  30  -2.407  -7.456   1.082
  232    HB   VAL  30           HB       VAL  30  -2.734  -8.370  -1.787
  233   1HG1  VAL  30          1HG1      VAL  30  -2.844  -5.829  -1.073
  234   2HG1  VAL  30          2HG1      VAL  30  -1.965  -6.346  -2.510
  235   3HG1  VAL  30          3HG1      VAL  30  -1.091  -6.018  -1.013
  236   1HG2  VAL  30          1HG2      VAL  30  -0.516  -8.925  -1.852
  237   2HG2  VAL  30          2HG2      VAL  30  -0.890  -9.353  -0.183
  238   3HG2  VAL  30          3HG2      VAL  30  -0.093  -7.821  -0.542
  239    H    LYS  31           H        LYS  31  -5.006  -8.909  -0.900
  240    HA   LYS  31           HA       LYS  31  -6.555  -6.705  -1.420
  241   1HB   LYS  31          2HB       LYS  31  -7.597  -9.416  -0.584
  242   2HB   LYS  31          1HB       LYS  31  -8.508  -8.188  -1.446
  243   1HG   LYS  31          2HG       LYS  31  -6.082  -9.631  -2.484
  244   2HG   LYS  31          1HG       LYS  31  -7.756  -9.954  -2.930
  245   1HD   LYS  31          2HD       LYS  31  -6.675  -7.200  -3.266
  246   2HD   LYS  31          1HD       LYS  31  -6.231  -8.441  -4.438
  247   1HE   LYS  31          2HE       LYS  31  -8.185  -7.212  -5.196
  248   2HE   LYS  31          1HE       LYS  31  -8.606  -8.888  -4.847
  249   1HZ   LYS  31          1HZ       LYS  31  -8.974  -6.810  -2.791
  250   2HZ   LYS  31          2HZ       LYS  31  -9.770  -8.294  -2.965
  251   3HZ   LYS  31          3HZ       LYS  31 -10.128  -7.015  -4.012
  252    H    GLN  32           H        GLN  32  -6.717  -8.782   1.442
  253    HA   GLN  32           HA       GLN  32  -8.669  -7.348   2.837
  254   1HB   GLN  32          2HB       GLN  32  -7.801  -9.627   3.431
  255   2HB   GLN  32          1HB       GLN  32  -6.343  -8.860   4.043
  256   1HG   GLN  32          2HG       GLN  32  -7.804  -9.372   5.869
  257   2HG   GLN  32          1HG       GLN  32  -7.700  -7.624   5.674
  258   1HE2  GLN  32          1HE2      GLN  32  -9.597  -8.971   3.231
  259   2HE2  GLN  32          2HE2      GLN  32 -11.143  -8.679   3.935
  260    H    PHE  33           H        PHE  33  -5.191  -6.954   2.626
  261    HA   PHE  33           HA       PHE  33  -4.715  -5.108   4.630
  262   1HB   PHE  33          2HB       PHE  33  -3.030  -6.240   3.103
  263   2HB   PHE  33          1HB       PHE  33  -3.445  -5.040   1.883
  264    HD1  PHE  33           1HD      PHE  33  -2.401  -5.229   5.446
  265    HD2  PHE  33           2HD      PHE  33  -2.125  -3.155   1.727
  266    HE1  PHE  33           1HE      PHE  33  -0.772  -3.668   6.426
  267    HE2  PHE  33           2HE      PHE  33  -0.494  -1.606   2.714
  268    HZ   PHE  33           HZ       PHE  33   0.184  -1.866   5.069
  269    H    PHE  34           H        PHE  34  -5.151  -4.308   1.221
  270    HA   PHE  34           HA       PHE  34  -5.665  -1.552   1.665
  271   1HB   PHE  34          2HB       PHE  34  -6.311  -3.243  -0.754
  272   2HB   PHE  34          1HB       PHE  34  -6.251  -1.479  -0.709
  273    HD1  PHE  34           1HD      PHE  34  -3.940  -0.797   0.739
  274    HD2  PHE  34           2HD      PHE  34  -4.497  -4.064  -1.921
  275    HE1  PHE  34           1HE      PHE  34  -1.517  -0.876   0.335
  276    HE2  PHE  34           2HE      PHE  34  -2.076  -4.142  -2.340
  277    HZ   PHE  34           HZ       PHE  34  -0.590  -2.549  -1.200
  278    H    ASN  35           H        ASN  35  -7.736  -4.352   1.256
  279    HA   ASN  35           HA       ASN  35 -10.227  -3.202   0.963
  280   1HB   ASN  35          2HB       ASN  35  -9.786  -5.633   0.938
  281   2HB   ASN  35          1HB       ASN  35  -9.480  -5.590   2.670
  282   1HD2  ASN  35          1HD2      ASN  35 -11.559  -6.748   0.703
  283   2HD2  ASN  35          2HD2      ASN  35 -13.056  -6.454   1.512
  284    H    ASP  36           H        ASP  36  -8.303  -3.674   3.840
  285    HA   ASP  36           HA       ASP  36 -10.305  -2.367   5.519
  286   1HB   ASP  36          2HB       ASP  36  -7.714  -3.735   6.254
  287   2HB   ASP  36          1HB       ASP  36  -8.838  -3.026   7.410
  288    H    ASN  37           H        ASN  37  -7.282  -1.630   3.983
  289    HA   ASN  37           HA       ASN  37  -6.662   0.579   5.737
  290   1HB   ASN  37          2HB       ASN  37  -5.556  -0.172   3.019
  291   2HB   ASN  37          1HB       ASN  37  -4.962   1.165   3.996
  292   1HD2  ASN  37          1HD2      ASN  37  -3.850  -1.509   3.015
  293   2HD2  ASN  37          2HD2      ASN  37  -3.142  -2.184   4.440
  294    H    GLY  38           H        GLY  38  -7.948   0.121   2.513
  295   1HA   GLY  38          2HA       GLY  38  -8.431   2.073   1.079
  296   2HA   GLY  38          1HA       GLY  38  -9.877   1.408   1.804
  297    H    VAL  39           H        VAL  39 -11.205   2.848   2.557
  298    HA   VAL  39           HA       VAL  39 -10.203   5.533   3.184
  299    HB   VAL  39           HB       VAL  39 -13.031   4.645   2.679
  300   1HG1  VAL  39          1HG1      VAL  39 -11.851   7.160   3.477
  301   2HG1  VAL  39          2HG1      VAL  39 -13.547   6.691   3.386
  302   3HG1  VAL  39          3HG1      VAL  39 -12.726   7.311   1.954
  303   1HG2  VAL  39          1HG2      VAL  39 -11.050   5.859   0.758
  304   2HG2  VAL  39          2HG2      VAL  39 -12.742   5.498   0.414
  305   3HG2  VAL  39          3HG2      VAL  39 -11.611   4.186   0.746
  306    H    ASP  40           H        ASP  40 -11.076   2.857   5.070
  307    HA   ASP  40           HA       ASP  40 -12.008   4.685   7.176
  308   1HB   ASP  40          2HB       ASP  40 -12.915   1.843   6.690
  309   2HB   ASP  40          1HB       ASP  40 -13.378   2.833   8.071
  310    H    GLY  41           H        GLY  41  -9.316   3.341   6.386
  311   1HA   GLY  41          2HA       GLY  41  -8.740   1.593   8.587
  312   2HA   GLY  41          1HA       GLY  41  -7.579   2.248   7.447
  313    H    GLU  42           H        GLU  42  -6.934   1.982  10.092
  314    HA   GLU  42           HA       GLU  42  -7.234   4.603  11.347
  315   1HB   GLU  42          2HB       GLU  42  -5.859   2.092  12.330
  316   2HB   GLU  42          1HB       GLU  42  -6.069   3.566  13.265
  317   1HG   GLU  42          2HG       GLU  42  -8.494   3.292  13.151
  318   2HG   GLU  42          1HG       GLU  42  -8.280   1.810  12.221
  319    H    TRP  43           H        TRP  43  -5.950   6.046  10.307
  320    HA   TRP  43           HA       TRP  43  -3.180   5.303   9.725
  321   1HB   TRP  43          2HB       TRP  43  -4.797   7.695   8.844
  322   2HB   TRP  43          1HB       TRP  43  -3.151   7.338   8.340
  323    HD1  TRP  43           HD       TRP  43  -5.765   4.530   8.467
  324    HE1  TRP  43           1HE      TRP  43  -6.242   3.761   6.059
  325    HE3  TRP  43           3HE      TRP  43  -3.146   8.115   5.945
  326    HZ2  TRP  43           2HZ      TRP  43  -5.592   4.571   3.437
  327    HZ3  TRP  43           3HZ      TRP  43  -3.123   8.050   3.492
  328    HH2  TRP  43           HH       TRP  43  -4.320   6.313   2.259
  329    H    THR  44           H        THR  44  -1.579   5.946  10.995
  330    HA   THR  44           HA       THR  44  -1.989   8.298  12.720
  331    HB   THR  44           HB       THR  44  -0.228   7.321  14.176
  332    HG1  THR  44           1HG      THR  44  -0.433   5.098  12.430
  333   1HG2  THR  44          1HG2      THR  44  -1.642   6.041  15.347
  334   2HG2  THR  44          2HG2      THR  44  -2.048   5.030  13.961
  335   3HG2  THR  44          3HG2      THR  44  -2.821   6.602  14.164
  336    H    TYR  45           H        TYR  45  -0.458   9.939  12.676
  337    HA   TYR  45           HA       TYR  45   1.573   9.681  10.558
  338   1HB   TYR  45          2HB       TYR  45  -0.205  11.365  10.155
  339   2HB   TYR  45          1HB       TYR  45   0.291  12.206  11.617
  340    HD1  TYR  45           1HD      TYR  45   2.647  10.666   9.227
  341    HD2  TYR  45           2HD      TYR  45   0.859  14.281  10.581
  342    HE1  TYR  45           1HE      TYR  45   4.276  11.955   7.913
  343    HE2  TYR  45           2HE      TYR  45   2.483  15.581   9.268
  344    HH   TYR  45           HH       TYR  45   4.668  15.338   8.279
  345    H    ASP  46           H        ASP  46   3.667  10.307  10.907
  346    HA   ASP  46           HA       ASP  46   4.375  11.074  13.661
  347   1HB   ASP  46          2HB       ASP  46   4.979   8.730  13.237
  348   2HB   ASP  46          1HB       ASP  46   5.903   9.218  11.820
  349    H    ASP  47           H        ASP  47   4.358  13.274  12.954
  350    HA   ASP  47           HA       ASP  47   5.608  14.439  10.831
  351   1HB   ASP  47          2HB       ASP  47   5.556  15.475  13.673
  352   2HB   ASP  47          1HB       ASP  47   5.902  16.449  12.247
  353    H    ALA  48           H        ALA  48   7.123  13.204  13.744
  354    HA   ALA  48           HA       ALA  48   9.609  14.339  13.655
  355   1HB   ALA  48          1HB       ALA  48  10.205  12.802  15.192
  356   2HB   ALA  48          2HB       ALA  48   9.608  11.449  14.230
  357   3HB   ALA  48          3HB       ALA  48   8.481  12.430  15.168
  358    H    THR  49           H        THR  49   8.370  11.812  11.553
  359    HA   THR  49           HA       THR  49  10.913  11.933  10.073
  360    HB   THR  49           HB       THR  49  10.621   9.550   9.490
  361    HG1  THR  49           1HG      THR  49   9.054   8.349  10.518
  362   1HG2  THR  49          1HG2      THR  49  10.460   9.565  12.453
  363   2HG2  THR  49          2HG2      THR  49  11.799  10.401  11.669
  364   3HG2  THR  49          3HG2      THR  49  11.543   8.680  11.381
  365    H    LYS  50           H        LYS  50   8.052  13.130   9.802
  366    HA   LYS  50           HA       LYS  50   6.537  13.563   8.123
  367   1HB   LYS  50          2HB       LYS  50   9.015  13.084   6.452
  368   2HB   LYS  50          1HB       LYS  50   7.560  13.891   5.892
  369   1HG   LYS  50          2HG       LYS  50   9.271  14.871   8.165
  370   2HG   LYS  50          1HG       LYS  50   9.409  15.426   6.497
  371   1HD   LYS  50          2HD       LYS  50   6.934  15.638   8.210
  372   2HD   LYS  50          1HD       LYS  50   8.065  16.952   7.877
  373   1HE   LYS  50          2HE       LYS  50   7.575  16.732   5.476
  374   2HE   LYS  50          1HE       LYS  50   6.404  15.467   5.844
  375   1HZ   LYS  50          1HZ       LYS  50   5.022  16.994   6.950
  376   2HZ   LYS  50          2HZ       LYS  50   5.484  17.769   5.519
  377   3HZ   LYS  50          3HZ       LYS  50   6.215  18.196   6.984
  378    H    THR  51           H        THR  51   6.553  10.867   9.006
  379    HA   THR  51           HA       THR  51   5.810   9.485   6.518
  380    HB   THR  51           HB       THR  51   7.207   8.347   8.941
  381    HG1  THR  51           1HG      THR  51   8.827   7.894   7.386
  382   1HG2  THR  51          1HG2      THR  51   6.571   6.308   8.406
  383   2HG2  THR  51          2HG2      THR  51   7.161   6.530   6.760
  384   3HG2  THR  51          3HG2      THR  51   5.504   6.974   7.170
  385    H    PHE  52           H        PHE  52   3.976   8.283   6.508
  386    HA   PHE  52           HA       PHE  52   2.252   8.479   8.887
  387   1HB   PHE  52          2HB       PHE  52   1.500   8.013   5.988
  388   2HB   PHE  52          1HB       PHE  52   0.367   8.131   7.330
  389    HD1  PHE  52           1HD      PHE  52  -0.185  10.256   8.306
  390    HD2  PHE  52           2HD      PHE  52   2.635   9.981   5.132
  391    HE1  PHE  52           1HE      PHE  52  -0.347  12.686   7.958
  392    HE2  PHE  52           2HE      PHE  52   2.479  12.412   4.777
  393    HZ   PHE  52           HZ       PHE  52   0.987  13.766   6.192
  394    H    THR  53           H        THR  53   1.241   6.603   9.680
  395    HA   THR  53           HA       THR  53   2.177   4.091   8.465
  396    HB   THR  53           HB       THR  53   1.905   3.197  10.892
  397    HG1  THR  53           1HG      THR  53   2.254   5.970  11.346
  398   1HG2  THR  53          1HG2      THR  53   4.154   4.614   9.662
  399   2HG2  THR  53          2HG2      THR  53   4.074   3.012  10.403
  400   3HG2  THR  53          3HG2      THR  53   4.235   4.448  11.417
  401    H    VAL  54           H        VAL  54   0.698   2.757   7.804
  402    HA   VAL  54           HA       VAL  54  -2.073   3.093   8.740
  403    HB   VAL  54           HB       VAL  54  -1.064   1.735   6.223
  404   1HG1  VAL  54          1HG1      VAL  54  -3.114   0.713   7.080
  405   2HG1  VAL  54          2HG1      VAL  54  -3.417   1.597   5.585
  406   3HG1  VAL  54          3HG1      VAL  54  -3.886   2.298   7.135
  407   1HG2  VAL  54          1HG2      VAL  54  -2.599   3.772   5.363
  408   2HG2  VAL  54          2HG2      VAL  54  -0.853   3.888   5.578
  409   3HG2  VAL  54          3HG2      VAL  54  -1.938   4.485   6.834
  410    H    THR  55           H        THR  55  -2.533   1.715  10.339
  411    HA   THR  55           HA       THR  55  -1.217  -0.902  10.341
  412    HB   THR  55           HB       THR  55  -2.765   0.344  12.605
  413    HG1  THR  55           1HG      THR  55   0.039   0.369  12.194
  414   1HG2  THR  55          1HG2      THR  55  -1.279  -1.129  13.968
  415   2HG2  THR  55          2HG2      THR  55  -0.778  -1.906  12.463
  416   3HG2  THR  55          3HG2      THR  55  -2.465  -1.982  12.978
  417    H    GLU  56           H        GLU  56  -2.281  -2.543   9.527
  418    HA   GLU  56           HA       GLU  56  -4.938  -2.619   8.783
  419   1HB   GLU  56          2HB       GLU  56  -3.339  -4.224   7.943
  420   2HB   GLU  56          1HB       GLU  56  -3.089  -4.882   9.552
  421   1HG   GLU  56          2HG       GLU  56  -4.475  -6.343   8.188
  422   2HG   GLU  56          1HG       GLU  56  -5.363  -5.731   9.584
  423   1H    MET   1          1HT       MET   1   5.660  18.263  -2.296
  424   2H    MET   1          2HT       MET   1   7.105  18.533  -3.133
  425   3H    MET   1          3HT       MET   1   6.617  19.607  -1.921
  426    HA   MET   1           HA       MET   1   8.433  17.906  -1.380
  427   1HB   MET   1          2HB       MET   1   7.343  19.381   0.246
  428   2HB   MET   1          1HB       MET   1   5.979  18.279   0.353
  429   1HG   MET   1          2HG       MET   1   7.448  18.033   2.265
  430   2HG   MET   1          1HG       MET   1   7.424  16.561   1.296
  431   1HE   MET   1          1HE       MET   1  10.463  17.339   3.359
  432   2HE   MET   1          2HE       MET   1  10.732  15.936   2.322
  433   3HE   MET   1          3HE       MET   1   9.144  16.212   3.040
  434    H    GLN   2           H        GLN   2   8.790  15.799  -0.592
  435    HA   GLN   2           HA       GLN   2   6.791  13.841  -1.492
  436   1HB   GLN   2          2HB       GLN   2   8.957  13.691  -2.626
  437   2HB   GLN   2          1HB       GLN   2   9.771  13.528  -1.077
  438   1HG   GLN   2          2HG       GLN   2   8.604  11.420  -0.685
  439   2HG   GLN   2          1HG       GLN   2   7.792  11.581  -2.238
  440   1HE2  GLN   2          1HE2      GLN   2  10.818  12.811  -2.683
  441   2HE2  GLN   2          2HE2      GLN   2  11.619  11.392  -3.250
  442    H    TYR   3           H        TYR   3   6.149  12.170  -0.137
  443    HA   TYR   3           HA       TYR   3   7.134  12.303   2.635
  444   1HB   TYR   3          2HB       TYR   3   4.261  11.991   1.743
  445   2HB   TYR   3          1HB       TYR   3   4.821  11.830   3.405
  446    HD1  TYR   3           1HD      TYR   3   4.685  13.681   4.783
  447    HD2  TYR   3           2HD      TYR   3   4.957  14.271   0.577
  448    HE1  TYR   3           1HE      TYR   3   4.423  16.104   5.109
  449    HE2  TYR   3           2HE      TYR   3   4.697  16.695   0.893
  450    HH   TYR   3           HH       TYR   3   4.122  18.087   4.100
  451    H    LYS   4           H        LYS   4   7.223  10.358   3.766
  452    HA   LYS   4           HA       LYS   4   7.100   7.983   2.041
  453   1HB   LYS   4          2HB       LYS   4   9.286   8.515   3.077
  454   2HB   LYS   4          1HB       LYS   4   8.551   8.365   4.668
  455   1HG   LYS   4          2HG       LYS   4   8.056   6.012   4.217
  456   2HG   LYS   4          1HG       LYS   4   8.800   6.167   2.624
  457   1HD   LYS   4          2HD       LYS   4  10.934   6.758   3.693
  458   2HD   LYS   4          1HD       LYS   4  10.184   6.562   5.278
  459   1HE   LYS   4          2HE       LYS   4  11.444   4.575   4.708
  460   2HE   LYS   4          1HE       LYS   4   9.721   4.206   4.746
  461   1HZ   LYS   4          1HZ       LYS   4  10.243   4.935   2.150
  462   2HZ   LYS   4          2HZ       LYS   4   9.991   3.364   2.724
  463   3HZ   LYS   4          3HZ       LYS   4  11.564   3.973   2.591
  464    H    VAL   5           H        VAL   5   5.234   6.939   2.230
  465    HA   VAL   5           HA       VAL   5   3.849   6.889   4.802
  466    HB   VAL   5           HB       VAL   5   2.930   5.849   2.116
  467   1HG1  VAL   5          1HG1      VAL   5   1.666   5.979   4.815
  468   2HG1  VAL   5          2HG1      VAL   5   1.631   4.685   3.619
  469   3HG1  VAL   5          3HG1      VAL   5   0.660   6.136   3.375
  470   1HG2  VAL   5          1HG2      VAL   5   3.321   8.374   2.409
  471   2HG2  VAL   5          2HG2      VAL   5   1.915   8.321   3.472
  472   3HG2  VAL   5          3HG2      VAL   5   1.761   7.838   1.784
  473    H    ILE   6           H        ILE   6   3.764   5.144   6.069
  474    HA   ILE   6           HA       ILE   6   5.093   2.707   5.123
  475    HB   ILE   6           HB       ILE   6   4.658   3.800   7.898
  476   1HG1  ILE   6          2HG1      ILE   6   7.167   3.061   6.380
  477   2HG1  ILE   6          1HG1      ILE   6   6.548   4.694   6.577
  478   1HG2  ILE   6          1HG2      ILE   6   5.136   1.028   7.040
  479   2HG2  ILE   6          2HG2      ILE   6   4.460   1.655   8.543
  480   3HG2  ILE   6          3HG2      ILE   6   6.208   1.622   8.310
  481   1HD1  ILE   6          1HD1      ILE   6   7.691   2.872   8.662
  482   2HD1  ILE   6          2HD1      ILE   6   6.758   4.311   9.073
  483   3HD1  ILE   6          3HD1      ILE   6   8.259   4.464   8.158
  484    H    LEU   7           H        LEU   7   3.826   1.113   4.528
  485    HA   LEU   7           HA       LEU   7   1.111   0.929   5.579
  486   1HB   LEU   7          2HB       LEU   7   2.538  -0.342   3.247
  487   2HB   LEU   7          1HB       LEU   7   0.960  -0.883   3.767
  488    HG   LEU   7           HG       LEU   7   1.609   1.910   2.843
  489   1HD1  LEU   7          1HD1      LEU   7   1.314  -0.378   1.307
  490   2HD1  LEU   7          2HD1      LEU   7   1.144   1.288   0.755
  491   3HD1  LEU   7          3HD1      LEU   7  -0.279   0.379   1.263
  492   1HD2  LEU   7          1HD2      LEU   7  -0.451   2.533   3.461
  493   2HD2  LEU   7          2HD2      LEU   7  -0.414   1.116   4.507
  494   3HD2  LEU   7          3HD2      LEU   7  -1.174   1.017   2.921
  495    H    ASN   8           H        ASN   8   1.712   0.257   7.656
  496    HA   ASN   8           HA       ASN   8   3.084  -2.290   7.973
  497   1HB   ASN   8          2HB       ASN   8   3.711  -0.358   9.364
  498   2HB   ASN   8          1HB       ASN   8   2.082  -0.305  10.022
  499   1HD2  ASN   8          1HD2      ASN   8   4.992  -0.984  10.919
  500   2HD2  ASN   8          2HD2      ASN   8   4.747  -2.352  11.949
  501    H    GLY   9           H        GLY   9   1.827  -4.059   7.735
  502   1HA   GLY   9          2HA       GLY   9  -0.794  -4.049   9.105
  503   2HA   GLY   9          1HA       GLY   9  -0.460  -4.965   7.643
  504    H    LYS  10           H        LYS  10  -1.408  -6.650   9.145
  505    HA   LYS  10           HA       LYS  10   0.384  -7.675  11.169
  506   1HB   LYS  10          2HB       LYS  10  -2.160  -8.855  10.028
  507   2HB   LYS  10          1HB       LYS  10  -1.305  -9.442  11.447
  508   1HG   LYS  10          2HG       LYS  10  -1.765  -7.352  12.606
  509   2HG   LYS  10          1HG       LYS  10  -2.590  -6.732  11.177
  510   1HD   LYS  10          2HD       LYS  10  -3.411  -9.160  12.771
  511   2HD   LYS  10          1HD       LYS  10  -4.178  -7.572  12.847
  512   1HE   LYS  10          2HE       LYS  10  -4.755  -7.755  10.464
  513   2HE   LYS  10          1HE       LYS  10  -4.018  -9.356  10.419
  514   1HZ   LYS  10          1HZ       LYS  10  -6.449  -8.512  11.881
  515   2HZ   LYS  10          2HZ       LYS  10  -5.649  -9.963  12.223
  516   3HZ   LYS  10          3HZ       LYS  10  -6.309  -9.703  10.687
  517    H    THR  11           H        THR  11  -0.971  -8.892   8.119
  518    HA   THR  11           HA       THR  11   1.175 -10.857   7.925
  519    HB   THR  11           HB       THR  11  -0.330 -11.599   5.950
  520    HG1  THR  11           1HG      THR  11  -2.569 -10.965   6.447
  521   1HG2  THR  11          1HG2      THR  11  -0.695 -12.021   8.814
  522   2HG2  THR  11          2HG2      THR  11  -0.635 -13.185   7.490
  523   3HG2  THR  11          3HG2      THR  11  -2.138 -12.334   7.847
  524    H    LEU  12           H        LEU  12   0.604  -7.754   6.970
  525    HA   LEU  12           HA       LEU  12   2.318  -8.088   4.620
  526   1HB   LEU  12          2HB       LEU  12   0.047  -7.747   3.841
  527   2HB   LEU  12          1HB       LEU  12  -0.105  -6.304   4.828
  528    HG   LEU  12           HG       LEU  12   1.428  -5.107   3.447
  529   1HD1  LEU  12          1HD1      LEU  12   3.148  -6.225   2.599
  530   2HD1  LEU  12          2HD1      LEU  12   2.059  -6.768   1.319
  531   3HD1  LEU  12          3HD1      LEU  12   2.307  -7.762   2.750
  532   1HD2  LEU  12          1HD2      LEU  12  -0.079  -4.734   1.855
  533   2HD2  LEU  12          2HD2      LEU  12  -0.996  -6.077   2.539
  534   3HD2  LEU  12          3HD2      LEU  12   0.108  -6.357   1.193
  535    H    LYS  13           H        LYS  13   3.997  -6.781   4.494
  536    HA   LYS  13           HA       LYS  13   4.141  -4.416   6.243
  537   1HB   LYS  13          2HB       LYS  13   6.377  -6.404   5.775
  538   2HB   LYS  13          1HB       LYS  13   6.456  -4.972   6.789
  539   1HG   LYS  13          2HG       LYS  13   4.523  -7.208   7.315
  540   2HG   LYS  13          1HG       LYS  13   6.165  -7.195   7.960
  541   1HD   LYS  13          2HD       LYS  13   4.134  -5.011   8.404
  542   2HD   LYS  13          1HD       LYS  13   4.462  -6.319   9.543
  543   1HE   LYS  13          2HE       LYS  13   6.831  -5.581   9.624
  544   2HE   LYS  13          1HE       LYS  13   6.403  -4.213   8.597
  545   1HZ   LYS  13          1HZ       LYS  13   5.887  -4.645  11.417
  546   2HZ   LYS  13          2HZ       LYS  13   4.606  -3.965  10.546
  547   3HZ   LYS  13          3HZ       LYS  13   6.114  -3.200  10.563
  548    H    GLY  14           H        GLY  14   4.780  -2.607   5.135
  549   1HA   GLY  14          2HA       GLY  14   6.662  -2.779   2.978
  550   2HA   GLY  14          1HA       GLY  14   5.027  -2.508   2.406
  551    H    GLU  15           H        GLU  15   6.683  -0.677   1.667
  552    HA   GLU  15           HA       GLU  15   5.956   1.648   3.281
  553   1HB   GLU  15          2HB       GLU  15   8.738   1.241   2.162
  554   2HB   GLU  15          1HB       GLU  15   8.169   2.635   3.069
  555   1HG   GLU  15          2HG       GLU  15   9.245   1.539   4.731
  556   2HG   GLU  15          1HG       GLU  15   7.660   0.788   4.889
  557    H    THR  16           H        THR  16   5.463   3.435   2.082
  558    HA   THR  16           HA       THR  16   5.934   3.336  -0.803
  559    HB   THR  16           HB       THR  16   3.765   2.528  -0.822
  560    HG1  THR  16           1HG      THR  16   3.309   5.301  -0.722
  561   1HG2  THR  16          1HG2      THR  16   3.440   3.983   1.704
  562   2HG2  THR  16          2HG2      THR  16   2.782   2.430   1.189
  563   3HG2  THR  16          3HG2      THR  16   2.018   3.930   0.663
  564    H    THR  17           H        THR  17   5.355   5.491  -1.861
  565    HA   THR  17           HA       THR  17   5.645   7.760  -0.038
  566    HB   THR  17           HB       THR  17   7.498   8.695  -1.390
  567    HG1  THR  17           1HG      THR  17   8.528   7.389  -2.877
  568   1HG2  THR  17          1HG2      THR  17   7.713   6.826   0.582
  569   2HG2  THR  17          2HG2      THR  17   9.046   7.750  -0.106
  570   3HG2  THR  17          3HG2      THR  17   8.693   6.130  -0.709
  571    H    THR  18           H        THR  18   4.210   9.241  -0.543
  572    HA   THR  18           HA       THR  18   3.267   9.523  -3.335
  573    HB   THR  18           HB       THR  18   1.501   9.012  -1.699
  574    HG1  THR  18           1HG      THR  18   1.184  10.575  -3.461
  575   1HG2  THR  18          1HG2      THR  18   2.564  11.414  -0.269
  576   2HG2  THR  18          2HG2      THR  18   2.194   9.812   0.370
  577   3HG2  THR  18          3HG2      THR  18   0.886  10.900  -0.095
  578    H    GLU  19           H        GLU  19   3.268  11.570  -4.288
  579    HA   GLU  19           HA       GLU  19   4.941  13.570  -2.917
  580   1HB   GLU  19          2HB       GLU  19   5.753  12.664  -5.102
  581   2HB   GLU  19          1HB       GLU  19   4.322  13.335  -5.870
  582   1HG   GLU  19          2HG       GLU  19   6.381  14.961  -4.397
  583   2HG   GLU  19          1HG       GLU  19   6.369  14.708  -6.141
  584    H    ALA  20           H        ALA  20   3.855  15.249  -2.053
  585    HA   ALA  20           HA       ALA  20   1.687  16.450  -3.577
  586   1HB   ALA  20          1HB       ALA  20  -0.003  16.130  -2.063
  587   2HB   ALA  20          2HB       ALA  20   1.105  15.874  -0.714
  588   3HB   ALA  20          3HB       ALA  20   0.873  14.606  -1.916
  589    H    VAL  21           H        VAL  21   1.124  18.531  -2.928
  590    HA   VAL  21           HA       VAL  21   3.156  20.263  -2.310
  591    HB   VAL  21           HB       VAL  21   0.259  20.785  -1.649
  592   1HG1  VAL  21          1HG1      VAL  21   0.747  23.078  -1.900
  593   2HG1  VAL  21          2HG1      VAL  21   2.334  22.743  -2.593
  594   3HG1  VAL  21          3HG1      VAL  21   2.030  22.421  -0.885
  595   1HG2  VAL  21          1HG2      VAL  21   0.383  21.814  -4.043
  596   2HG2  VAL  21          2HG2      VAL  21   0.089  20.087  -3.835
  597   3HG2  VAL  21          3HG2      VAL  21   1.703  20.664  -4.258
  598    H    ASP  22           H        ASP  22   1.147  18.503  -0.069
  599    HA   ASP  22           HA       ASP  22   2.890  19.286   2.097
  600   1HB   ASP  22          2HB       ASP  22   1.182  20.173   3.568
  601   2HB   ASP  22          1HB       ASP  22   1.219  21.113   2.082
  602    H    ALA  23           H        ALA  23   2.144  18.206   4.216
  603    HA   ALA  23           HA       ALA  23   2.081  15.459   3.806
  604   1HB   ALA  23          1HB       ALA  23   1.015  16.437   6.378
  605   2HB   ALA  23          2HB       ALA  23   2.623  17.003   5.926
  606   3HB   ALA  23          3HB       ALA  23   2.299  15.273   6.049
  607    H    ALA  24           H        ALA  24  -0.560  17.687   4.548
  608    HA   ALA  24           HA       ALA  24  -2.544  15.701   4.874
  609   1HB   ALA  24          1HB       ALA  24  -3.725  18.059   3.793
  610   2HB   ALA  24          2HB       ALA  24  -2.431  18.543   4.890
  611   3HB   ALA  24          3HB       ALA  24  -3.728  17.494   5.465
  612    H    THR  25           H        THR  25  -1.755  17.759   2.053
  613    HA   THR  25           HA       THR  25  -3.513  16.643   0.239
  614    HB   THR  25           HB       THR  25  -1.902  17.392  -1.491
  615    HG1  THR  25           1HG      THR  25   0.090  17.820  -1.046
  616   1HG2  THR  25          1HG2      THR  25  -1.559  19.790  -0.566
  617   2HG2  THR  25          2HG2      THR  25  -2.586  19.221   0.750
  618   3HG2  THR  25          3HG2      THR  25  -3.185  19.197  -0.910
  619    H    ALA  26           H        ALA  26  -0.230  15.663   1.121
  620    HA   ALA  26           HA       ALA  26  -0.017  13.467  -0.623
  621   1HB   ALA  26          1HB       ALA  26   1.282  14.041   2.035
  622   2HB   ALA  26          2HB       ALA  26   1.965  14.272   0.425
  623   3HB   ALA  26          3HB       ALA  26   1.689  12.643   1.041
  624    H    GLU  27           H        GLU  27  -0.996  13.644   2.812
  625    HA   GLU  27           HA       GLU  27  -1.614  10.986   3.214
  626   1HB   GLU  27          2HB       GLU  27  -1.554  12.658   5.008
  627   2HB   GLU  27          1HB       GLU  27  -3.007  13.407   4.365
  628   1HG   GLU  27          2HG       GLU  27  -2.975  10.538   5.220
  629   2HG   GLU  27          1HG       GLU  27  -3.228  11.843   6.375
  630    H    LYS  28           H        LYS  28  -3.671  13.586   1.956
  631    HA   LYS  28           HA       LYS  28  -6.015  12.063   1.656
  632   1HB   LYS  28          2HB       LYS  28  -5.056  14.491   0.125
  633   2HB   LYS  28          1HB       LYS  28  -6.684  13.831   0.027
  634   1HG   LYS  28          2HG       LYS  28  -5.376  14.946   2.499
  635   2HG   LYS  28          1HG       LYS  28  -6.605  15.744   1.516
  636   1HD   LYS  28          2HD       LYS  28  -8.185  13.954   2.034
  637   2HD   LYS  28          1HD       LYS  28  -6.954  13.142   3.003
  638   1HE   LYS  28          2HE       LYS  28  -6.873  15.065   4.513
  639   2HE   LYS  28          1HE       LYS  28  -8.092  15.886   3.538
  640   1HZ   LYS  28          1HZ       LYS  28  -9.706  14.280   4.134
  641   2HZ   LYS  28          2HZ       LYS  28  -8.946  14.749   5.571
  642   3HZ   LYS  28          3HZ       LYS  28  -8.556  13.269   4.854
  643    H    VAL  29           H        VAL  29  -3.325  12.729  -0.535
  644    HA   VAL  29           HA       VAL  29  -4.337  11.474  -2.817
  645    HB   VAL  29           HB       VAL  29  -1.453  11.661  -1.922
  646   1HG1  VAL  29          1HG1      VAL  29  -1.500  11.729  -4.674
  647   2HG1  VAL  29          2HG1      VAL  29  -2.707  10.504  -4.278
  648   3HG1  VAL  29          3HG1      VAL  29  -1.055  10.340  -3.676
  649   1HG2  VAL  29          1HG2      VAL  29  -2.310  13.464  -4.030
  650   2HG2  VAL  29          2HG2      VAL  29  -1.444  13.807  -2.532
  651   3HG2  VAL  29          3HG2      VAL  29  -3.205  13.717  -2.531
  652    H    VAL  30           H        VAL  30  -2.572  10.189  -0.053
  653    HA   VAL  30           HA       VAL  30  -2.211   7.565  -1.027
  654    HB   VAL  30           HB       VAL  30  -2.555   8.487   1.838
  655   1HG1  VAL  30          1HG1      VAL  30  -2.717   5.948   1.122
  656   2HG1  VAL  30          2HG1      VAL  30  -1.845   6.443   2.572
  657   3HG1  VAL  30          3HG1      VAL  30  -0.959   6.094   1.088
  658   1HG2  VAL  30          1HG2      VAL  30  -0.325   8.987   1.935
  659   2HG2  VAL  30          2HG2      VAL  30  -0.666   9.424   0.261
  660   3HG2  VAL  30          3HG2      VAL  30   0.089   7.874   0.632
  661    H    LYS  31           H        LYS  31  -4.801   9.081   0.919
  662    HA   LYS  31           HA       LYS  31  -6.411   6.915   1.418
  663   1HB   LYS  31          2HB       LYS  31  -7.373   9.652   0.568
  664   2HB   LYS  31          1HB       LYS  31  -8.326   8.446   1.418
  665   1HG   LYS  31          2HG       LYS  31  -5.879   9.829   2.489
  666   2HG   LYS  31          1HG       LYS  31  -7.552  10.191   2.911
  667   1HD   LYS  31          2HD       LYS  31  -6.542   7.413   3.263
  668   2HD   LYS  31          1HD       LYS  31  -6.087   8.644   4.440
  669   1HE   LYS  31          2HE       LYS  31  -8.080   7.462   5.170
  670   2HE   LYS  31          1HE       LYS  31  -8.454   9.147   4.815
  671   1HZ   LYS  31          1HZ       LYS  31  -8.844   7.080   2.754
  672   2HZ   LYS  31          2HZ       LYS  31  -9.606   8.581   2.918
  673   3HZ   LYS  31          3HZ       LYS  31 -10.010   7.313   3.958
  674    H    GLN  32           H        GLN  32  -6.480   8.994  -1.446
  675    HA   GLN  32           HA       GLN  32  -8.447   7.608  -2.869
  676   1HB   GLN  32          2HB       GLN  32  -7.516   9.866  -3.450
  677   2HB   GLN  32          1HB       GLN  32  -6.069   9.063  -4.042
  678   1HG   GLN  32          2HG       GLN  32  -7.490   9.609  -5.888
  679   2HG   GLN  32          1HG       GLN  32  -7.432   7.861  -5.692
  680   1HE2  GLN  32          1HE2      GLN  32  -9.329   9.253  -3.274
  681   2HE2  GLN  32          2HE2      GLN  32 -10.873   8.999  -4.001
  682    H    PHE  33           H        PHE  33  -4.983   7.130  -2.610
  683    HA   PHE  33           HA       PHE  33  -4.522   5.273  -4.605
  684   1HB   PHE  33          2HB       PHE  33  -2.833   6.365  -3.054
  685   2HB   PHE  33          1HB       PHE  33  -3.294   5.176  -1.842
  686    HD1  PHE  33           1HD      PHE  33  -2.196   5.338  -5.388
  687    HD2  PHE  33           2HD      PHE  33  -2.023   3.256  -1.667
  688    HE1  PHE  33           1HE      PHE  33  -0.592   3.737  -6.346
  689    HE2  PHE  33           2HE      PHE  33  -0.416   1.671  -2.631
  690    HZ   PHE  33           HZ       PHE  33   0.302   1.912  -4.977
  691    H    PHE  34           H        PHE  34  -5.027   4.484  -1.204
  692    HA   PHE  34           HA       PHE  34  -5.603   1.742  -1.656
  693   1HB   PHE  34          2HB       PHE  34  -6.240   3.448   0.754
  694   2HB   PHE  34          1HB       PHE  34  -6.224   1.682   0.710
  695    HD1  PHE  34           1HD      PHE  34  -3.908   0.944  -0.704
  696    HD2  PHE  34           2HD      PHE  34  -4.424   4.225   1.946
  697    HE1  PHE  34           1HE      PHE  34  -1.491   0.964  -0.267
  698    HE2  PHE  34           2HE      PHE  34  -2.007   4.245   2.400
  699    HZ   PHE  34           HZ       PHE  34  -0.544   2.616   1.281
  700    H    ASN  35           H        ASN  35  -7.609   4.590  -1.274
  701    HA   ASN  35           HA       ASN  35 -10.132   3.503  -1.017
  702   1HB   ASN  35          2HB       ASN  35  -9.631   5.923  -0.986
  703   2HB   ASN  35          1HB       ASN  35  -9.302   5.872  -2.714
  704   1HD2  ASN  35          1HD2      ASN  35 -11.380   7.080  -0.776
  705   2HD2  ASN  35          2HD2      ASN  35 -12.873   6.821  -1.607
  706    H    ASP  36           H        ASP  36  -8.157   3.927  -3.868
  707    HA   ASP  36           HA       ASP  36 -10.165   2.668  -5.575
  708   1HB   ASP  36          2HB       ASP  36  -7.531   3.972  -6.274
  709   2HB   ASP  36          1HB       ASP  36  -8.657   3.291  -7.444
  710    H    ASN  37           H        ASN  37  -7.183   1.859  -3.996
  711    HA   ASN  37           HA       ASN  37  -6.592  -0.365  -5.741
  712   1HB   ASN  37          2HB       ASN  37  -5.507   0.358  -3.007
  713   2HB   ASN  37          1HB       ASN  37  -4.930  -0.992  -3.975
  714   1HD2  ASN  37          1HD2      ASN  37  -3.769   1.655  -2.979
  715   2HD2  ASN  37          2HD2      ASN  37  -3.024   2.311  -4.395
  716    H    GLY  38           H        GLY  38  -7.912   0.124  -2.536
  717   1HA   GLY  38          2HA       GLY  38  -8.461  -1.815  -1.109
  718   2HA   GLY  38          1HA       GLY  38  -9.881  -1.116  -1.854
  719    H    VAL  39           H        VAL  39 -11.233  -2.523  -2.626
  720    HA   VAL  39           HA       VAL  39 -10.289  -5.232  -3.239
  721    HB   VAL  39           HB       VAL  39 -13.102  -4.274  -2.775
  722   1HG1  VAL  39          1HG1      VAL  39 -11.972  -6.817  -3.557
  723   2HG1  VAL  39          2HG1      VAL  39 -13.656  -6.308  -3.489
  724   3HG1  VAL  39          3HG1      VAL  39 -12.870  -6.948  -2.047
  725   1HG2  VAL  39          1HG2      VAL  39 -11.177  -5.536  -0.825
  726   2HG2  VAL  39          2HG2      VAL  39 -12.865  -5.134  -0.506
  727   3HG2  VAL  39          3HG2      VAL  39 -11.697  -3.850  -0.821
  728    H    ASP  40           H        ASP  40 -11.070  -2.536  -5.138
  729    HA   ASP  40           HA       ASP  40 -12.016  -4.341  -7.256
  730   1HB   ASP  40          2HB       ASP  40 -12.859  -1.477  -6.783
  731   2HB   ASP  40          1HB       ASP  40 -13.328  -2.456  -8.171
  732    H    GLY  41           H        GLY  41  -9.303  -3.063  -6.427
  733   1HA   GLY  41          2HA       GLY  41  -8.655  -1.329  -8.621
  734   2HA   GLY  41          1HA       GLY  41  -7.525  -2.012  -7.464
  735    H    GLU  42           H        GLU  42  -6.837  -1.762 -10.100
  736    HA   GLU  42           HA       GLU  42  -7.183  -4.376 -11.360
  737   1HB   GLU  42          2HB       GLU  42  -5.734  -1.899 -12.323
  738   2HB   GLU  42          1HB       GLU  42  -5.965  -3.369 -13.261
  739   1HG   GLU  42          2HG       GLU  42  -8.385  -3.034 -13.181
  740   2HG   GLU  42          1HG       GLU  42  -8.148  -1.557 -12.248
  741    H    TRP  43           H        TRP  43  -5.948  -5.848 -10.301
  742    HA   TRP  43           HA       TRP  43  -3.169  -5.173  -9.680
  743   1HB   TRP  43          2HB       TRP  43  -4.857  -7.525  -8.822
  744   2HB   TRP  43          1HB       TRP  43  -3.209  -7.208  -8.295
  745    HD1  TRP  43           HD       TRP  43  -5.752  -4.337  -8.458
  746    HE1  TRP  43           1HE      TRP  43  -6.245  -3.557  -6.058
  747    HE3  TRP  43           3HE      TRP  43  -3.256  -7.983  -5.901
  748    HZ2  TRP  43           2HZ      TRP  43  -5.653  -4.382  -3.426
  749    HZ3  TRP  43           3HZ      TRP  43  -3.268  -7.920  -3.448
  750    HH2  TRP  43           HH       TRP  43  -4.441  -6.155  -2.231
  751    H    THR  44           H        THR  44  -1.567  -5.855 -10.926
  752    HA   THR  44           HA       THR  44  -2.010  -8.197 -12.660
  753    HB   THR  44           HB       THR  44  -0.205  -7.263 -14.090
  754    HG1  THR  44           1HG      THR  44  -0.382  -5.036 -12.345
  755   1HG2  THR  44          1HG2      THR  44  -1.572  -5.950 -15.281
  756   2HG2  THR  44          2HG2      THR  44  -1.973  -4.928 -13.900
  757   3HG2  THR  44          3HG2      THR  44  -2.781  -6.483 -14.113
  758    H    TYR  45           H        TYR  45  -0.520  -9.875 -12.594
  759    HA   TYR  45           HA       TYR  45   1.487  -9.666 -10.446
  760   1HB   TYR  45          2HB       TYR  45  -0.338 -11.305 -10.069
  761   2HB   TYR  45          1HB       TYR  45   0.159 -12.160 -11.525
  762    HD1  TYR  45           1HD      TYR  45   2.517 -10.676  -9.102
  763    HD2  TYR  45           2HD      TYR  45   0.662 -14.248 -10.481
  764    HE1  TYR  45           1HE      TYR  45   4.094 -12.004  -7.764
  765    HE2  TYR  45           2HE      TYR  45   2.234 -15.585  -9.145
  766    HH   TYR  45           HH       TYR  45   4.411 -15.396  -8.125
  767    H    ASP  46           H        ASP  46   3.569 -10.343 -10.766
  768    HA   ASP  46           HA       ASP  46   4.298 -11.127 -13.510
  769   1HB   ASP  46          2HB       ASP  46   4.952  -8.798 -13.077
  770   2HB   ASP  46          1HB       ASP  46   5.844  -9.308 -11.647
  771    H    ASP  47           H        ASP  47   4.218 -13.325 -12.806
  772    HA   ASP  47           HA       ASP  47   5.408 -14.520 -10.663
  773   1HB   ASP  47          2HB       ASP  47   5.370 -15.556 -13.507
  774   2HB   ASP  47          1HB       ASP  47   5.674 -16.537 -12.077
  775    H    ALA  48           H        ALA  48   6.994 -13.323 -13.555
  776    HA   ALA  48           HA       ALA  48   9.451 -14.518 -13.432
  777   1HB   ALA  48          1HB       ALA  48  10.105 -12.996 -14.959
  778   2HB   ALA  48          2HB       ALA  48   9.528 -11.630 -14.006
  779   3HB   ALA  48          3HB       ALA  48   8.390 -12.582 -14.958
  780    H    THR  49           H        THR  49   8.243 -11.961 -11.346
  781    HA   THR  49           HA       THR  49  10.760 -12.144  -9.829
  782    HB   THR  49           HB       THR  49  10.518  -9.754  -9.251
  783    HG1  THR  49           1HG      THR  49   8.997  -8.515 -10.302
  784   1HG2  THR  49          1HG2      THR  49  10.398  -9.766 -12.216
  785   2HG2  THR  49          2HG2      THR  49  11.707 -10.634 -11.413
  786   3HG2  THR  49          3HG2      THR  49  11.488  -8.907 -11.127
  787    H    LYS  50           H        LYS  50   7.870 -13.271  -9.600
  788    HA   LYS  50           HA       LYS  50   6.320 -13.667  -7.942
  789   1HB   LYS  50          2HB       LYS  50   8.785 -13.248  -6.238
  790   2HB   LYS  50          1HB       LYS  50   7.302 -14.018  -5.698
  791   1HG   LYS  50          2HG       LYS  50   9.021 -15.040  -7.946
  792   2HG   LYS  50          1HG       LYS  50   9.123 -15.598  -6.276
  793   1HD   LYS  50          2HD       LYS  50   6.668 -15.750  -8.024
  794   2HD   LYS  50          1HD       LYS  50   7.761 -17.092  -7.676
  795   1HE   LYS  50          2HE       LYS  50   7.244 -16.860  -5.280
  796   2HE   LYS  50          1HE       LYS  50   6.108 -15.567  -5.668
  797   1HZ   LYS  50          1HZ       LYS  50   4.706 -17.061  -6.792
  798   2HZ   LYS  50          2HZ       LYS  50   5.128 -17.844  -5.355
  799   3HZ   LYS  50          3HZ       LYS  50   5.869 -18.289  -6.809
  800    H    THR  51           H        THR  51   6.414 -10.972  -8.825
  801    HA   THR  51           HA       THR  51   5.670  -9.572  -6.346
  802    HB   THR  51           HB       THR  51   7.128  -8.469  -8.750
  803    HG1  THR  51           1HG      THR  51   8.736  -8.055  -7.172
  804   1HG2  THR  51          1HG2      THR  51   6.534  -6.414  -8.224
  805   2HG2  THR  51          2HG2      THR  51   7.095  -6.653  -6.569
  806   3HG2  THR  51          3HG2      THR  51   5.434  -7.054  -7.004
  807    H    PHE  52           H        PHE  52   3.865  -8.325  -6.363
  808    HA   PHE  52           HA       PHE  52   2.171  -8.480  -8.766
  809   1HB   PHE  52          2HB       PHE  52   1.389  -7.996  -5.879
  810   2HB   PHE  52          1HB       PHE  52   0.273  -8.086  -7.235
  811    HD1  PHE  52           1HD      PHE  52  -0.317 -10.198  -8.221
  812    HD2  PHE  52           2HD      PHE  52   2.464  -9.991  -5.006
  813    HE1  PHE  52           1HE      PHE  52  -0.542 -12.623  -7.875
  814    HE2  PHE  52           2HE      PHE  52   2.243 -12.417  -4.654
  815    HZ   PHE  52           HZ       PHE  52   0.741 -13.735  -6.090
  816    H    THR  53           H        THR  53   1.216  -6.580  -9.573
  817    HA   THR  53           HA       THR  53   2.196  -4.092  -8.344
  818    HB   THR  53           HB       THR  53   1.981  -3.192 -10.775
  819    HG1  THR  53           1HG      THR  53   2.269  -5.974 -11.224
  820   1HG2  THR  53          1HG2      THR  53   4.177  -4.661  -9.515
  821   2HG2  THR  53          2HG2      THR  53   4.146  -3.060 -10.255
  822   3HG2  THR  53          3HG2      THR  53   4.287  -4.498 -11.267
  823    H    VAL  54           H        VAL  54   0.741  -2.723  -7.704
  824    HA   VAL  54           HA       VAL  54  -2.024  -2.991  -8.680
  825    HB   VAL  54           HB       VAL  54  -1.018  -1.657  -6.148
  826   1HG1  VAL  54          1HG1      VAL  54  -3.030  -0.586  -7.036
  827   2HG1  VAL  54          2HG1      VAL  54  -3.377  -1.462  -5.544
  828   3HG1  VAL  54          3HG1      VAL  54  -3.839  -2.151  -7.101
  829   1HG2  VAL  54          1HG2      VAL  54  -2.614  -3.656  -5.310
  830   2HG2  VAL  54          2HG2      VAL  54  -0.868  -3.814  -5.500
  831   3HG2  VAL  54          3HG2      VAL  54  -1.949  -4.385  -6.771
  832    H    THR  55           H        THR  55  -2.428  -1.602 -10.285
  833    HA   THR  55           HA       THR  55  -1.049   0.983 -10.267
  834    HB   THR  55           HB       THR  55  -2.595  -0.227 -12.553
  835    HG1  THR  55           1HG      THR  55   0.203  -0.321 -12.103
  836   1HG2  THR  55          1HG2      THR  55  -1.053   1.210 -13.894
  837   2HG2  THR  55          2HG2      THR  55  -0.556   1.974 -12.383
  838   3HG2  THR  55          3HG2      THR  55  -2.232   2.092 -12.922
  839    H    GLU  56           H        GLU  56  -2.084   2.649  -9.469
  840    HA   GLU  56           HA       GLU  56  -4.749   2.790  -8.761
  841   1HB   GLU  56          2HB       GLU  56  -3.122   4.355  -7.900
  842   2HB   GLU  56          1HB       GLU  56  -2.835   5.007  -9.506
  843   1HG   GLU  56          2HG       GLU  56  -4.204   6.500  -8.160
  844   2HG   GLU  56          1HG       GLU  56  -5.085   5.911  -9.568
  Start of MODEL   22
    1   1H    MET   1          1HT       MET   1   5.402 -18.367   2.804
    2   2H    MET   1          2HT       MET   1   5.775 -19.772   1.937
    3   3H    MET   1          3HT       MET   1   4.639 -18.678   1.326
    4    HA   MET   1           HA       MET   1   7.561 -18.302   1.589
    5   1HB   MET   1          2HB       MET   1   6.722 -19.549  -0.373
    6   2HB   MET   1          1HB       MET   1   5.666 -18.203  -0.774
    7   1HG   MET   1          2HG       MET   1   7.589 -16.779  -1.164
    8   2HG   MET   1          1HG       MET   1   8.672 -18.090  -0.701
    9   1HE   MET   1          1HE       MET   1   8.904 -16.449  -3.448
   10   2HE   MET   1          2HE       MET   1   9.249 -17.765  -4.569
   11   3HE   MET   1          3HE       MET   1  10.008 -17.742  -2.977
   12    H    GLN   2           H        GLN   2   8.293 -16.212   0.620
   13    HA   GLN   2           HA       GLN   2   6.538 -14.040   1.528
   14   1HB   GLN   2          2HB       GLN   2   8.734 -14.151   2.618
   15   2HB   GLN   2          1HB       GLN   2   9.527 -14.061   1.052
   16   1HG   GLN   2          2HG       GLN   2   8.606 -11.830   0.707
   17   2HG   GLN   2          1HG       GLN   2   7.796 -11.919   2.267
   18   1HE2  GLN   2          1HE2      GLN   2  10.662 -13.484   2.677
   19   2HE2  GLN   2          2HE2      GLN   2  11.626 -12.171   3.246
   20    H    TYR   3           H        TYR   3   5.919 -12.419   0.158
   21    HA   TYR   3           HA       TYR   3   6.894 -12.603  -2.616
   22   1HB   TYR   3          2HB       TYR   3   4.070 -12.047  -1.690
   23   2HB   TYR   3          1HB       TYR   3   4.620 -11.947  -3.361
   24    HD1  TYR   3           1HD      TYR   3   4.344 -13.799  -4.719
   25    HD2  TYR   3           2HD      TYR   3   4.568 -14.363  -0.508
   26    HE1  TYR   3           1HE      TYR   3   3.888 -16.195  -5.022
   27    HE2  TYR   3           2HE      TYR   3   4.115 -16.762  -0.798
   28    HH   TYR   3           HH       TYR   3   4.337 -18.332  -3.730
   29    H    LYS   4           H        LYS   4   7.148 -10.703  -3.762
   30    HA   LYS   4           HA       LYS   4   7.370  -8.307  -2.090
   31   1HB   LYS   4          2HB       LYS   4   9.287  -9.256  -3.520
   32   2HB   LYS   4          1HB       LYS   4   8.399  -8.638  -4.904
   33   1HG   LYS   4          2HG       LYS   4   9.427  -6.999  -2.597
   34   2HG   LYS   4          1HG       LYS   4  10.159  -7.112  -4.197
   35   1HD   LYS   4          2HD       LYS   4   8.040  -6.203  -5.150
   36   2HD   LYS   4          1HD       LYS   4   7.464  -5.953  -3.499
   37   1HE   LYS   4          2HE       LYS   4   8.384  -3.891  -4.357
   38   2HE   LYS   4          1HE       LYS   4   9.410  -4.512  -3.064
   39   1HZ   LYS   4          1HZ       LYS   4   9.938  -4.844  -5.968
   40   2HZ   LYS   4          2HZ       LYS   4  10.936  -5.366  -4.708
   41   3HZ   LYS   4          3HZ       LYS   4  10.696  -3.713  -4.964
   42    H    VAL   5           H        VAL   5   5.548  -7.123  -2.087
   43    HA   VAL   5           HA       VAL   5   3.948  -6.966  -4.528
   44    HB   VAL   5           HB       VAL   5   3.320  -5.969  -1.745
   45   1HG1  VAL   5          1HG1      VAL   5   2.153  -4.694  -3.466
   46   2HG1  VAL   5          2HG1      VAL   5   1.031  -5.720  -2.573
   47   3HG1  VAL   5          3HG1      VAL   5   1.562  -6.191  -4.187
   48   1HG2  VAL   5          1HG2      VAL   5   1.558  -7.956  -2.217
   49   2HG2  VAL   5          2HG2      VAL   5   3.089  -8.178  -1.370
   50   3HG2  VAL   5          3HG2      VAL   5   2.966  -8.564  -3.086
   51    H    ILE   6           H        ILE   6   4.064  -5.289  -5.838
   52    HA   ILE   6           HA       ILE   6   5.364  -2.829  -4.900
   53    HB   ILE   6           HB       ILE   6   4.982  -3.928  -7.691
   54   1HG1  ILE   6          2HG1      ILE   6   7.472  -3.509  -6.028
   55   2HG1  ILE   6          1HG1      ILE   6   6.708  -5.060  -6.354
   56   1HG2  ILE   6          1HG2      ILE   6   5.161  -1.263  -7.030
   57   2HG2  ILE   6          2HG2      ILE   6   5.541  -1.981  -8.596
   58   3HG2  ILE   6          3HG2      ILE   6   6.825  -1.702  -7.420
   59   1HD1  ILE   6          1HD1      ILE   6   7.128  -4.661  -8.781
   60   2HD1  ILE   6          2HD1      ILE   6   8.582  -4.836  -7.798
   61   3HD1  ILE   6          3HD1      ILE   6   8.060  -3.237  -8.321
   62    H    LEU   7           H        LEU   7   4.150  -1.043  -4.649
   63    HA   LEU   7           HA       LEU   7   1.434  -1.042  -5.788
   64   1HB   LEU   7          2HB       LEU   7   2.357   0.742  -3.555
   65   2HB   LEU   7          1HB       LEU   7   0.726   0.225  -3.947
   66    HG   LEU   7           HG       LEU   7   2.884  -1.523  -2.777
   67   1HD1  LEU   7          1HD1      LEU   7   1.450  -1.519  -0.783
   68   2HD1  LEU   7          2HD1      LEU   7   0.389  -0.345  -1.562
   69   3HD1  LEU   7          3HD1      LEU   7   2.053   0.091  -1.174
   70   1HD2  LEU   7          1HD2      LEU   7   1.418  -2.790  -4.234
   71   2HD2  LEU   7          2HD2      LEU   7   0.001  -2.110  -3.436
   72   3HD2  LEU   7          3HD2      LEU   7   1.085  -3.180  -2.547
   73    H    ASN   8           H        ASN   8   1.531   0.005  -7.713
   74    HA   ASN   8           HA       ASN   8   2.986   2.559  -7.838
   75   1HB   ASN   8          2HB       ASN   8   2.135   0.702 -10.058
   76   2HB   ASN   8          1HB       ASN   8   2.910   2.263 -10.306
   77   1HD2  ASN   8          1HD2      ASN   8   4.981   2.126 -10.705
   78   2HD2  ASN   8          2HD2      ASN   8   6.063   0.928 -10.089
   79    H    GLY   9           H        GLY   9   1.654   4.242  -7.454
   80   1HA   GLY   9          2HA       GLY   9  -1.025   4.144  -8.687
   81   2HA   GLY   9          1HA       GLY   9  -0.638   5.054  -7.238
   82    H    LYS  10           H        LYS  10  -1.781   6.712  -8.609
   83    HA   LYS  10           HA       LYS  10  -0.421   7.822 -10.855
   84   1HB   LYS  10          2HB       LYS  10  -2.555   8.997  -9.062
   85   2HB   LYS  10          1HB       LYS  10  -2.006   9.715 -10.569
   86   1HG   LYS  10          2HG       LYS  10  -3.308   7.014 -10.304
   87   2HG   LYS  10          1HG       LYS  10  -4.113   8.494 -10.824
   88   1HD   LYS  10          2HD       LYS  10  -2.559   8.646 -12.726
   89   2HD   LYS  10          1HD       LYS  10  -1.803   7.137 -12.212
   90   1HE   LYS  10          2HE       LYS  10  -3.915   5.961 -12.527
   91   2HE   LYS  10          1HE       LYS  10  -4.694   7.468 -13.006
   92   1HZ   LYS  10          1HZ       LYS  10  -3.675   5.748 -14.740
   93   2HZ   LYS  10          2HZ       LYS  10  -2.313   6.718 -14.497
   94   3HZ   LYS  10          3HZ       LYS  10  -3.757   7.411 -15.040
   95    H    THR  11           H        THR  11  -0.873   9.001  -7.515
   96    HA   THR  11           HA       THR  11   1.518  10.670  -7.852
   97    HB   THR  11           HB       THR  11   0.399  11.867  -5.824
   98    HG1  THR  11           1HG      THR  11  -1.879  11.666  -5.898
   99   1HG2  THR  11          1HG2      THR  11  -0.087  13.462  -7.274
  100   2HG2  THR  11          2HG2      THR  11  -1.401  12.502  -7.956
  101   3HG2  THR  11          3HG2      THR  11   0.241  12.314  -8.572
  102    H    LEU  12           H        LEU  12   0.931   7.776  -6.772
  103    HA   LEU  12           HA       LEU  12   2.700   8.083  -4.465
  104   1HB   LEU  12          2HB       LEU  12   0.464   7.961  -3.553
  105   2HB   LEU  12          1HB       LEU  12   0.125   6.517  -4.485
  106    HG   LEU  12           HG       LEU  12   1.688   5.240  -3.167
  107   1HD1  LEU  12          1HD1      LEU  12   2.635   7.883  -2.463
  108   2HD1  LEU  12          2HD1      LEU  12   3.460   6.334  -2.381
  109   3HD1  LEU  12          3HD1      LEU  12   2.422   6.853  -1.052
  110   1HD2  LEU  12          1HD2      LEU  12   0.084   4.913  -1.672
  111   2HD2  LEU  12          2HD2      LEU  12  -0.666   6.427  -2.174
  112   3HD2  LEU  12          3HD2      LEU  12   0.500   6.418  -0.850
  113    H    LYS  13           H        LYS  13   4.177   6.495  -4.205
  114    HA   LYS  13           HA       LYS  13   3.968   4.045  -5.783
  115   1HB   LYS  13          2HB       LYS  13   6.375   5.870  -5.957
  116   2HB   LYS  13          1HB       LYS  13   6.188   4.315  -6.756
  117   1HG   LYS  13          2HG       LYS  13   4.351   5.206  -8.087
  118   2HG   LYS  13          1HG       LYS  13   4.517   6.765  -7.276
  119   1HD   LYS  13          2HD       LYS  13   6.811   6.953  -8.146
  120   2HD   LYS  13          1HD       LYS  13   6.607   5.413  -8.985
  121   1HE   LYS  13          2HE       LYS  13   4.986   7.916  -9.446
  122   2HE   LYS  13          1HE       LYS  13   6.264   7.304 -10.496
  123   1HZ   LYS  13          1HZ       LYS  13   3.743   5.865  -9.864
  124   2HZ   LYS  13          2HZ       LYS  13   4.952   5.341 -10.925
  125   3HZ   LYS  13          3HZ       LYS  13   4.043   6.720 -11.293
  126    H    GLY  14           H        GLY  14   5.156   2.306  -4.914
  127   1HA   GLY  14          2HA       GLY  14   7.125   2.628  -2.903
  128   2HA   GLY  14          1HA       GLY  14   5.566   2.326  -2.158
  129    H    GLU  15           H        GLU  15   6.983   0.503  -1.367
  130    HA   GLU  15           HA       GLU  15   6.417  -1.843  -3.014
  131   1HB   GLU  15          2HB       GLU  15   9.118  -1.281  -1.769
  132   2HB   GLU  15          1HB       GLU  15   8.656  -2.774  -2.571
  133   1HG   GLU  15          2HG       GLU  15   8.378  -1.583  -4.672
  134   2HG   GLU  15          1HG       GLU  15   8.788  -0.065  -3.875
  135    H    THR  16           H        THR  16   5.794  -3.596  -1.859
  136    HA   THR  16           HA       THR  16   6.150  -3.570   1.040
  137    HB   THR  16           HB       THR  16   4.012  -2.683   1.016
  138    HG1  THR  16           1HG      THR  16   3.458  -5.433   0.819
  139   1HG2  THR  16          1HG2      THR  16   3.671  -4.110  -1.540
  140   2HG2  THR  16          2HG2      THR  16   3.161  -2.494  -1.062
  141   3HG2  THR  16          3HG2      THR  16   2.237  -3.902  -0.541
  142    H    THR  17           H        THR  17   5.426  -5.718   2.020
  143    HA   THR  17           HA       THR  17   5.737  -7.955   0.160
  144    HB   THR  17           HB       THR  17   7.449  -8.973   1.659
  145    HG1  THR  17           1HG      THR  17   8.508  -7.550   3.105
  146   1HG2  THR  17          1HG2      THR  17   9.253  -7.973   0.678
  147   2HG2  THR  17          2HG2      THR  17   8.581  -6.350   0.841
  148   3HG2  THR  17          3HG2      THR  17   7.959  -7.441  -0.397
  149    H    THR  18           H        THR  18   4.202  -9.377   0.544
  150    HA   THR  18           HA       THR  18   3.069  -9.619   3.259
  151    HB   THR  18           HB       THR  18   1.493  -9.064   1.416
  152    HG1  THR  18           1HG      THR  18   0.864 -10.352   3.253
  153   1HG2  THR  18          1HG2      THR  18   2.303 -11.746   0.330
  154   2HG2  THR  18          2HG2      THR  18   2.430 -10.179  -0.471
  155   3HG2  THR  18          3HG2      THR  18   0.844 -10.877  -0.146
  156    H    GLU  19           H        GLU  19   3.116 -11.551   4.320
  157    HA   GLU  19           HA       GLU  19   4.743 -13.673   3.098
  158   1HB   GLU  19          2HB       GLU  19   5.523 -12.814   5.258
  159   2HB   GLU  19          1HB       GLU  19   3.973 -13.207   5.988
  160   1HG   GLU  19          2HG       GLU  19   5.635 -14.863   6.565
  161   2HG   GLU  19          1HG       GLU  19   4.371 -15.577   5.565
  162    H    ALA  20           H        ALA  20   3.548 -15.192   2.083
  163    HA   ALA  20           HA       ALA  20   1.334 -16.388   3.555
  164   1HB   ALA  20          1HB       ALA  20   0.797 -15.836   0.694
  165   2HB   ALA  20          2HB       ALA  20   0.674 -14.489   1.826
  166   3HB   ALA  20          3HB       ALA  20  -0.313 -15.932   2.060
  167    H    VAL  21           H        VAL  21   0.824 -18.472   2.953
  168    HA   VAL  21           HA       VAL  21   2.860 -20.187   2.279
  169    HB   VAL  21           HB       VAL  21  -0.047 -20.748   1.704
  170   1HG1  VAL  21          1HG1      VAL  21   0.484 -23.034   2.005
  171   2HG1  VAL  21          2HG1      VAL  21   2.094 -22.653   2.617
  172   3HG1  VAL  21          3HG1      VAL  21   1.708 -22.376   0.918
  173   1HG2  VAL  21          1HG2      VAL  21   1.453 -20.608   4.286
  174   2HG2  VAL  21          2HG2      VAL  21   0.101 -21.726   4.101
  175   3HG2  VAL  21          3HG2      VAL  21  -0.152 -19.994   3.887
  176    H    ASP  22           H        ASP  22   0.540 -18.663   0.116
  177    HA   ASP  22           HA       ASP  22   2.251 -19.356  -2.138
  178   1HB   ASP  22          2HB       ASP  22   0.255 -20.053  -3.504
  179   2HB   ASP  22          1HB       ASP  22   0.717 -21.181  -2.234
  180    H    ALA  23           H        ALA  23   1.440 -18.258  -4.197
  181    HA   ALA  23           HA       ALA  23   1.398 -15.512  -3.817
  182   1HB   ALA  23          1HB       ALA  23   1.719 -17.135  -5.962
  183   2HB   ALA  23          2HB       ALA  23   1.537 -15.385  -6.056
  184   3HB   ALA  23          3HB       ALA  23   0.139 -16.430  -6.304
  185    H    ALA  24           H        ALA  24  -1.296 -17.734  -4.356
  186    HA   ALA  24           HA       ALA  24  -3.303 -15.769  -4.588
  187   1HB   ALA  24          1HB       ALA  24  -3.222 -18.681  -4.146
  188   2HB   ALA  24          2HB       ALA  24  -4.216 -17.726  -5.245
  189   3HB   ALA  24          3HB       ALA  24  -4.665 -17.863  -3.544
  190    H    THR  25           H        THR  25  -2.328 -17.735  -1.754
  191    HA   THR  25           HA       THR  25  -3.990 -16.525   0.110
  192    HB   THR  25           HB       THR  25  -2.213 -17.176   1.777
  193    HG1  THR  25           1HG      THR  25  -0.318 -17.697   1.136
  194   1HG2  THR  25          1HG2      THR  25  -3.164 -19.205  -0.201
  195   2HG2  THR  25          2HG2      THR  25  -3.809 -18.843   1.399
  196   3HG2  THR  25          3HG2      THR  25  -2.243 -19.637   1.240
  197    H    ALA  26           H        ALA  26  -0.767 -15.620  -1.030
  198    HA   ALA  26           HA       ALA  26  -0.396 -13.371   0.614
  199   1HB   ALA  26          1HB       ALA  26   0.791 -14.411  -1.873
  200   2HB   ALA  26          2HB       ALA  26   1.570 -13.768  -0.427
  201   3HB   ALA  26          3HB       ALA  26   0.926 -12.668  -1.646
  202    H    GLU  27           H        GLU  27  -1.633 -13.619  -2.737
  203    HA   GLU  27           HA       GLU  27  -2.296 -10.995  -3.177
  204   1HB   GLU  27          2HB       GLU  27  -2.450 -12.742  -4.887
  205   2HB   GLU  27          1HB       GLU  27  -3.831 -13.440  -4.054
  206   1HG   GLU  27          2HG       GLU  27  -5.105 -11.403  -4.459
  207   2HG   GLU  27          1HG       GLU  27  -3.722 -10.708  -5.301
  208    H    LYS  28           H        LYS  28  -4.320 -13.523  -1.689
  209    HA   LYS  28           HA       LYS  28  -6.573 -11.927  -1.205
  210   1HB   LYS  28          2HB       LYS  28  -5.534 -14.297   0.365
  211   2HB   LYS  28          1HB       LYS  28  -7.145 -13.612   0.524
  212   1HG   LYS  28          2HG       LYS  28  -5.991 -14.909  -1.935
  213   2HG   LYS  28          1HG       LYS  28  -7.206 -15.595  -0.852
  214   1HD   LYS  28          2HD       LYS  28  -8.737 -13.770  -1.424
  215   2HD   LYS  28          1HD       LYS  28  -7.524 -13.099  -2.516
  216   1HE   LYS  28          2HE       LYS  28  -9.209 -14.395  -3.729
  217   2HE   LYS  28          1HE       LYS  28  -7.606 -15.114  -3.875
  218   1HZ   LYS  28          1HZ       LYS  28  -9.549 -16.023  -1.839
  219   2HZ   LYS  28          2HZ       LYS  28  -8.169 -16.822  -2.400
  220   3HZ   LYS  28          3HZ       LYS  28  -9.522 -16.671  -3.401
  221    H    VAL  29           H        VAL  29  -3.721 -12.629   0.757
  222    HA   VAL  29           HA       VAL  29  -4.421 -11.240   3.061
  223    HB   VAL  29           HB       VAL  29  -1.717 -11.750   1.816
  224   1HG1  VAL  29          1HG1      VAL  29  -2.434 -10.289   4.309
  225   2HG1  VAL  29          2HG1      VAL  29  -1.152  -9.969   3.142
  226   3HG1  VAL  29          3HG1      VAL  29  -0.986 -11.297   4.290
  227   1HG2  VAL  29          1HG2      VAL  29  -3.315 -13.585   2.802
  228   2HG2  VAL  29          2HG2      VAL  29  -2.689 -12.995   4.341
  229   3HG2  VAL  29          3HG2      VAL  29  -1.581 -13.628   3.125
  230    H    VAL  30           H        VAL  30  -2.839 -10.109   0.109
  231    HA   VAL  30           HA       VAL  30  -2.413  -7.461   1.025
  232    HB   VAL  30           HB       VAL  30  -2.833  -8.317  -1.838
  233   1HG1  VAL  30          1HG1      VAL  30  -0.983  -6.164  -0.902
  234   2HG1  VAL  30          2HG1      VAL  30  -2.706  -5.834  -1.062
  235   3HG1  VAL  30          3HG1      VAL  30  -1.773  -6.353  -2.465
  236   1HG2  VAL  30          1HG2      VAL  30  -0.067  -8.082  -1.032
  237   2HG2  VAL  30          2HG2      VAL  30  -0.889  -9.401  -1.865
  238   3HG2  VAL  30          3HG2      VAL  30  -0.907  -9.323  -0.102
  239    H    LYS  31           H        LYS  31  -4.979  -8.982  -0.958
  240    HA   LYS  31           HA       LYS  31  -6.591  -6.826  -1.462
  241   1HB   LYS  31          2HB       LYS  31  -7.473  -9.603  -0.651
  242   2HB   LYS  31          1HB       LYS  31  -8.537  -8.388  -1.335
  243   1HG   LYS  31          2HG       LYS  31  -6.340  -9.922  -2.651
  244   2HG   LYS  31          1HG       LYS  31  -8.023  -9.730  -3.142
  245   1HD   LYS  31          2HD       LYS  31  -7.326  -7.200  -3.330
  246   2HD   LYS  31          1HD       LYS  31  -5.713  -7.897  -3.483
  247   1HE   LYS  31          2HE       LYS  31  -8.079  -8.623  -5.203
  248   2HE   LYS  31          1HE       LYS  31  -6.791  -7.512  -5.669
  249   1HZ   LYS  31          1HZ       LYS  31  -6.247  -9.579  -6.602
  250   2HZ   LYS  31          2HZ       LYS  31  -6.593 -10.423  -5.179
  251   3HZ   LYS  31          3HZ       LYS  31  -5.231  -9.421  -5.259
  252    H    GLN  32           H        GLN  32  -6.548  -8.831   1.443
  253    HA   GLN  32           HA       GLN  32  -8.535  -7.367   2.828
  254   1HB   GLN  32          2HB       GLN  32  -8.153  -9.507   3.674
  255   2HB   GLN  32          1HB       GLN  32  -6.412  -9.322   3.661
  256   1HG   GLN  32          2HG       GLN  32  -8.157  -7.726   5.503
  257   2HG   GLN  32          1HG       GLN  32  -7.627  -9.354   5.910
  258   1HE2  GLN  32          1HE2      GLN  32  -5.116  -8.226   4.168
  259   2HE2  GLN  32          2HE2      GLN  32  -4.175  -7.517   5.423
  260    H    PHE  33           H        PHE  33  -5.072  -7.027   2.523
  261    HA   PHE  33           HA       PHE  33  -4.546  -5.193   4.540
  262   1HB   PHE  33          2HB       PHE  33  -2.860  -6.368   3.100
  263   2HB   PHE  33          1HB       PHE  33  -3.274  -5.266   1.792
  264    HD1  PHE  33           1HD      PHE  33  -1.855  -5.459   5.188
  265    HD2  PHE  33           2HD      PHE  33  -2.293  -3.119   1.648
  266    HE1  PHE  33           1HE      PHE  33  -0.181  -3.862   6.024
  267    HE2  PHE  33           2HE      PHE  33  -0.620  -1.527   2.495
  268    HZ   PHE  33           HZ       PHE  33   0.434  -1.902   4.692
  269    H    PHE  34           H        PHE  34  -5.223  -4.506   1.127
  270    HA   PHE  34           HA       PHE  34  -5.589  -1.693   1.595
  271   1HB   PHE  34          2HB       PHE  34  -6.163  -3.361  -0.853
  272   2HB   PHE  34          1HB       PHE  34  -6.212  -1.598  -0.791
  273    HD1  PHE  34           1HD      PHE  34  -3.921  -0.883   0.776
  274    HD2  PHE  34           2HD      PHE  34  -4.333  -3.965  -2.115
  275    HE1  PHE  34           1HE      PHE  34  -1.500  -0.816   0.366
  276    HE2  PHE  34           2HE      PHE  34  -1.913  -3.901  -2.542
  277    HZ   PHE  34           HZ       PHE  34  -0.498  -2.323  -1.291
  278    H    ASN  35           H        ASN  35  -7.741  -4.429   1.039
  279    HA   ASN  35           HA       ASN  35 -10.179  -3.167   0.748
  280   1HB   ASN  35          2HB       ASN  35  -9.901  -5.599   0.634
  281   2HB   ASN  35          1HB       ASN  35  -9.531  -5.655   2.353
  282   1HD2  ASN  35          1HD2      ASN  35 -11.779  -6.468   0.313
  283   2HD2  ASN  35          2HD2      ASN  35 -13.213  -6.187   1.235
  284    H    ASP  36           H        ASP  36  -8.289  -3.758   3.613
  285    HA   ASP  36           HA       ASP  36 -10.269  -2.484   5.339
  286   1HB   ASP  36          2HB       ASP  36  -7.691  -3.900   6.010
  287   2HB   ASP  36          1HB       ASP  36  -8.796  -3.213   7.198
  288    H    ASN  37           H        ASN  37  -7.206  -1.713   3.847
  289    HA   ASN  37           HA       ASN  37  -6.604   0.436   5.679
  290   1HB   ASN  37          2HB       ASN  37  -5.473  -0.284   2.966
  291   2HB   ASN  37          1HB       ASN  37  -4.947   1.124   3.879
  292   1HD2  ASN  37          1HD2      ASN  37  -3.636  -1.456   3.001
  293   2HD2  ASN  37          2HD2      ASN  37  -2.911  -2.065   4.447
  294    H    GLY  38           H        GLY  38  -7.948   0.072   2.476
  295   1HA   GLY  38          2HA       GLY  38  -8.426   2.068   1.094
  296   2HA   GLY  38          1HA       GLY  38  -9.865   1.383   1.813
  297    H    VAL  39           H        VAL  39 -11.191   2.815   2.573
  298    HA   VAL  39           HA       VAL  39 -10.345   5.517   2.972
  299    HB   VAL  39           HB       VAL  39 -13.073   4.290   3.188
  300   1HG1  VAL  39          1HG1      VAL  39 -13.778   6.724   2.831
  301   2HG1  VAL  39          2HG1      VAL  39 -12.141   7.141   3.339
  302   3HG1  VAL  39          3HG1      VAL  39 -13.212   6.272   4.438
  303   1HG2  VAL  39          1HG2      VAL  39 -12.955   5.962   0.981
  304   2HG2  VAL  39          2HG2      VAL  39 -12.928   4.199   0.969
  305   3HG2  VAL  39          3HG2      VAL  39 -11.415   5.104   0.960
  306    H    ASP  40           H        ASP  40 -12.113   3.276   5.193
  307    HA   ASP  40           HA       ASP  40 -11.689   5.186   7.316
  308   1HB   ASP  40          2HB       ASP  40 -13.125   2.533   7.276
  309   2HB   ASP  40          1HB       ASP  40 -13.074   3.625   8.656
  310    H    GLY  41           H        GLY  41  -9.322   3.665   6.266
  311   1HA   GLY  41          2HA       GLY  41  -8.596   1.742   8.238
  312   2HA   GLY  41          1HA       GLY  41  -7.497   2.539   7.121
  313    H    GLU  42           H        GLU  42  -6.940   1.946   9.874
  314    HA   GLU  42           HA       GLU  42  -7.119   4.481  11.293
  315   1HB   GLU  42          2HB       GLU  42  -5.786   1.877  12.070
  316   2HB   GLU  42          1HB       GLU  42  -5.967   3.278  13.117
  317   1HG   GLU  42          2HG       GLU  42  -8.397   3.053  12.999
  318   2HG   GLU  42          1HG       GLU  42  -8.212   1.644  11.955
  319    H    TRP  43           H        TRP  43  -5.803   5.969  10.321
  320    HA   TRP  43           HA       TRP  43  -3.032   5.195   9.750
  321   1HB   TRP  43          2HB       TRP  43  -4.551   7.658   8.896
  322   2HB   TRP  43          1HB       TRP  43  -2.933   7.208   8.377
  323    HD1  TRP  43           HD       TRP  43  -5.785   4.634   8.463
  324    HE1  TRP  43           1HE      TRP  43  -6.308   3.923   6.046
  325    HE3  TRP  43           3HE      TRP  43  -2.776   7.933   6.021
  326    HZ2  TRP  43           2HZ      TRP  43  -5.529   4.682   3.441
  327    HZ3  TRP  43           3HZ      TRP  43  -2.708   7.878   3.574
  328    HH2  TRP  43           HH       TRP  43  -4.059   6.285   2.302
  329    H    THR  44           H        THR  44  -1.420   5.852  10.999
  330    HA   THR  44           HA       THR  44  -1.862   8.134  12.805
  331    HB   THR  44           HB       THR  44  -0.001   7.183  14.155
  332    HG1  THR  44           1HG      THR  44   0.912   5.994  12.340
  333   1HG2  THR  44          1HG2      THR  44  -1.614   4.790  14.062
  334   2HG2  THR  44          2HG2      THR  44  -2.599   6.254  14.078
  335   3HG2  THR  44          3HG2      THR  44  -1.413   5.972  15.354
  336    H    TYR  45           H        TYR  45  -0.445   9.864  12.710
  337    HA   TYR  45           HA       TYR  45   1.555   9.733  10.553
  338   1HB   TYR  45          2HB       TYR  45  -0.350  11.297  10.193
  339   2HB   TYR  45          1HB       TYR  45   0.147  12.182  11.631
  340    HD1  TYR  45           1HD      TYR  45   2.455  10.747   9.118
  341    HD2  TYR  45           2HD      TYR  45   0.612  14.276  10.617
  342    HE1  TYR  45           1HE      TYR  45   3.964  12.113   7.740
  343    HE2  TYR  45           2HE      TYR  45   2.117  15.652   9.245
  344    HH   TYR  45           HH       TYR  45   4.175  15.552   8.099
  345    H    ASP  46           H        ASP  46   3.608  10.505  10.866
  346    HA   ASP  46           HA       ASP  46   4.312  11.316  13.609
  347   1HB   ASP  46          2HB       ASP  46   5.053   9.013  13.176
  348   2HB   ASP  46          1HB       ASP  46   5.927   9.558  11.748
  349    H    ASP  47           H        ASP  47   4.176  13.514  12.934
  350    HA   ASP  47           HA       ASP  47   5.320  14.735  10.769
  351   1HB   ASP  47          2HB       ASP  47   5.266  15.819  13.593
  352   2HB   ASP  47          1HB       ASP  47   5.456  16.776  12.128
  353    H    ALA  48           H        ALA  48   6.929  13.664  13.706
  354    HA   ALA  48           HA       ALA  48   9.347  14.942  13.549
  355   1HB   ALA  48          1HB       ALA  48   8.730  13.500  15.399
  356   2HB   ALA  48          2HB       ALA  48  10.300  13.033  14.750
  357   3HB   ALA  48          3HB       ALA  48   8.868  12.081  14.361
  358    H    THR  49           H        THR  49   8.240  12.254  11.578
  359    HA   THR  49           HA       THR  49  10.738  12.478  10.034
  360    HB   THR  49           HB       THR  49  10.612  10.059   9.568
  361    HG1  THR  49           1HG      THR  49   8.536  10.059  11.502
  362   1HG2  THR  49          1HG2      THR  49  11.245  11.202  12.114
  363   2HG2  THR  49          2HG2      THR  49  12.003   9.853  11.268
  364   3HG2  THR  49          3HG2      THR  49  10.614   9.568  12.317
  365    H    LYS  50           H        LYS  50   7.752  13.397   9.827
  366    HA   LYS  50           HA       LYS  50   6.166  13.652   8.184
  367   1HB   LYS  50          2HB       LYS  50   8.699  13.438   6.555
  368   2HB   LYS  50          1HB       LYS  50   7.143  13.851   5.850
  369   1HG   LYS  50          2HG       LYS  50   8.513  15.419   8.023
  370   2HG   LYS  50          1HG       LYS  50   8.557  15.811   6.303
  371   1HD   LYS  50          2HD       LYS  50   6.050  15.915   6.363
  372   2HD   LYS  50          1HD       LYS  50   6.153  15.767   8.119
  373   1HE   LYS  50          2HE       LYS  50   7.537  17.804   8.183
  374   2HE   LYS  50          1HE       LYS  50   7.364  17.957   6.434
  375   1HZ   LYS  50          1HZ       LYS  50   4.820  17.809   7.133
  376   2HZ   LYS  50          2HZ       LYS  50   5.660  19.275   7.055
  377   3HZ   LYS  50          3HZ       LYS  50   5.437  18.507   8.546
  378    H    THR  51           H        THR  51   6.610  10.946   9.121
  379    HA   THR  51           HA       THR  51   6.000   9.422   6.685
  380    HB   THR  51           HB       THR  51   7.134   8.476   9.320
  381    HG1  THR  51           1HG      THR  51   8.577   9.591   7.878
  382   1HG2  THR  51          1HG2      THR  51   5.905   6.986   7.155
  383   2HG2  THR  51          2HG2      THR  51   6.359   6.471   8.778
  384   3HG2  THR  51          3HG2      THR  51   7.562   6.486   7.488
  385    H    PHE  52           H        PHE  52   4.276   8.015   6.638
  386    HA   PHE  52           HA       PHE  52   2.315   8.306   8.825
  387   1HB   PHE  52          2HB       PHE  52   1.711   7.742   5.913
  388   2HB   PHE  52          1HB       PHE  52   0.549   8.081   7.187
  389    HD1  PHE  52           1HD      PHE  52  -0.371  10.175   7.202
  390    HD2  PHE  52           2HD      PHE  52   3.567   9.674   5.666
  391    HE1  PHE  52           1HE      PHE  52  -0.299  12.564   6.610
  392    HE2  PHE  52           2HE      PHE  52   3.646  12.061   5.081
  393    HZ   PHE  52           HZ       PHE  52   1.713  13.508   5.553
  394    H    THR  53           H        THR  53   1.441   6.447   9.668
  395    HA   THR  53           HA       THR  53   2.289   3.925   8.426
  396    HB   THR  53           HB       THR  53   2.045   3.031  10.859
  397    HG1  THR  53           1HG      THR  53   2.640   5.750  11.367
  398   1HG2  THR  53          1HG2      THR  53   4.340   4.547   9.727
  399   2HG2  THR  53          2HG2      THR  53   4.168   2.818  10.044
  400   3HG2  THR  53          3HG2      THR  53   4.416   3.941  11.383
  401    H    VAL  54           H        VAL  54   0.790   2.552   7.868
  402    HA   VAL  54           HA       VAL  54  -1.962   2.992   8.820
  403    HB   VAL  54           HB       VAL  54  -1.036   1.574   6.307
  404   1HG1  VAL  54          1HG1      VAL  54  -3.827   2.303   7.193
  405   2HG1  VAL  54          2HG1      VAL  54  -3.135   0.683   7.253
  406   3HG1  VAL  54          3HG1      VAL  54  -3.377   1.480   5.699
  407   1HG2  VAL  54          1HG2      VAL  54  -2.219   3.549   5.216
  408   2HG2  VAL  54          2HG2      VAL  54  -0.650   3.866   5.958
  409   3HG2  VAL  54          3HG2      VAL  54  -2.131   4.331   6.795
  410    H    THR  55           H        THR  55  -2.342   1.676  10.490
  411    HA   THR  55           HA       THR  55  -1.127  -0.972  10.535
  412    HB   THR  55           HB       THR  55  -2.794   0.289  12.704
  413    HG1  THR  55           1HG      THR  55  -0.775   0.917  13.584
  414   1HG2  THR  55          1HG2      THR  55  -1.253  -1.154  14.117
  415   2HG2  THR  55          2HG2      THR  55  -0.854  -1.992  12.616
  416   3HG2  THR  55          3HG2      THR  55  -2.517  -1.977  13.206
  417    H    GLU  56           H        GLU  56  -2.187  -2.499   9.486
  418    HA   GLU  56           HA       GLU  56  -4.841  -2.551   8.744
  419   1HB   GLU  56          2HB       GLU  56  -3.219  -4.060   7.774
  420   2HB   GLU  56          1HB       GLU  56  -2.963  -4.845   9.328
  421   1HG   GLU  56          2HG       GLU  56  -4.331  -6.201   7.838
  422   2HG   GLU  56          1HG       GLU  56  -5.213  -5.729   9.290
  423   1H    MET   1          1HT       MET   1   5.885  18.283  -2.634
  424   2H    MET   1          2HT       MET   1   6.280  19.678  -1.763
  425   3H    MET   1          3HT       MET   1   5.109  18.613  -1.168
  426    HA   MET   1           HA       MET   1   8.025  18.166  -1.390
  427   1HB   MET   1          2HB       MET   1   7.189  19.431   0.561
  428   2HB   MET   1          1HB       MET   1   6.095  18.112   0.946
  429   1HG   MET   1          2HG       MET   1   7.977  16.642   1.363
  430   2HG   MET   1          1HG       MET   1   9.099  17.926   0.916
  431   1HE   MET   1          1HE       MET   1   9.251  16.281   3.666
  432   2HE   MET   1          2HE       MET   1   9.614  17.589   4.792
  433   3HE   MET   1          3HE       MET   1  10.392  17.547   3.210
  434    H    GLN   2           H        GLN   2   8.692  16.058  -0.411
  435    HA   GLN   2           HA       GLN   2   6.899  13.929  -1.343
  436   1HB   GLN   2          2HB       GLN   2   9.112  13.986  -2.403
  437   2HB   GLN   2          1HB       GLN   2   9.880  13.877  -0.825
  438   1HG   GLN   2          2HG       GLN   2   8.900  11.670  -0.494
  439   2HG   GLN   2          1HG       GLN   2   8.114  11.779  -2.066
  440   1HE2  GLN   2          1HE2      GLN   2  11.024  13.273  -2.434
  441   2HE2  GLN   2          2HE2      GLN   2  11.963  11.936  -2.990
  442    H    TYR   3           H        TYR   3   6.220  12.325   0.018
  443    HA   TYR   3           HA       TYR   3   7.160  12.485   2.805
  444   1HB   TYR   3          2HB       TYR   3   4.336  11.998   1.838
  445   2HB   TYR   3          1HB       TYR   3   4.861  11.884   3.516
  446    HD1  TYR   3           1HD      TYR   3   4.611  13.742   4.871
  447    HD2  TYR   3           2HD      TYR   3   4.908  14.299   0.664
  448    HE1  TYR   3           1HE      TYR   3   4.209  16.149   5.167
  449    HE2  TYR   3           2HE      TYR   3   4.509  16.710   0.949
  450    HH   TYR   3           HH       TYR   3   4.728  18.274   3.883
  451    H    LYS   4           H        LYS   4   7.351  10.580   3.954
  452    HA   LYS   4           HA       LYS   4   7.540   8.178   2.285
  453   1HB   LYS   4          2HB       LYS   4   9.458   9.081   3.742
  454   2HB   LYS   4          1HB       LYS   4   8.535   8.484   5.112
  455   1HG   LYS   4          2HG       LYS   4   9.558   6.821   2.821
  456   2HG   LYS   4          1HG       LYS   4  10.268   6.917   4.431
  457   1HD   LYS   4          2HD       LYS   4   8.115   6.059   5.353
  458   2HD   LYS   4          1HD       LYS   4   7.556   5.824   3.695
  459   1HE   LYS   4          2HE       LYS   4   8.414   3.738   4.564
  460   2HE   LYS   4          1HE       LYS   4   9.472   4.335   3.287
  461   1HZ   LYS   4          1HZ       LYS   4   9.967   4.655   6.198
  462   2HZ   LYS   4          2HZ       LYS   4  10.996   5.153   4.952
  463   3HZ   LYS   4          3HZ       LYS   4  10.712   3.505   5.205
  464    H    VAL   5           H        VAL   5   5.689   7.039   2.256
  465    HA   VAL   5           HA       VAL   5   4.051   6.922   4.673
  466    HB   VAL   5           HB       VAL   5   3.440   5.938   1.883
  467   1HG1  VAL   5          1HG1      VAL   5   2.217   4.694   3.586
  468   2HG1  VAL   5          2HG1      VAL   5   1.131   5.746   2.677
  469   3HG1  VAL   5          3HG1      VAL   5   1.653   6.205   4.298
  470   1HG2  VAL   5          1HG2      VAL   5   1.719   7.969   2.328
  471   2HG2  VAL   5          2HG2      VAL   5   3.268   8.154   1.504
  472   3HG2  VAL   5          3HG2      VAL   5   3.128   8.543   3.219
  473    H    ILE   6           H        ILE   6   4.110   5.243   5.985
  474    HA   ILE   6           HA       ILE   6   5.362   2.752   5.065
  475    HB   ILE   6           HB       ILE   6   4.967   3.860   7.850
  476   1HG1  ILE   6          2HG1      ILE   6   7.468   3.379   6.223
  477   2HG1  ILE   6          1HG1      ILE   6   6.740   4.950   6.537
  478   1HG2  ILE   6          1HG2      ILE   6   5.091   1.191   7.191
  479   2HG2  ILE   6          2HG2      ILE   6   5.465   1.900   8.763
  480   3HG2  ILE   6          3HG2      ILE   6   6.759   1.589   7.604
  481   1HD1  ILE   6          1HD1      ILE   6   7.114   4.541   8.971
  482   2HD1  ILE   6          2HD1      ILE   6   8.586   4.681   8.009
  483   3HD1  ILE   6          3HD1      ILE   6   8.018   3.094   8.526
  484    H    LEU   7           H        LEU   7   4.110   0.997   4.796
  485    HA   LEU   7           HA       LEU   7   1.378   1.062   5.897
  486   1HB   LEU   7          2HB       LEU   7   2.288  -0.747   3.677
  487   2HB   LEU   7          1HB       LEU   7   0.666  -0.190   4.047
  488    HG   LEU   7           HG       LEU   7   2.881   1.506   2.906
  489   1HD1  LEU   7          1HD1      LEU   7   1.474   1.537   0.893
  490   2HD1  LEU   7          2HD1      LEU   7   0.375   0.387   1.658
  491   3HD1  LEU   7          3HD1      LEU   7   2.033  -0.087   1.293
  492   1HD2  LEU   7          1HD2      LEU   7   1.426   2.808   4.343
  493   2HD2  LEU   7          2HD2      LEU   7   0.003   2.162   3.526
  494   3HD2  LEU   7          3HD2      LEU   7   1.126   3.206   2.652
  495    H    ASN   8           H        ASN   8   1.422   0.012   7.823
  496    HA   ASN   8           HA       ASN   8   2.813  -2.577   7.968
  497   1HB   ASN   8          2HB       ASN   8   1.976  -0.698  10.177
  498   2HB   ASN   8          1HB       ASN   8   2.708  -2.279  10.436
  499   1HD2  ASN   8          1HD2      ASN   8   4.777  -2.192  10.864
  500   2HD2  ASN   8          2HD2      ASN   8   5.896  -1.020  10.264
  501    H    GLY   9           H        GLY   9   1.445  -4.227   7.565
  502   1HA   GLY   9          2HA       GLY   9  -1.247  -4.062   8.760
  503   2HA   GLY   9          1HA       GLY   9  -0.864  -4.983   7.317
  504    H    LYS  10           H        LYS  10  -2.064  -6.613   8.672
  505    HA   LYS  10           HA       LYS  10  -0.764  -7.755  10.936
  506   1HB   LYS  10          2HB       LYS  10  -2.899  -8.879   9.113
  507   2HB   LYS  10          1HB       LYS  10  -2.390  -9.608  10.629
  508   1HG   LYS  10          2HG       LYS  10  -3.622  -6.876  10.344
  509   2HG   LYS  10          1HG       LYS  10  -4.470  -8.337  10.854
  510   1HD   LYS  10          2HD       LYS  10  -2.948  -8.526  12.777
  511   2HD   LYS  10          1HD       LYS  10  -2.149  -7.037  12.274
  512   1HE   LYS  10          2HE       LYS  10  -4.236  -5.809  12.559
  513   2HE   LYS  10          1HE       LYS  10  -5.057  -7.297  13.026
  514   1HZ   LYS  10          1HZ       LYS  10  -4.021  -5.600  14.775
  515   2HZ   LYS  10          2HZ       LYS  10  -2.679  -6.604  14.552
  516   3HZ   LYS  10          3HZ       LYS  10  -4.148  -7.261  15.074
  517    H    THR  11           H        THR  11  -1.199  -8.924   7.591
  518    HA   THR  11           HA       THR  11   1.147 -10.649   7.961
  519    HB   THR  11           HB       THR  11   0.028 -11.820   5.917
  520    HG1  THR  11           1HG      THR  11  -2.245 -11.564   5.959
  521   1HG2  THR  11          1HG2      THR  11  -0.518 -13.402   7.359
  522   2HG2  THR  11          2HG2      THR  11  -1.817 -12.411   8.023
  523   3HG2  THR  11          3HG2      THR  11  -0.179 -12.262   8.662
  524    H    LEU  12           H        LEU  12   0.646  -7.743   6.872
  525    HA   LEU  12           HA       LEU  12   2.439  -8.092   4.591
  526   1HB   LEU  12          2HB       LEU  12   0.220  -7.917   3.647
  527   2HB   LEU  12          1HB       LEU  12  -0.095  -6.465   4.575
  528    HG   LEU  12           HG       LEU  12   1.516  -5.226   3.280
  529   1HD1  LEU  12          1HD1      LEU  12   2.407  -7.891   2.589
  530   2HD1  LEU  12          2HD1      LEU  12   3.273  -6.364   2.519
  531   3HD1  LEU  12          3HD1      LEU  12   2.240  -6.855   1.174
  532   1HD2  LEU  12          1HD2      LEU  12  -0.059  -4.861   1.761
  533   2HD2  LEU  12          2HD2      LEU  12  -0.852  -6.357   2.253
  534   3HD2  LEU  12          3HD2      LEU  12   0.331  -6.375   0.945
  535    H    LYS  13           H        LYS  13   3.959  -6.541   4.352
  536    HA   LYS  13           HA       LYS  13   3.786  -4.087   5.927
  537   1HB   LYS  13          2HB       LYS  13   6.146  -5.969   6.136
  538   2HB   LYS  13          1HB       LYS  13   5.986  -4.409   6.931
  539   1HG   LYS  13          2HG       LYS  13   4.109  -5.257   8.237
  540   2HG   LYS  13          1HG       LYS  13   4.249  -6.818   7.427
  541   1HD   LYS  13          2HD       LYS  13   6.524  -7.062   8.328
  542   2HD   LYS  13          1HD       LYS  13   6.346  -5.519   9.166
  543   1HE   LYS  13          2HE       LYS  13   4.660  -7.981   9.604
  544   2HE   LYS  13          1HE       LYS  13   5.937  -7.399  10.672
  545   1HZ   LYS  13          1HZ       LYS  13   3.460  -5.901  10.004
  546   2HZ   LYS  13          2HZ       LYS  13   4.666  -5.405  11.082
  547   3HZ   LYS  13          3HZ       LYS  13   3.719  -6.761  11.438
  548    H    GLY  14           H        GLY  14   5.029  -2.377   5.075
  549   1HA   GLY  14          2HA       GLY  14   7.018  -2.747   3.093
  550   2HA   GLY  14          1HA       GLY  14   5.476  -2.408   2.325
  551    H    GLU  15           H        GLU  15   6.947  -0.620   1.554
  552    HA   GLU  15           HA       GLU  15   6.417   1.740   3.194
  553   1HB   GLU  15          2HB       GLU  15   9.120   1.112   1.987
  554   2HB   GLU  15          1HB       GLU  15   8.684   2.616   2.783
  555   1HG   GLU  15          2HG       GLU  15   8.348   1.433   4.879
  556   2HG   GLU  15          1HG       GLU  15   8.731  -0.095   4.087
  557    H    THR  16           H        THR  16   5.853   3.508   2.031
  558    HA   THR  16           HA       THR  16   6.250   3.471  -0.863
  559    HB   THR  16           HB       THR  16   4.091   2.638  -0.869
  560    HG1  THR  16           1HG      THR  16   3.601   5.400  -0.680
  561   1HG2  THR  16          1HG2      THR  16   3.748   4.071   1.683
  562   2HG2  THR  16          2HG2      THR  16   3.205   2.470   1.195
  563   3HG2  THR  16          3HG2      THR  16   2.323   3.900   0.662
  564    H    THR  17           H        THR  17   5.592   5.637  -1.852
  565    HA   THR  17           HA       THR  17   5.931   7.866   0.011
  566    HB   THR  17           HB       THR  17   7.689   8.841  -1.462
  567    HG1  THR  17           1HG      THR  17   8.731   7.392  -2.893
  568   1HG2  THR  17          1HG2      THR  17   9.452   7.798  -0.457
  569   2HG2  THR  17          2HG2      THR  17   8.744   6.193  -0.629
  570   3HG2  THR  17          3HG2      THR  17   8.131   7.298   0.600
  571    H    THR  18           H        THR  18   4.435   9.325  -0.393
  572    HA   THR  18           HA       THR  18   3.348   9.593  -3.124
  573    HB   THR  18           HB       THR  18   1.733   9.078  -1.304
  574    HG1  THR  18           1HG      THR  18   1.161  10.379  -3.150
  575   1HG2  THR  18          1HG2      THR  18   2.593  11.738  -0.205
  576   2HG2  THR  18          2HG2      THR  18   2.670  10.169   0.595
  577   3HG2  THR  18          3HG2      THR  18   1.105  10.905   0.250
  578    H    GLU  19           H        GLU  19   3.457  11.525  -4.184
  579    HA   GLU  19           HA       GLU  19   5.116  13.605  -2.938
  580   1HB   GLU  19          2HB       GLU  19   5.906  12.727  -5.088
  581   2HB   GLU  19          1HB       GLU  19   4.377  13.158  -5.840
  582   1HG   GLU  19          2HG       GLU  19   6.086  14.773  -6.392
  583   2HG   GLU  19          1HG       GLU  19   4.827  15.518  -5.411
  584    H    ALA  20           H        ALA  20   3.944  15.153  -1.941
  585    HA   ALA  20           HA       ALA  20   1.782  16.403  -3.445
  586   1HB   ALA  20          1HB       ALA  20   1.192  15.864  -0.592
  587   2HB   ALA  20          2HB       ALA  20   1.051  14.521  -1.726
  588   3HB   ALA  20          3HB       ALA  20   0.102  15.987  -1.973
  589    H    VAL  21           H        VAL  21   1.315  18.498  -2.850
  590    HA   VAL  21           HA       VAL  21   3.382  20.163  -2.146
  591    HB   VAL  21           HB       VAL  21   0.481  20.795  -1.612
  592   1HG1  VAL  21          1HG1      VAL  21   1.073  23.068  -1.905
  593   2HG1  VAL  21          2HG1      VAL  21   2.681  22.646  -2.493
  594   3HG1  VAL  21          3HG1      VAL  21   2.265  22.381  -0.801
  595   1HG2  VAL  21          1HG2      VAL  21   2.013  20.619  -4.173
  596   2HG2  VAL  21          2HG2      VAL  21   0.687  21.770  -4.007
  597   3HG2  VAL  21          3HG2      VAL  21   0.389  20.042  -3.796
  598    H    ASP  22           H        ASP  22   0.994  18.698  -0.016
  599    HA   ASP  22           HA       ASP  22   2.690  19.348   2.262
  600   1HB   ASP  22          2HB       ASP  22   0.692  20.094   3.600
  601   2HB   ASP  22          1HB       ASP  22   1.200  21.210   2.336
  602    H    ALA  23           H        ALA  23   1.823  18.270   4.309
  603    HA   ALA  23           HA       ALA  23   1.720  15.527   3.928
  604   1HB   ALA  23          1HB       ALA  23   2.051  17.143   6.078
  605   2HB   ALA  23          2HB       ALA  23   1.825  15.396   6.169
  606   3HB   ALA  23          3HB       ALA  23   0.450  16.478   6.398
  607    H    ALA  24           H        ALA  24  -0.926  17.813   4.429
  608    HA   ALA  24           HA       ALA  24  -2.983  15.897   4.632
  609   1HB   ALA  24          1HB       ALA  24  -2.824  18.807   4.191
  610   2HB   ALA  24          2HB       ALA  24  -3.858  17.877   5.277
  611   3HB   ALA  24          3HB       ALA  24  -4.279  18.026   3.570
  612    H    THR  25           H        THR  25  -1.921  17.841   1.813
  613    HA   THR  25           HA       THR  25  -3.584  16.669  -0.074
  614    HB   THR  25           HB       THR  25  -1.769  17.276  -1.717
  615    HG1  THR  25           1HG      THR  25   0.130  17.750  -1.048
  616   1HG2  THR  25          1HG2      THR  25  -2.699  19.329   0.249
  617   2HG2  THR  25          2HG2      THR  25  -3.330  18.983  -1.361
  618   3HG2  THR  25          3HG2      THR  25  -1.747  19.738  -1.179
  619    H    ALA  26           H        ALA  26  -0.402  15.687   1.110
  620    HA   ALA  26           HA       ALA  26  -0.064  13.429  -0.527
  621   1HB   ALA  26          1HB       ALA  26   1.115  14.440   1.977
  622   2HB   ALA  26          2HB       ALA  26   1.897  13.778   0.541
  623   3HB   ALA  26          3HB       ALA  26   1.209  12.694   1.750
  624    H    GLU  27           H        GLU  27  -1.340  13.708   2.807
  625    HA   GLU  27           HA       GLU  27  -2.074  11.102   3.236
  626   1HB   GLU  27          2HB       GLU  27  -2.209  12.852   4.944
  627   2HB   GLU  27          1HB       GLU  27  -3.560  13.583   4.091
  628   1HG   GLU  27          2HG       GLU  27  -4.889  11.577   4.478
  629   2HG   GLU  27          1HG       GLU  27  -3.536  10.848   5.340
  630    H    LYS  28           H        LYS  28  -4.013  13.677   1.720
  631    HA   LYS  28           HA       LYS  28  -6.297  12.135   1.203
  632   1HB   LYS  28          2HB       LYS  28  -5.180  14.480  -0.352
  633   2HB   LYS  28          1HB       LYS  28  -6.804  13.834  -0.534
  634   1HG   LYS  28          2HG       LYS  28  -5.655  15.103   1.941
  635   2HG   LYS  28          1HG       LYS  28  -6.836  15.817   0.841
  636   1HD   LYS  28          2HD       LYS  28  -8.419  14.031   1.392
  637   2HD   LYS  28          1HD       LYS  28  -7.237  13.330   2.500
  638   1HE   LYS  28          2HE       LYS  28  -8.907  14.667   3.690
  639   2HE   LYS  28          1HE       LYS  28  -7.291  15.348   3.859
  640   1HZ   LYS  28          1HZ       LYS  28  -9.182  16.303   1.795
  641   2HZ   LYS  28          2HZ       LYS  28  -7.790  17.069   2.376
  642   3HZ   LYS  28          3HZ       LYS  28  -9.161  16.952   3.359
  643    H    VAL  29           H        VAL  29  -3.402  12.769  -0.718
  644    HA   VAL  29           HA       VAL  29  -4.103  11.396  -3.033
  645    HB   VAL  29           HB       VAL  29  -1.405  11.841  -1.749
  646   1HG1  VAL  29          1HG1      VAL  29  -2.122  10.397  -4.253
  647   2HG1  VAL  29          2HG1      VAL  29  -0.865  10.045  -3.067
  648   3HG1  VAL  29          3HG1      VAL  29  -0.650  11.369  -4.212
  649   1HG2  VAL  29          1HG2      VAL  29  -2.944  13.714  -2.758
  650   2HG2  VAL  29          2HG2      VAL  29  -2.311  13.107  -4.287
  651   3HG2  VAL  29          3HG2      VAL  29  -1.206  13.715  -3.055
  652    H    VAL  30           H        VAL  30  -2.591  10.227  -0.058
  653    HA   VAL  30           HA       VAL  30  -2.216   7.570  -0.968
  654    HB   VAL  30           HB       VAL  30  -2.656   8.435   1.889
  655   1HG1  VAL  30          1HG1      VAL  30  -0.845   6.238   0.978
  656   2HG1  VAL  30          2HG1      VAL  30  -2.579   5.951   1.113
  657   3HG1  VAL  30          3HG1      VAL  30  -1.653   6.447   2.529
  658   1HG2  VAL  30          1HG2      VAL  30   0.114   8.133   1.121
  659   2HG2  VAL  30          2HG2      VAL  30  -0.687   9.473   1.943
  660   3HG2  VAL  30          3HG2      VAL  30  -0.681   9.395   0.181
  661    H    LYS  31           H        LYS  31  -4.774   9.153   0.979
  662    HA   LYS  31           HA       LYS  31  -6.444   7.037   1.458
  663   1HB   LYS  31          2HB       LYS  31  -7.245   9.835   0.637
  664   2HB   LYS  31          1HB       LYS  31  -8.350   8.646   1.305
  665   1HG   LYS  31          2HG       LYS  31  -6.134  10.126   2.652
  666   2HG   LYS  31          1HG       LYS  31  -7.826   9.976   3.119
  667   1HD   LYS  31          2HD       LYS  31  -7.195   7.430   3.318
  668   2HD   LYS  31          1HD       LYS  31  -5.568   8.088   3.492
  669   1HE   LYS  31          2HE       LYS  31  -7.939   8.871   5.180
  670   2HE   LYS  31          1HE       LYS  31  -6.686   7.729   5.664
  671   1HZ   LYS  31          1HZ       LYS  31  -6.104   9.782   6.606
  672   2HZ   LYS  31          2HZ       LYS  31  -6.410  10.634   5.177
  673   3HZ   LYS  31          3HZ       LYS  31  -5.075   9.599   5.275
  674    H    GLN  32           H        GLN  32  -6.311   9.039  -1.445
  675    HA   GLN  32           HA       GLN  32  -8.313   7.624  -2.859
  676   1HB   GLN  32          2HB       GLN  32  -7.867   9.754  -3.698
  677   2HB   GLN  32          1HB       GLN  32  -6.131   9.526  -3.660
  678   1HG   GLN  32          2HG       GLN  32  -7.887   7.973  -5.528
  679   2HG   GLN  32          1HG       GLN  32  -7.313   9.587  -5.925
  680   1HE2  GLN  32          1HE2      GLN  32  -4.855   8.400  -4.149
  681   2HE2  GLN  32          2HE2      GLN  32  -3.914   7.666  -5.391
  682    H    PHE  33           H        PHE  33  -4.863   7.201  -2.504
  683    HA   PHE  33           HA       PHE  33  -4.354   5.353  -4.514
  684   1HB   PHE  33          2HB       PHE  33  -2.662   6.487  -3.049
  685   2HB   PHE  33          1HB       PHE  33  -3.120   5.397  -1.747
  686    HD1  PHE  33           1HD      PHE  33  -1.649   5.553  -5.124
  687    HD2  PHE  33           2HD      PHE  33  -2.193   3.227  -1.590
  688    HE1  PHE  33           1HE      PHE  33  -0.002   3.917  -5.936
  689    HE2  PHE  33           2HE      PHE  33  -0.547   1.593  -2.413
  690    HZ   PHE  33           HZ       PHE  33   0.547   1.943  -4.596
  691    H    PHE  34           H        PHE  34  -5.094   4.684  -1.110
  692    HA   PHE  34           HA       PHE  34  -5.523   1.881  -1.584
  693   1HB   PHE  34          2HB       PHE  34  -6.092   3.562   0.855
  694   2HB   PHE  34          1HB       PHE  34  -6.182   1.801   0.794
  695    HD1  PHE  34           1HD      PHE  34  -3.887   1.031  -0.741
  696    HD2  PHE  34           2HD      PHE  34  -4.265   4.122   2.144
  697    HE1  PHE  34           1HE      PHE  34  -1.474   0.905  -0.299
  698    HE2  PHE  34           2HE      PHE  34  -1.853   3.999   2.605
  699    HZ   PHE  34           HZ       PHE  34  -0.460   2.387   1.372
  700    H    ASN  35           H        ASN  35  -7.615   4.667  -1.057
  701    HA   ASN  35           HA       ASN  35 -10.087   3.466  -0.800
  702   1HB   ASN  35          2HB       ASN  35  -9.752   5.890  -0.683
  703   2HB   ASN  35          1HB       ASN  35  -9.357   5.937  -2.397
  704   1HD2  ASN  35          1HD2      ASN  35 -11.613   6.806  -0.390
  705   2HD2  ASN  35          2HD2      ASN  35 -13.040   6.558  -1.330
  706    H    ASP  36           H        ASP  36  -8.144   4.011  -3.639
  707    HA   ASP  36           HA       ASP  36 -10.129   2.785  -5.392
  708   1HB   ASP  36          2HB       ASP  36  -7.508   4.137  -6.029
  709   2HB   ASP  36          1HB       ASP  36  -8.612   3.478  -7.231
  710    H    ASN  37           H        ASN  37  -7.107   1.939  -3.858
  711    HA   ASN  37           HA       ASN  37  -6.532  -0.223  -5.682
  712   1HB   ASN  37          2HB       ASN  37  -5.423   0.470  -2.954
  713   2HB   ASN  37          1HB       ASN  37  -4.916  -0.952  -3.859
  714   1HD2  ASN  37          1HD2      ASN  37  -3.557   1.596  -2.962
  715   2HD2  ASN  37          2HD2      ASN  37  -2.796   2.187  -4.398
  716    H    GLY  38           H        GLY  38  -7.911   0.172  -2.500
  717   1HA   GLY  38          2HA       GLY  38  -8.459  -1.811  -1.123
  718   2HA   GLY  38          1HA       GLY  38  -9.868  -1.091  -1.864
  719    H    VAL  39           H        VAL  39 -11.220  -2.490  -2.644
  720    HA   VAL  39           HA       VAL  39 -10.433  -5.212  -3.030
  721    HB   VAL  39           HB       VAL  39 -13.127  -3.919  -3.284
  722   1HG1  VAL  39          1HG1      VAL  39 -13.895  -6.336  -2.937
  723   2HG1  VAL  39          2HG1      VAL  39 -12.264  -6.792  -3.422
  724   3HG1  VAL  39          3HG1      VAL  39 -13.297  -5.896  -4.536
  725   1HG2  VAL  39          1HG2      VAL  39 -13.081  -5.593  -1.077
  726   2HG2  VAL  39          2HG2      VAL  39 -13.012  -3.831  -1.064
  727   3HG2  VAL  39          3HG2      VAL  39 -11.521  -4.772  -1.033
  728    H    ASP  40           H        ASP  40 -12.115  -2.929  -5.274
  729    HA   ASP  40           HA       ASP  40 -11.707  -4.849  -7.392
  730   1HB   ASP  40          2HB       ASP  40 -13.079  -2.162  -7.372
  731   2HB   ASP  40          1HB       ASP  40 -13.035  -3.256  -8.751
  732    H    GLY  41           H        GLY  41  -9.319  -3.387  -6.308
  733   1HA   GLY  41          2HA       GLY  41  -8.518  -1.482  -8.270
  734   2HA   GLY  41          1HA       GLY  41  -7.456  -2.305  -7.137
  735    H    GLU  42           H        GLU  42  -6.846  -1.726  -9.881
  736    HA   GLU  42           HA       GLU  42  -7.066  -4.256 -11.304
  737   1HB   GLU  42          2HB       GLU  42  -5.660  -1.686 -12.062
  738   2HB   GLU  42          1HB       GLU  42  -5.859  -3.082 -13.112
  739   1HG   GLU  42          2HG       GLU  42  -8.285  -2.798 -13.028
  740   2HG   GLU  42          1HG       GLU  42  -8.081  -1.394 -11.981
  741    H    TRP  43           H        TRP  43  -5.800  -5.776 -10.314
  742    HA   TRP  43           HA       TRP  43  -3.019  -5.069  -9.704
  743   1HB   TRP  43          2HB       TRP  43  -4.609  -7.495  -8.870
  744   2HB   TRP  43          1HB       TRP  43  -2.988  -7.083  -8.330
  745    HD1  TRP  43           HD       TRP  43  -5.776  -4.441  -8.455
  746    HE1  TRP  43           1HE      TRP  43  -6.315  -3.718  -6.046
  747    HE3  TRP  43           3HE      TRP  43  -2.882  -7.812  -5.972
  748    HZ2  TRP  43           2HZ      TRP  43  -5.592  -4.494  -3.430
  749    HZ3  TRP  43           3HZ      TRP  43  -2.848  -7.757  -3.523
  750    HH2  TRP  43           HH       TRP  43  -4.178  -6.132  -2.272
  751    H    THR  44           H        THR  44  -1.407  -5.765 -10.931
  752    HA   THR  44           HA       THR  44  -1.878  -8.037 -12.742
  753    HB   THR  44           HB       THR  44   0.024  -7.130 -14.064
  754    HG1  THR  44           1HG      THR  44   0.940  -5.964 -12.237
  755   1HG2  THR  44          1HG2      THR  44  -1.531  -4.699 -13.995
  756   2HG2  THR  44          2HG2      THR  44  -2.550  -6.138 -14.025
  757   3HG2  THR  44          3HG2      THR  44  -1.341  -5.887 -15.284
  758    H    TYR  45           H        TYR  45  -0.506  -9.800 -12.627
  759    HA   TYR  45           HA       TYR  45   1.467  -9.717 -10.442
  760   1HB   TYR  45          2HB       TYR  45  -0.480 -11.235 -10.110
  761   2HB   TYR  45          1HB       TYR  45   0.016 -12.132 -11.539
  762    HD1  TYR  45           1HD      TYR  45   2.321 -10.752  -8.995
  763    HD2  TYR  45           2HD      TYR  45   0.414 -14.236 -10.520
  764    HE1  TYR  45           1HE      TYR  45   3.779 -12.154  -7.597
  765    HE2  TYR  45           2HE      TYR  45   1.866 -15.647  -9.127
  766    HH   TYR  45           HH       TYR  45   3.910 -15.599  -7.952
  767    H    ASP  46           H        ASP  46   3.504 -10.540 -10.727
  768    HA   ASP  46           HA       ASP  46   4.226 -11.368 -13.458
  769   1HB   ASP  46          2HB       ASP  46   5.019  -9.083 -13.015
  770   2HB   ASP  46          1HB       ASP  46   5.859  -9.648 -11.575
  771    H    ASP  47           H        ASP  47   4.029 -13.560 -12.786
  772    HA   ASP  47           HA       ASP  47   5.112 -14.809 -10.606
  773   1HB   ASP  47          2HB       ASP  47   5.073 -15.892 -13.431
  774   2HB   ASP  47          1HB       ASP  47   5.218 -16.853 -11.962
  775    H    ALA  48           H        ALA  48   6.789 -13.779 -13.518
  776    HA   ALA  48           HA       ALA  48   9.171 -15.116 -13.330
  777   1HB   ALA  48          1HB       ALA  48   8.615 -13.658 -15.188
  778   2HB   ALA  48          2HB       ALA  48  10.189 -13.230 -14.515
  779   3HB   ALA  48          3HB       ALA  48   8.774 -12.243 -14.146
  780    H    THR  49           H        THR  49   8.102 -12.400 -11.373
  781    HA   THR  49           HA       THR  49  10.571 -12.685  -9.793
  782    HB   THR  49           HB       THR  49  10.497 -10.262  -9.329
  783    HG1  THR  49           1HG      THR  49   8.451 -10.213 -11.292
  784   1HG2  THR  49          1HG2      THR  49  11.139 -11.421 -11.866
  785   2HG2  THR  49          2HG2      THR  49  11.918 -10.091 -11.010
  786   3HG2  THR  49          3HG2      THR  49  10.552  -9.772 -12.079
  787    H    LYS  50           H        LYS  50   7.562 -13.531  -9.628
  788    HA   LYS  50           HA       LYS  50   5.947 -13.746  -8.009
  789   1HB   LYS  50          2HB       LYS  50   8.460 -13.595  -6.343
  790   2HB   LYS  50          1HB       LYS  50   6.885 -13.968  -5.662
  791   1HG   LYS  50          2HG       LYS  50   8.250 -15.570  -7.815
  792   2HG   LYS  50          1HG       LYS  50   8.259 -15.964  -6.094
  793   1HD   LYS  50          2HD       LYS  50   5.750 -16.006  -6.192
  794   2HD   LYS  50          1HD       LYS  50   5.882 -15.860  -7.945
  795   1HE   LYS  50          2HE       LYS  50   7.218 -17.930  -7.990
  796   2HE   LYS  50          1HE       LYS  50   7.016 -18.079  -6.243
  797   1HZ   LYS  50          1HZ       LYS  50   4.487 -17.870  -6.977
  798   2HZ   LYS  50          2HZ       LYS  50   5.289 -19.356  -6.889
  799   3HZ   LYS  50          3HZ       LYS  50   5.106 -18.584  -8.382
  800    H    THR  51           H        THR  51   6.470 -11.054  -8.940
  801    HA   THR  51           HA       THR  51   5.863  -9.515  -6.513
  802    HB   THR  51           HB       THR  51   7.058  -8.596  -9.130
  803    HG1  THR  51           1HG      THR  51   8.451  -9.746  -7.667
  804   1HG2  THR  51          1HG2      THR  51   5.835  -7.077  -6.982
  805   2HG2  THR  51          2HG2      THR  51   6.324  -6.572  -8.600
  806   3HG2  THR  51          3HG2      THR  51   7.507  -6.616  -7.293
  807    H    PHE  52           H        PHE  52   4.174  -8.066  -6.489
  808    HA   PHE  52           HA       PHE  52   2.236  -8.309  -8.703
  809   1HB   PHE  52          2HB       PHE  52   1.607  -7.729  -5.800
  810   2HB   PHE  52          1HB       PHE  52   0.454  -8.039  -7.091
  811    HD1  PHE  52           1HD      PHE  52  -0.516 -10.112  -7.119
  812    HD2  PHE  52           2HD      PHE  52   3.410  -9.706  -5.528
  813    HE1  PHE  52           1HE      PHE  52  -0.512 -12.502  -6.527
  814    HE2  PHE  52           2HE      PHE  52   3.422 -12.094  -4.942
  815    HZ   PHE  52           HZ       PHE  52   1.461 -13.495  -5.442
  816    H    THR  53           H        THR  53   1.419  -6.429  -9.559
  817    HA   THR  53           HA       THR  53   2.312  -3.928  -8.305
  818    HB   THR  53           HB       THR  53   2.124  -3.029 -10.740
  819    HG1  THR  53           1HG      THR  53   2.659  -5.762 -11.240
  820   1HG2  THR  53          1HG2      THR  53   4.365  -4.600  -9.576
  821   2HG2  THR  53          2HG2      THR  53   4.239  -2.868  -9.894
  822   3HG2  THR  53          3HG2      THR  53   4.481  -3.997 -11.229
  823    H    VAL  54           H        VAL  54   0.838  -2.521  -7.768
  824    HA   VAL  54           HA       VAL  54  -1.909  -2.893  -8.758
  825    HB   VAL  54           HB       VAL  54  -0.986  -1.497  -6.232
  826   1HG1  VAL  54          1HG1      VAL  54  -3.780  -2.158  -7.157
  827   2HG1  VAL  54          2HG1      VAL  54  -3.047  -0.555  -7.207
  828   3HG1  VAL  54          3HG1      VAL  54  -3.333  -1.346  -5.657
  829   1HG2  VAL  54          1HG2      VAL  54  -2.230  -3.442  -5.159
  830   2HG2  VAL  54          2HG2      VAL  54  -0.660  -3.797  -5.877
  831   3HG2  VAL  54          3HG2      VAL  54  -2.139  -4.225  -6.735
  832    H    THR  55           H        THR  55  -2.234  -1.567 -10.433
  833    HA   THR  55           HA       THR  55  -0.954   1.050 -10.461
  834    HB   THR  55           HB       THR  55  -2.621  -0.171 -12.653
  835    HG1  THR  55           1HG      THR  55  -0.605  -0.849 -13.504
  836   1HG2  THR  55          1HG2      THR  55  -1.024   1.234 -14.044
  837   2HG2  THR  55          2HG2      THR  55  -0.628   2.063 -12.537
  838   3HG2  THR  55          3HG2      THR  55  -2.283   2.088 -13.149
  839    H    GLU  56           H        GLU  56  -1.990   2.602  -9.426
  840    HA   GLU  56           HA       GLU  56  -4.654   2.720  -8.721
  841   1HB   GLU  56          2HB       GLU  56  -3.011   4.188  -7.730
  842   2HB   GLU  56          1HB       GLU  56  -2.711   4.966  -9.278
  843   1HG   GLU  56          2HG       GLU  56  -4.068   6.355  -7.808
  844   2HG   GLU  56          1HG       GLU  56  -4.941   5.906  -9.273
  Start of MODEL   23
    1   1H    MET   1          1HT       MET   1   7.099 -19.745   2.392
    2   2H    MET   1          2HT       MET   1   5.511 -19.279   2.052
    3   3H    MET   1          3HT       MET   1   6.435 -18.385   3.148
    4    HA   MET   1           HA       MET   1   8.036 -18.078   1.168
    5   1HB   MET   1          2HB       MET   1   5.404 -18.807  -0.124
    6   2HB   MET   1          1HB       MET   1   6.700 -17.974  -0.969
    7   1HG   MET   1          2HG       MET   1   8.177 -19.861  -0.614
    8   2HG   MET   1          1HG       MET   1   6.920 -20.695   0.297
    9   1HE   MET   1          1HE       MET   1   7.992 -19.349  -3.272
   10   2HE   MET   1          2HE       MET   1   6.501 -18.486  -2.889
   11   3HE   MET   1          3HE       MET   1   6.521 -19.681  -4.187
   12    H    GLN   2           H        GLN   2   8.221 -15.953   0.645
   13    HA   GLN   2           HA       GLN   2   6.025 -14.185   1.488
   14   1HB   GLN   2          2HB       GLN   2   8.039 -13.978   2.878
   15   2HB   GLN   2          1HB       GLN   2   9.001 -13.646   1.444
   16   1HG   GLN   2          2HG       GLN   2   7.729 -11.600   1.061
   17   2HG   GLN   2          1HG       GLN   2   6.761 -11.931   2.493
   18   1HE2  GLN   2          1HE2      GLN   2   9.789 -12.986   3.229
   19   2HE2  GLN   2          2HE2      GLN   2  10.417 -11.562   3.971
   20    H    TYR   3           H        TYR   3   5.709 -12.232   0.252
   21    HA   TYR   3           HA       TYR   3   6.864 -12.296  -2.449
   22   1HB   TYR   3          2HB       TYR   3   3.932 -11.922  -1.805
   23   2HB   TYR   3          1HB       TYR   3   4.650 -11.777  -3.406
   24    HD1  TYR   3           1HD      TYR   3   4.631 -13.625  -4.797
   25    HD2  TYR   3           2HD      TYR   3   4.382 -14.216  -0.594
   26    HE1  TYR   3           1HE      TYR   3   4.313 -16.034  -5.162
   27    HE2  TYR   3           2HE      TYR   3   4.066 -16.631  -0.946
   28    HH   TYR   3           HH       TYR   3   4.512 -18.317  -2.634
   29    H    LYS   4           H        LYS   4   7.011 -10.287  -3.504
   30    HA   LYS   4           HA       LYS   4   6.761  -7.988  -1.681
   31   1HB   LYS   4          2HB       LYS   4   9.047  -8.425  -2.413
   32   2HB   LYS   4          1HB       LYS   4   8.545  -8.358  -4.096
   33   1HG   LYS   4          2HG       LYS   4   7.910  -5.999  -3.786
   34   2HG   LYS   4          1HG       LYS   4   8.487  -6.082  -2.123
   35   1HD   LYS   4          2HD       LYS   4  10.209  -6.633  -4.536
   36   2HD   LYS   4          1HD       LYS   4  10.099  -5.062  -3.744
   37   1HE   LYS   4          2HE       LYS   4  12.034  -6.116  -2.879
   38   2HE   LYS   4          1HE       LYS   4  10.807  -6.211  -1.616
   39   1HZ   LYS   4          1HZ       LYS   4  12.267  -8.289  -2.591
   40   2HZ   LYS   4          2HZ       LYS   4  10.772  -8.483  -3.356
   41   3HZ   LYS   4          3HZ       LYS   4  10.857  -8.419  -1.667
   42    H    VAL   5           H        VAL   5   4.969  -6.868  -2.048
   43    HA   VAL   5           HA       VAL   5   3.864  -6.772  -4.746
   44    HB   VAL   5           HB       VAL   5   2.693  -5.737  -2.162
   45   1HG1  VAL   5          1HG1      VAL   5   1.647  -4.519  -3.853
   46   2HG1  VAL   5          2HG1      VAL   5   0.557  -5.879  -3.585
   47   3HG1  VAL   5          3HG1      VAL   5   1.651  -5.884  -4.968
   48   1HG2  VAL   5          1HG2      VAL   5   2.674  -8.382  -3.467
   49   2HG2  VAL   5          2HG2      VAL   5   1.122  -7.805  -2.856
   50   3HG2  VAL   5          3HG2      VAL   5   2.500  -7.952  -1.765
   51    H    ILE   6           H        ILE   6   3.797  -5.030  -5.981
   52    HA   ILE   6           HA       ILE   6   5.105  -2.591  -5.008
   53    HB   ILE   6           HB       ILE   6   4.705  -3.645  -7.811
   54   1HG1  ILE   6          2HG1      ILE   6   7.204  -3.109  -6.191
   55   2HG1  ILE   6          1HG1      ILE   6   6.506  -4.694  -6.496
   56   1HG2  ILE   6          1HG2      ILE   6   6.383  -1.536  -8.104
   57   2HG2  ILE   6          2HG2      ILE   6   5.292  -0.932  -6.856
   58   3HG2  ILE   6          3HG2      ILE   6   4.646  -1.481  -8.403
   59   1HD1  ILE   6          1HD1      ILE   6   6.854  -4.279  -8.934
   60   2HD1  ILE   6          2HD1      ILE   6   8.332  -4.404  -7.980
   61   3HD1  ILE   6          3HD1      ILE   6   7.743  -2.823  -8.491
   62    H    LEU   7           H        LEU   7   3.805  -1.005  -4.472
   63    HA   LEU   7           HA       LEU   7   1.102  -0.892  -5.577
   64   1HB   LEU   7          2HB       LEU   7   2.192   0.929  -3.446
   65   2HB   LEU   7          1HB       LEU   7   0.528   0.456  -3.738
   66    HG   LEU   7           HG       LEU   7   2.707  -1.249  -2.558
   67   1HD1  LEU   7          1HD1      LEU   7   1.329  -1.252  -0.588
   68   2HD1  LEU   7          2HD1      LEU   7   0.084  -0.312  -1.412
   69   3HD1  LEU   7          3HD1      LEU   7   1.654   0.412  -1.070
   70   1HD2  LEU   7          1HD2      LEU   7   1.293  -2.547  -4.099
   71   2HD2  LEU   7          2HD2      LEU   7  -0.134  -2.022  -3.207
   72   3HD2  LEU   7          3HD2      LEU   7   1.078  -3.031  -2.417
   73    H    ASN   8           H        ASN   8   1.683  -0.184  -7.665
   74    HA   ASN   8           HA       ASN   8   3.013   2.392  -7.935
   75   1HB   ASN   8          2HB       ASN   8   3.672   0.466  -9.351
   76   2HB   ASN   8          1HB       ASN   8   2.057   0.459 -10.050
   77   1HD2  ASN   8          1HD2      ASN   8   5.041   1.199 -10.771
   78   2HD2  ASN   8          2HD2      ASN   8   4.825   2.584 -11.781
   79    H    GLY   9           H        GLY   9   1.701   4.123  -7.667
   80   1HA   GLY   9          2HA       GLY   9  -0.914   4.051  -9.048
   81   2HA   GLY   9          1HA       GLY   9  -0.621   4.953  -7.571
   82    H    LYS  10           H        LYS  10  -1.568   6.685  -8.896
   83    HA   LYS  10           HA       LYS  10   0.002   7.752 -11.040
   84   1HB   LYS  10          2HB       LYS  10  -2.334   8.911  -9.512
   85   2HB   LYS  10          1HB       LYS  10  -1.603   9.654 -10.925
   86   1HG   LYS  10          2HG       LYS  10  -2.735   6.883 -10.976
   87   2HG   LYS  10          1HG       LYS  10  -3.714   8.310 -11.296
   88   1HD   LYS  10          2HD       LYS  10  -1.163   7.854 -12.791
   89   2HD   LYS  10          1HD       LYS  10  -2.638   7.012 -13.272
   90   1HE   LYS  10          2HE       LYS  10  -2.458   9.015 -14.569
   91   2HE   LYS  10          1HE       LYS  10  -3.777   9.209 -13.416
   92   1HZ   LYS  10          1HZ       LYS  10  -2.604  10.736 -12.192
   93   2HZ   LYS  10          2HZ       LYS  10  -2.062  11.102 -13.751
   94   3HZ   LYS  10          3HZ       LYS  10  -1.092  10.182 -12.716
   95    H    THR  11           H        THR  11  -0.884   8.980  -7.816
   96    HA   THR  11           HA       THR  11   1.477  10.709  -7.856
   97    HB   THR  11           HB       THR  11   0.182  11.705  -5.824
   98    HG1  THR  11           1HG      THR  11  -1.965  10.493  -7.205
   99   1HG2  THR  11          1HG2      THR  11  -1.546  12.483  -7.925
  100   2HG2  THR  11          2HG2      THR  11   0.074  12.278  -8.592
  101   3HG2  THR  11          3HG2      THR  11  -0.188  13.367  -7.230
  102    H    LEU  12           H        LEU  12   0.784   7.723  -6.875
  103    HA   LEU  12           HA       LEU  12   2.538   7.953  -4.550
  104   1HB   LEU  12          2HB       LEU  12   0.263   7.815  -3.698
  105   2HB   LEU  12          1HB       LEU  12  -0.023   6.365  -4.639
  106    HG   LEU  12           HG       LEU  12   1.484   5.101  -3.284
  107   1HD1  LEU  12          1HD1      LEU  12   2.511   7.722  -2.646
  108   2HD1  LEU  12          2HD1      LEU  12   3.283   6.150  -2.511
  109   3HD1  LEU  12          3HD1      LEU  12   2.262   6.748  -1.202
  110   1HD2  LEU  12          1HD2      LEU  12   0.275   6.471  -1.031
  111   2HD2  LEU  12          2HD2      LEU  12  -0.008   4.846  -1.649
  112   3HD2  LEU  12          3HD2      LEU  12  -0.864   6.218  -2.352
  113    H    LYS  13           H        LYS  13   4.047   6.416  -4.375
  114    HA   LYS  13           HA       LYS  13   3.842   3.964  -5.938
  115   1HB   LYS  13          2HB       LYS  13   6.172   5.878  -6.206
  116   2HB   LYS  13          1HB       LYS  13   6.076   4.278  -6.928
  117   1HG   LYS  13          2HG       LYS  13   4.191   4.989  -8.294
  118   2HG   LYS  13          1HG       LYS  13   4.244   6.586  -7.547
  119   1HD   LYS  13          2HD       LYS  13   5.339   6.604  -9.726
  120   2HD   LYS  13          1HD       LYS  13   6.494   6.933  -8.435
  121   1HE   LYS  13          2HE       LYS  13   7.425   5.389 -10.082
  122   2HE   LYS  13          1HE       LYS  13   7.251   4.616  -8.507
  123   1HZ   LYS  13          1HZ       LYS  13   6.346   3.627 -10.865
  124   2HZ   LYS  13          2HZ       LYS  13   4.945   4.284 -10.181
  125   3HZ   LYS  13          3HZ       LYS  13   5.836   3.126  -9.330
  126    H    GLY  14           H        GLY  14   5.083   2.258  -5.094
  127   1HA   GLY  14          2HA       GLY  14   7.116   2.577  -3.174
  128   2HA   GLY  14          1HA       GLY  14   5.589   2.355  -2.339
  129    H    GLU  15           H        GLU  15   6.869   0.491  -1.524
  130    HA   GLU  15           HA       GLU  15   6.162  -1.865  -3.084
  131   1HB   GLU  15          2HB       GLU  15   8.943  -1.385  -1.996
  132   2HB   GLU  15          1HB       GLU  15   8.376  -2.896  -2.690
  133   1HG   GLU  15          2HG       GLU  15   8.009  -1.767  -4.831
  134   2HG   GLU  15          1HG       GLU  15   8.604  -0.263  -4.130
  135    H    THR  16           H        THR  16   5.509  -3.540  -1.867
  136    HA   THR  16           HA       THR  16   5.928  -3.423   1.030
  137    HB   THR  16           HB       THR  16   3.772  -2.569   0.971
  138    HG1  THR  16           1HG      THR  16   3.266  -5.330   0.909
  139   1HG2  THR  16          1HG2      THR  16   3.463  -4.110  -1.517
  140   2HG2  THR  16          2HG2      THR  16   2.901  -2.494  -1.100
  141   3HG2  THR  16          3HG2      THR  16   2.023  -3.908  -0.524
  142    H    THR  17           H        THR  17   5.235  -5.554   2.095
  143    HA   THR  17           HA       THR  17   5.560  -7.836   0.297
  144    HB   THR  17           HB       THR  17   7.302  -8.806   1.780
  145    HG1  THR  17           1HG      THR  17   7.397  -7.823   3.637
  146   1HG2  THR  17          1HG2      THR  17   9.170  -7.359   1.089
  147   2HG2  THR  17          2HG2      THR  17   7.999  -6.165   0.527
  148   3HG2  THR  17          3HG2      THR  17   8.072  -7.757  -0.232
  149    H    THR  18           H        THR  18   4.015  -9.216   0.705
  150    HA   THR  18           HA       THR  18   2.946  -9.489   3.443
  151    HB   THR  18           HB       THR  18   1.315  -8.905   1.668
  152    HG1  THR  18           1HG      THR  18   0.740 -10.260   3.473
  153   1HG2  THR  18          1HG2      THR  18   0.653 -10.886   0.160
  154   2HG2  THR  18          2HG2      THR  18   2.317 -11.418   0.404
  155   3HG2  THR  18          3HG2      THR  18   1.991  -9.846  -0.329
  156    H    GLU  19           H        GLU  19   2.932 -11.483   4.440
  157    HA   GLU  19           HA       GLU  19   4.596 -13.557   3.183
  158   1HB   GLU  19          2HB       GLU  19   5.241 -12.731   5.437
  159   2HB   GLU  19          1HB       GLU  19   3.688 -13.269   6.061
  160   1HG   GLU  19          2HG       GLU  19   5.307 -14.896   6.652
  161   2HG   GLU  19          1HG       GLU  19   4.301 -15.586   5.380
  162    H    ALA  20           H        ALA  20   3.445 -15.107   2.104
  163    HA   ALA  20           HA       ALA  20   1.148 -16.272   3.458
  164   1HB   ALA  20          1HB       ALA  20   0.635 -14.317   1.695
  165   2HB   ALA  20          2HB       ALA  20  -0.444 -15.682   1.973
  166   3HB   ALA  20          3HB       ALA  20   0.669 -15.701   0.605
  167    H    VAL  21           H        VAL  21   0.601 -18.315   2.784
  168    HA   VAL  21           HA       VAL  21   2.604 -20.076   2.143
  169    HB   VAL  21           HB       VAL  21  -0.292 -20.541   1.442
  170   1HG1  VAL  21          1HG1      VAL  21   0.183 -22.860   1.774
  171   2HG1  VAL  21          2HG1      VAL  21   1.812 -22.497   2.344
  172   3HG1  VAL  21          3HG1      VAL  21   1.384 -22.210   0.657
  173   1HG2  VAL  21          1HG2      VAL  21  -0.469 -19.845   3.637
  174   2HG2  VAL  21          2HG2      VAL  21   1.111 -20.493   4.080
  175   3HG2  VAL  21          3HG2      VAL  21  -0.249 -21.586   3.820
  176    H    ASP  22           H        ASP  22   0.595 -18.268  -0.077
  177    HA   ASP  22           HA       ASP  22   2.350 -19.010  -2.251
  178   1HB   ASP  22          2HB       ASP  22   0.424 -19.679  -3.742
  179   2HB   ASP  22          1HB       ASP  22   0.850 -20.837  -2.486
  180    H    ALA  23           H        ALA  23   1.588 -17.915  -4.356
  181    HA   ALA  23           HA       ALA  23   1.540 -15.168  -3.943
  182   1HB   ALA  23          1HB       ALA  23   1.046 -16.897  -6.327
  183   2HB   ALA  23          2HB       ALA  23   2.378 -15.787  -6.004
  184   3HB   ALA  23          3HB       ALA  23   0.787 -15.155  -6.430
  185    H    ALA  24           H        ALA  24  -1.114 -17.393  -4.648
  186    HA   ALA  24           HA       ALA  24  -3.104 -15.409  -4.951
  187   1HB   ALA  24          1HB       ALA  24  -3.969 -17.360  -5.716
  188   2HB   ALA  24          2HB       ALA  24  -4.536 -17.517  -4.055
  189   3HB   ALA  24          3HB       ALA  24  -3.062 -18.339  -4.563
  190    H    THR  25           H        THR  25  -2.287 -17.465  -2.126
  191    HA   THR  25           HA       THR  25  -4.032 -16.288  -0.322
  192    HB   THR  25           HB       THR  25  -2.357 -17.002   1.419
  193    HG1  THR  25           1HG      THR  25  -0.430 -17.492   0.861
  194   1HG2  THR  25          1HG2      THR  25  -2.380 -19.445   0.817
  195   2HG2  THR  25          2HG2      THR  25  -3.203 -18.970  -0.669
  196   3HG2  THR  25          3HG2      THR  25  -3.948 -18.640   0.896
  197    H    ALA  26           H        ALA  26  -0.745 -15.401  -1.263
  198    HA   ALA  26           HA       ALA  26  -0.425 -13.201   0.453
  199   1HB   ALA  26          1HB       ALA  26   1.539 -12.909  -0.610
  200   2HB   ALA  26          2HB       ALA  26   0.788 -12.920  -2.206
  201   3HB   ALA  26          3HB       ALA  26   1.156 -14.441  -1.392
  202    H    GLU  27           H        GLU  27  -1.548 -13.364  -2.941
  203    HA   GLU  27           HA       GLU  27  -2.115 -10.687  -3.305
  204   1HB   GLU  27          2HB       GLU  27  -2.167 -12.385  -5.099
  205   2HB   GLU  27          1HB       GLU  27  -3.661 -13.020  -4.423
  206   1HG   GLU  27          2HG       GLU  27  -4.767 -10.894  -4.850
  207   2HG   GLU  27          1HG       GLU  27  -3.272 -10.249  -5.525
  208    H    LYS  28           H        LYS  28  -4.185 -13.262  -2.022
  209    HA   LYS  28           HA       LYS  28  -6.486 -11.678  -1.643
  210   1HB   LYS  28          2HB       LYS  28  -5.595 -14.185  -0.208
  211   2HB   LYS  28          1HB       LYS  28  -7.201 -13.480  -0.090
  212   1HG   LYS  28          2HG       LYS  28  -5.920 -14.562  -2.590
  213   2HG   LYS  28          1HG       LYS  28  -7.181 -15.347  -1.637
  214   1HD   LYS  28          2HD       LYS  28  -7.444 -12.684  -3.033
  215   2HD   LYS  28          1HD       LYS  28  -8.082 -14.218  -3.631
  216   1HE   LYS  28          2HE       LYS  28  -8.857 -12.848  -1.057
  217   2HE   LYS  28          1HE       LYS  28  -9.824 -12.911  -2.530
  218   1HZ   LYS  28          1HZ       LYS  28  -9.277 -15.524  -2.004
  219   2HZ   LYS  28          2HZ       LYS  28 -10.724 -14.727  -1.640
  220   3HZ   LYS  28          3HZ       LYS  28  -9.519 -14.873  -0.462
  221    H    VAL  29           H        VAL  29  -3.848 -12.603   0.542
  222    HA   VAL  29           HA       VAL  29  -4.754 -11.364   2.854
  223    HB   VAL  29           HB       VAL  29  -1.900 -11.637   1.881
  224   1HG1  VAL  29          1HG1      VAL  29  -1.544 -11.606   4.470
  225   2HG1  VAL  29          2HG1      VAL  29  -3.061 -10.708   4.465
  226   3HG1  VAL  29          3HG1      VAL  29  -1.670 -10.095   3.570
  227   1HG2  VAL  29          1HG2      VAL  29  -2.847 -13.375   4.033
  228   2HG2  VAL  29          2HG2      VAL  29  -1.917 -13.764   2.586
  229   3HG2  VAL  29          3HG2      VAL  29  -3.674 -13.629   2.497
  230    H    VAL  30           H        VAL  30  -2.942 -10.047   0.133
  231    HA   VAL  30           HA       VAL  30  -2.560  -7.457   1.182
  232    HB   VAL  30           HB       VAL  30  -2.909  -8.202  -1.727
  233   1HG1  VAL  30          1HG1      VAL  30  -2.878  -5.732  -0.833
  234   2HG1  VAL  30          2HG1      VAL  30  -1.981  -6.179  -2.285
  235   3HG1  VAL  30          3HG1      VAL  30  -1.138  -6.017  -0.745
  236   1HG2  VAL  30          1HG2      VAL  30  -1.074  -9.319  -0.083
  237   2HG2  VAL  30          2HG2      VAL  30  -0.198  -7.892  -0.632
  238   3HG2  VAL  30          3HG2      VAL  30  -0.824  -9.049  -1.806
  239    H    LYS  31           H        LYS  31  -5.141  -8.904  -0.822
  240    HA   LYS  31           HA       LYS  31  -6.718  -6.725  -1.337
  241   1HB   LYS  31          2HB       LYS  31  -7.760  -9.409  -0.415
  242   2HB   LYS  31          1HB       LYS  31  -8.666  -8.203  -1.310
  243   1HG   LYS  31          2HG       LYS  31  -6.349  -9.834  -2.291
  244   2HG   LYS  31          1HG       LYS  31  -8.030  -9.948  -2.796
  245   1HD   LYS  31          2HD       LYS  31  -7.748  -7.490  -3.517
  246   2HD   LYS  31          1HD       LYS  31  -6.018  -7.814  -3.386
  247   1HE   LYS  31          2HE       LYS  31  -6.822  -8.130  -5.674
  248   2HE   LYS  31          1HE       LYS  31  -6.206  -9.627  -4.981
  249   1HZ   LYS  31          1HZ       LYS  31  -8.675  -9.222  -6.134
  250   2HZ   LYS  31          2HZ       LYS  31  -8.983  -9.363  -4.477
  251   3HZ   LYS  31          3HZ       LYS  31  -8.158 -10.595  -5.290
  252    H    GLN  32           H        GLN  32  -6.803  -8.758   1.559
  253    HA   GLN  32           HA       GLN  32  -8.719  -7.276   2.985
  254   1HB   GLN  32          2HB       GLN  32  -7.968  -9.556   3.625
  255   2HB   GLN  32          1HB       GLN  32  -6.415  -8.888   4.103
  256   1HG   GLN  32          2HG       GLN  32  -7.757  -9.244   6.052
  257   2HG   GLN  32          1HG       GLN  32  -7.551  -7.515   5.796
  258   1HE2  GLN  32          1HE2      GLN  32  -9.732  -8.806   3.564
  259   2HE2  GLN  32          2HE2      GLN  32 -11.191  -8.384   4.379
  260    H    PHE  33           H        PHE  33  -5.240  -6.978   2.699
  261    HA   PHE  33           HA       PHE  33  -4.696  -5.128   4.688
  262   1HB   PHE  33          2HB       PHE  33  -3.030  -6.316   3.216
  263   2HB   PHE  33          1HB       PHE  33  -3.432  -5.179   1.935
  264    HD1  PHE  33           1HD      PHE  33  -2.264  -5.293   5.452
  265    HD2  PHE  33           2HD      PHE  33  -2.218  -3.218   1.727
  266    HE1  PHE  33           1HE      PHE  33  -0.615  -3.701   6.347
  267    HE2  PHE  33           2HE      PHE  33  -0.562  -1.637   2.633
  268    HZ   PHE  33           HZ       PHE  33   0.228  -1.890   4.956
  269    H    PHE  34           H        PHE  34  -5.214  -4.387   1.263
  270    HA   PHE  34           HA       PHE  34  -5.619  -1.596   1.690
  271   1HB   PHE  34          2HB       PHE  34  -6.273  -3.311  -0.709
  272   2HB   PHE  34          1HB       PHE  34  -6.280  -1.545  -0.690
  273    HD1  PHE  34           1HD      PHE  34  -3.967  -0.849   0.841
  274    HD2  PHE  34           2HD      PHE  34  -4.453  -3.991  -1.985
  275    HE1  PHE  34           1HE      PHE  34  -1.544  -0.853   0.443
  276    HE2  PHE  34           2HE      PHE  34  -2.025  -3.997  -2.396
  277    HZ   PHE  34           HZ       PHE  34  -0.575  -2.430  -1.165
  278    H    ASN  35           H        ASN  35  -7.780  -4.332   1.302
  279    HA   ASN  35           HA       ASN  35 -10.234  -3.088   1.062
  280   1HB   ASN  35          2HB       ASN  35  -9.882  -5.531   0.995
  281   2HB   ASN  35          1HB       ASN  35  -9.550  -5.527   2.724
  282   1HD2  ASN  35          1HD2      ASN  35 -11.693  -6.590   0.790
  283   2HD2  ASN  35          2HD2      ASN  35 -13.168  -6.242   1.617
  284    H    ASP  36           H        ASP  36  -8.272  -3.653   3.899
  285    HA   ASP  36           HA       ASP  36 -10.214  -2.325   5.633
  286   1HB   ASP  36          2HB       ASP  36  -7.638  -3.758   6.300
  287   2HB   ASP  36          1HB       ASP  36  -8.717  -3.027   7.485
  288    H    ASN  37           H        ASN  37  -7.203  -1.622   4.044
  289    HA   ASN  37           HA       ASN  37  -6.550   0.566   5.818
  290   1HB   ASN  37          2HB       ASN  37  -5.415  -0.184   3.112
  291   2HB   ASN  37          1HB       ASN  37  -4.818   1.136   4.111
  292   1HD2  ASN  37          1HD2      ASN  37  -3.712  -1.523   3.121
  293   2HD2  ASN  37          2HD2      ASN  37  -3.040  -2.229   4.549
  294    H    GLY  38           H        GLY  38  -7.813   0.146   2.569
  295   1HA   GLY  38          2HA       GLY  38  -8.222   2.145   1.163
  296   2HA   GLY  38          1HA       GLY  38  -9.694   1.482   1.836
  297    H    VAL  39           H        VAL  39 -11.019   2.894   2.668
  298    HA   VAL  39           HA       VAL  39  -9.976   5.539   3.423
  299    HB   VAL  39           HB       VAL  39 -12.795   4.777   2.742
  300   1HG1  VAL  39          1HG1      VAL  39 -12.639   7.372   2.134
  301   2HG1  VAL  39          2HG1      VAL  39 -11.419   7.312   3.406
  302   3HG1  VAL  39          3HG1      VAL  39 -13.069   6.795   3.744
  303   1HG2  VAL  39          1HG2      VAL  39 -10.824   6.112   0.896
  304   2HG2  VAL  39          2HG2      VAL  39 -12.436   5.507   0.511
  305   3HG2  VAL  39          3HG2      VAL  39 -11.135   4.377   0.886
  306    H    ASP  40           H        ASP  40 -10.865   2.851   5.142
  307    HA   ASP  40           HA       ASP  40 -12.039   4.529   7.250
  308   1HB   ASP  40          2HB       ASP  40 -12.727   1.657   6.603
  309   2HB   ASP  40          1HB       ASP  40 -13.340   2.559   7.987
  310    H    GLY  41           H        GLY  41  -9.238   3.291   6.539
  311   1HA   GLY  41          2HA       GLY  41  -8.723   1.603   8.821
  312   2HA   GLY  41          1HA       GLY  41  -7.536   2.183   7.662
  313    H    GLU  42           H        GLU  42  -6.772   2.102  10.205
  314    HA   GLU  42           HA       GLU  42  -7.115   4.779  11.353
  315   1HB   GLU  42          2HB       GLU  42  -5.931   2.226  12.445
  316   2HB   GLU  42          1HB       GLU  42  -5.763   3.768  13.269
  317   1HG   GLU  42          2HG       GLU  42  -7.557   2.547  14.262
  318   2HG   GLU  42          1HG       GLU  42  -8.226   3.925  13.395
  319    H    TRP  43           H        TRP  43  -5.776   6.214  10.404
  320    HA   TRP  43           HA       TRP  43  -3.046   5.377   9.743
  321   1HB   TRP  43          2HB       TRP  43  -4.589   7.838   8.913
  322   2HB   TRP  43          1HB       TRP  43  -2.977   7.407   8.361
  323    HD1  TRP  43           HD       TRP  43  -5.870   4.851   8.529
  324    HE1  TRP  43           1HE      TRP  43  -6.387   4.086   6.125
  325    HE3  TRP  43           3HE      TRP  43  -2.786   8.038   5.984
  326    HZ2  TRP  43           2HZ      TRP  43  -5.591   4.755   3.496
  327    HZ3  TRP  43           3HZ      TRP  43  -2.719   7.909   3.534
  328    HH2  TRP  43           HH       TRP  43  -4.097   6.300   2.315
  329    H    THR  44           H        THR  44  -1.380   5.993  10.964
  330    HA   THR  44           HA       THR  44  -1.692   8.355  12.697
  331    HB   THR  44           HB       THR  44   0.096   7.335  14.101
  332    HG1  THR  44           1HG      THR  44  -0.277   5.105  12.394
  333   1HG2  THR  44          1HG2      THR  44  -1.212   5.750  15.226
  334   2HG2  THR  44          2HG2      THR  44  -2.107   5.332  13.766
  335   3HG2  THR  44          3HG2      THR  44  -2.358   6.900  14.535
  336    H    TYR  45           H        TYR  45  -0.164   9.978  12.556
  337    HA   TYR  45           HA       TYR  45   1.842   9.649  10.423
  338   1HB   TYR  45          2HB       TYR  45   0.070  11.320   9.987
  339   2HB   TYR  45          1HB       TYR  45   0.560  12.194  11.433
  340    HD1  TYR  45           1HD      TYR  45   2.861  10.628   8.986
  341    HD2  TYR  45           2HD      TYR  45   1.176  14.251  10.447
  342    HE1  TYR  45           1HE      TYR  45   4.480  11.912   7.653
  343    HE2  TYR  45           2HE      TYR  45   2.790  15.544   9.118
  344    HH   TYR  45           HH       TYR  45   4.233  15.342   7.261
  345    H    ASP  46           H        ASP  46   3.942  10.363  10.710
  346    HA   ASP  46           HA       ASP  46   4.694  11.135  13.451
  347   1HB   ASP  46          2HB       ASP  46   5.339   8.806  13.013
  348   2HB   ASP  46          1HB       ASP  46   6.216   9.312  11.571
  349    H    ASP  47           H        ASP  47   4.614  13.334  12.748
  350    HA   ASP  47           HA       ASP  47   5.783  14.537  10.605
  351   1HB   ASP  47          2HB       ASP  47   5.854  15.583  13.442
  352   2HB   ASP  47          1HB       ASP  47   6.024  16.550  11.980
  353    H    ALA  48           H        ALA  48   7.425  13.321  13.464
  354    HA   ALA  48           HA       ALA  48   9.873  14.527  13.310
  355   1HB   ALA  48          1HB       ALA  48  10.767  12.697  14.534
  356   2HB   ALA  48          2HB       ALA  48   9.523  11.603  13.926
  357   3HB   ALA  48          3HB       ALA  48   9.090  12.898  15.043
  358    H    THR  49           H        THR  49   8.684  11.913  11.272
  359    HA   THR  49           HA       THR  49  11.134  12.194   9.660
  360    HB   THR  49           HB       THR  49  10.985   9.789   9.111
  361    HG1  THR  49           1HG      THR  49   9.551   8.492  10.156
  362   1HG2  THR  49          1HG2      THR  49  11.172   9.119  11.768
  363   2HG2  THR  49          2HG2      THR  49  11.636  10.822  11.738
  364   3HG2  THR  49          3HG2      THR  49  12.492   9.655  10.729
  365    H    LYS  50           H        LYS  50   8.200  13.184   9.550
  366    HA   LYS  50           HA       LYS  50   6.554  13.491   7.986
  367   1HB   LYS  50          2HB       LYS  50   8.948  13.220   6.163
  368   2HB   LYS  50          1HB       LYS  50   7.382  13.857   5.677
  369   1HG   LYS  50          2HG       LYS  50   8.010  15.366   7.891
  370   2HG   LYS  50          1HG       LYS  50   9.568  15.146   7.090
  371   1HD   LYS  50          2HD       LYS  50   8.584  15.944   4.986
  372   2HD   LYS  50          1HD       LYS  50   7.043  16.181   5.813
  373   1HE   LYS  50          2HE       LYS  50   8.260  18.286   5.601
  374   2HE   LYS  50          1HE       LYS  50   8.080  17.822   7.292
  375   1HZ   LYS  50          1HZ       LYS  50  10.489  16.777   6.216
  376   2HZ   LYS  50          2HZ       LYS  50  10.269  17.810   7.539
  377   3HZ   LYS  50          3HZ       LYS  50  10.420  18.452   5.981
  378    H    THR  51           H        THR  51   6.854  10.811   8.867
  379    HA   THR  51           HA       THR  51   6.045   9.343   6.448
  380    HB   THR  51           HB       THR  51   7.507   8.284   8.875
  381    HG1  THR  51           1HG      THR  51   8.880   9.370   7.475
  382   1HG2  THR  51          1HG2      THR  51   5.855   6.868   7.108
  383   2HG2  THR  51          2HG2      THR  51   6.982   6.218   8.300
  384   3HG2  THR  51          3HG2      THR  51   7.515   6.504   6.643
  385    H    PHE  52           H        PHE  52   4.211   8.165   6.526
  386    HA   PHE  52           HA       PHE  52   2.591   8.371   8.979
  387   1HB   PHE  52          2HB       PHE  52   1.622   7.770   6.175
  388   2HB   PHE  52          1HB       PHE  52   0.637   8.167   7.575
  389    HD1  PHE  52           1HD      PHE  52  -0.243  10.276   7.630
  390    HD2  PHE  52           2HD      PHE  52   3.475   9.662   5.654
  391    HE1  PHE  52           1HE      PHE  52  -0.208  12.646   6.961
  392    HE2  PHE  52           2HE      PHE  52   3.523  12.027   4.993
  393    HZ   PHE  52           HZ       PHE  52   1.680  13.521   5.646
  394    H    THR  53           H        THR  53   1.574   6.507   9.807
  395    HA   THR  53           HA       THR  53   2.465   3.976   8.595
  396    HB   THR  53           HB       THR  53   2.098   3.086  11.019
  397    HG1  THR  53           1HG      THR  53   2.534   5.844  11.475
  398   1HG2  THR  53          1HG2      THR  53   4.468   4.187  11.606
  399   2HG2  THR  53          2HG2      THR  53   4.435   4.431   9.860
  400   3HG2  THR  53          3HG2      THR  53   4.261   2.806  10.526
  401    H    VAL  54           H        VAL  54   0.946   2.765   7.822
  402    HA   VAL  54           HA       VAL  54  -1.829   3.208   8.674
  403    HB   VAL  54           HB       VAL  54  -0.813   1.787   6.205
  404   1HG1  VAL  54          1HG1      VAL  54  -3.503   2.216   7.363
  405   2HG1  VAL  54          2HG1      VAL  54  -2.887   0.886   6.381
  406   3HG1  VAL  54          3HG1      VAL  54  -3.340   2.409   5.616
  407   1HG2  VAL  54          1HG2      VAL  54  -1.751   3.817   5.040
  408   2HG2  VAL  54          2HG2      VAL  54  -0.276   4.086   5.968
  409   3HG2  VAL  54          3HG2      VAL  54  -1.835   4.586   6.624
  410    H    THR  55           H        THR  55  -2.371   1.878  10.284
  411    HA   THR  55           HA       THR  55  -1.350  -0.866  10.268
  412    HB   THR  55           HB       THR  55  -2.925   0.488  12.458
  413    HG1  THR  55           1HG      THR  55  -1.161   1.624  12.646
  414   1HG2  THR  55          1HG2      THR  55  -1.208  -1.975  12.386
  415   2HG2  THR  55          2HG2      THR  55  -2.920  -1.853  12.802
  416   3HG2  THR  55          3HG2      THR  55  -1.701  -1.171  13.878
  417    H    GLU  56           H        GLU  56  -2.556  -2.337   9.261
  418    HA   GLU  56           HA       GLU  56  -5.006  -2.084   8.176
  419   1HB   GLU  56          2HB       GLU  56  -5.182  -4.471   8.113
  420   2HB   GLU  56          1HB       GLU  56  -3.478  -4.054   7.968
  421   1HG   GLU  56          2HG       GLU  56  -3.510  -5.852   9.425
  422   2HG   GLU  56          1HG       GLU  56  -3.354  -4.452  10.483
  423   1H    MET   1          1HT       MET   1   7.610  19.618  -2.199
  424   2H    MET   1          2HT       MET   1   6.005  19.192  -1.880
  425   3H    MET   1          3HT       MET   1   6.924  18.275  -2.965
  426    HA   MET   1           HA       MET   1   8.488  17.929  -0.961
  427   1HB   MET   1          2HB       MET   1   5.857  18.724   0.293
  428   2HB   MET   1          1HB       MET   1   7.120  17.860   1.157
  429   1HG   MET   1          2HG       MET   1   8.648  19.709   0.823
  430   2HG   MET   1          1HG       MET   1   7.424  20.574  -0.106
  431   1HE   MET   1          1HE       MET   1   8.412  19.201   3.477
  432   2HE   MET   1          2HE       MET   1   6.907  18.376   3.074
  433   3HE   MET   1          3HE       MET   1   6.937  19.570   4.372
  434    H    GLN   2           H        GLN   2   8.615  15.802  -0.436
  435    HA   GLN   2           HA       GLN   2   6.387  14.087  -1.311
  436   1HB   GLN   2          2HB       GLN   2   8.417  13.830  -2.672
  437   2HB   GLN   2          1HB       GLN   2   9.350  13.476  -1.225
  438   1HG   GLN   2          2HG       GLN   2   8.023  11.461  -0.859
  439   2HG   GLN   2          1HG       GLN   2   7.083  11.815  -2.305
  440   1HE2  GLN   2          1HE2      GLN   2  10.147  12.798  -2.998
  441   2HE2  GLN   2          2HE2      GLN   2  10.749  11.357  -3.732
  442    H    TYR   3           H        TYR   3   6.008  12.142  -0.079
  443    HA   TYR   3           HA       TYR   3   7.126  12.178   2.636
  444   1HB   TYR   3          2HB       TYR   3   4.194  11.877   1.953
  445   2HB   TYR   3          1HB       TYR   3   4.887  11.714   3.564
  446    HD1  TYR   3           1HD      TYR   3   4.892  13.561   4.954
  447    HD2  TYR   3           2HD      TYR   3   4.717  14.159   0.747
  448    HE1  TYR   3           1HE      TYR   3   4.629  15.979   5.315
  449    HE2  TYR   3           2HE      TYR   3   4.454  16.579   1.096
  450    HH   TYR   3           HH       TYR   3   4.918  18.256   2.791
  451    H    LYS   4           H        LYS   4   7.209  10.167   3.693
  452    HA   LYS   4           HA       LYS   4   6.929   7.875   1.867
  453   1HB   LYS   4          2HB       LYS   4   9.214   8.256   2.631
  454   2HB   LYS   4          1HB       LYS   4   8.686   8.201   4.307
  455   1HG   LYS   4          2HG       LYS   4   7.999   5.859   3.989
  456   2HG   LYS   4          1HG       LYS   4   8.601   5.926   2.333
  457   1HD   LYS   4          2HD       LYS   4  10.303   6.437   4.770
  458   2HD   LYS   4          1HD       LYS   4  10.165   4.869   3.977
  459   1HE   LYS   4          2HE       LYS   4  12.138   5.875   3.139
  460   2HE   LYS   4          1HE       LYS   4  10.933   5.999   1.860
  461   1HZ   LYS   4          1HZ       LYS   4  12.427   8.042   2.856
  462   2HZ   LYS   4          2HZ       LYS   4  10.927   8.272   3.600
  463   3HZ   LYS   4          3HZ       LYS   4  11.032   8.206   1.912
  464    H    VAL   5           H        VAL   5   5.104   6.798   2.209
  465    HA   VAL   5           HA       VAL   5   3.960   6.730   4.891
  466    HB   VAL   5           HB       VAL   5   2.801   5.724   2.290
  467   1HG1  VAL   5          1HG1      VAL   5   1.701   4.530   3.965
  468   2HG1  VAL   5          2HG1      VAL   5   0.648   5.916   3.682
  469   3HG1  VAL   5          3HG1      VAL   5   1.722   5.895   5.082
  470   1HG2  VAL   5          1HG2      VAL   5   2.827   8.367   3.595
  471   2HG2  VAL   5          2HG2      VAL   5   1.271   7.828   2.963
  472   3HG2  VAL   5          3HG2      VAL   5   2.667   7.942   1.891
  473    H    ILE   6           H        ILE   6   3.833   4.988   6.124
  474    HA   ILE   6           HA       ILE   6   5.094   2.519   5.169
  475    HB   ILE   6           HB       ILE   6   4.681   3.584   7.966
  476   1HG1  ILE   6          2HG1      ILE   6   7.189   2.986   6.383
  477   2HG1  ILE   6          1HG1      ILE   6   6.526   4.588   6.677
  478   1HG2  ILE   6          1HG2      ILE   6   6.303   1.436   8.284
  479   2HG2  ILE   6          2HG2      ILE   6   5.215   0.857   7.021
  480   3HG2  ILE   6          3HG2      ILE   6   4.560   1.423   8.558
  481   1HD1  ILE   6          1HD1      ILE   6   6.829   4.165   9.122
  482   2HD1  ILE   6          2HD1      ILE   6   8.323   4.256   8.187
  483   3HD1  ILE   6          3HD1      ILE   6   7.689   2.688   8.689
  484    H    LEU   7           H        LEU   7   3.765   0.966   4.615
  485    HA   LEU   7           HA       LEU   7   1.045   0.919   5.683
  486   1HB   LEU   7          2HB       LEU   7   2.120  -0.928   3.568
  487   2HB   LEU   7          1HB       LEU   7   0.464  -0.417   3.836
  488    HG   LEU   7           HG       LEU   7   2.700   1.235   2.686
  489   1HD1  LEU   7          1HD1      LEU   7   1.349   1.272   0.696
  490   2HD1  LEU   7          2HD1      LEU   7   0.072   0.363   1.502
  491   3HD1  LEU   7          3HD1      LEU   7   1.628  -0.399   1.181
  492   1HD2  LEU   7          1HD2      LEU   7   1.297   2.569   4.206
  493   2HD2  LEU   7          2HD2      LEU   7  -0.130   2.077   3.295
  494   3HD2  LEU   7          3HD2      LEU   7   1.117   3.057   2.522
  495    H    ASN   8           H        ASN   8   1.578   0.197   7.777
  496    HA   ASN   8           HA       ASN   8   2.842  -2.410   8.066
  497   1HB   ASN   8          2HB       ASN   8   3.526  -0.500   9.492
  498   2HB   ASN   8          1HB       ASN   8   1.902  -0.454  10.168
  499   1HD2  ASN   8          1HD2      ASN   8   4.857  -1.265  10.930
  500   2HD2  ASN   8          2HD2      ASN   8   4.594  -2.645  11.938
  501    H    GLY   9           H        GLY   9   1.492  -4.109   7.780
  502   1HA   GLY   9          2HA       GLY   9  -1.138  -3.972   9.122
  503   2HA   GLY   9          1HA       GLY   9  -0.848  -4.882   7.650
  504    H    LYS  10           H        LYS  10  -1.856  -6.591   8.962
  505    HA   LYS  10           HA       LYS  10  -0.343  -7.696  11.128
  506   1HB   LYS  10          2HB       LYS  10  -2.684  -8.798   9.565
  507   2HB   LYS  10          1HB       LYS  10  -1.992  -9.558  10.989
  508   1HG   LYS  10          2HG       LYS  10  -3.055  -6.760  11.023
  509   2HG   LYS  10          1HG       LYS  10  -4.075  -8.164  11.331
  510   1HD   LYS  10          2HD       LYS  10  -1.533  -7.769  12.862
  511   2HD   LYS  10          1HD       LYS  10  -2.995  -6.892  13.322
  512   1HE   LYS  10          2HE       LYS  10  -2.882  -8.898  14.619
  513   2HE   LYS  10          1HE       LYS  10  -4.190  -9.060  13.450
  514   1HZ   LYS  10          1HZ       LYS  10  -3.037 -10.615  12.243
  515   2HZ   LYS  10          2HZ       LYS  10  -2.525 -10.994  13.808
  516   3HZ   LYS  10          3HZ       LYS  10  -1.519 -10.098  12.787
  517    H    THR  11           H        THR  11  -1.213  -8.902   7.892
  518    HA   THR  11           HA       THR  11   1.106 -10.687   7.964
  519    HB   THR  11           HB       THR  11  -0.186 -11.652   5.913
  520    HG1  THR  11           1HG      THR  11  -2.322 -10.389   7.265
  521   1HG2  THR  11          1HG2      THR  11  -1.960 -12.388   7.990
  522   2HG2  THR  11          2HG2      THR  11  -0.345 -12.222   8.681
  523   3HG2  THR  11          3HG2      THR  11  -0.614 -13.304   7.314
  524    H    LEU  12           H        LEU  12   0.498  -7.685   6.973
  525    HA   LEU  12           HA       LEU  12   2.279  -7.960   4.673
  526   1HB   LEU  12          2HB       LEU  12   0.021  -7.765   3.789
  527   2HB   LEU  12          1HB       LEU  12  -0.244  -6.308   4.726
  528    HG   LEU  12           HG       LEU  12   1.313  -5.081   3.393
  529   1HD1  LEU  12          1HD1      LEU  12   2.285  -7.727   2.770
  530   2HD1  LEU  12          2HD1      LEU  12   3.098  -6.175   2.648
  531   3HD1  LEU  12          3HD1      LEU  12   2.081  -6.748   1.322
  532   1HD2  LEU  12          1HD2      LEU  12   0.104  -6.423   1.124
  533   2HD2  LEU  12          2HD2      LEU  12  -0.150  -4.791   1.738
  534   3HD2  LEU  12          3HD2      LEU  12  -1.049  -6.140   2.427
  535    H    LYS  13           H        LYS  13   3.829  -6.459   4.519
  536    HA   LYS  13           HA       LYS  13   3.660  -4.003   6.081
  537   1HB   LYS  13          2HB       LYS  13   5.940  -5.973   6.382
  538   2HB   LYS  13          1HB       LYS  13   5.871  -4.371   7.103
  539   1HG   LYS  13          2HG       LYS  13   3.951  -5.035   8.440
  540   2HG   LYS  13          1HG       LYS  13   3.975  -6.634   7.693
  541   1HD   LYS  13          2HD       LYS  13   5.040  -6.677   9.889
  542   2HD   LYS  13          1HD       LYS  13   6.204  -7.034   8.614
  543   1HE   LYS  13          2HE       LYS  13   7.150  -5.513  10.274
  544   2HE   LYS  13          1HE       LYS  13   7.016  -4.737   8.696
  545   1HZ   LYS  13          1HZ       LYS  13   6.102  -3.726  11.042
  546   2HZ   LYS  13          2HZ       LYS  13   4.695  -4.350  10.339
  547   3HZ   LYS  13          3HZ       LYS  13   5.627  -3.213   9.501
  548    H    GLY  14           H        GLY  14   4.954  -2.327   5.255
  549   1HA   GLY  14          2HA       GLY  14   7.006  -2.695   3.363
  550   2HA   GLY  14          1HA       GLY  14   5.497  -2.436   2.508
  551    H    GLU  15           H        GLU  15   6.832  -0.605   1.710
  552    HA   GLU  15           HA       GLU  15   6.161   1.766   3.260
  553   1HB   GLU  15          2HB       GLU  15   8.946   1.220   2.212
  554   2HB   GLU  15          1HB       GLU  15   8.404   2.745   2.899
  555   1HG   GLU  15          2HG       GLU  15   7.980   1.626   5.034
  556   2HG   GLU  15          1HG       GLU  15   8.549   0.107   4.342
  557    H    THR  16           H        THR  16   5.565   3.458   2.035
  558    HA   THR  16           HA       THR  16   6.022   3.331  -0.856
  559    HB   THR  16           HB       THR  16   3.846   2.530  -0.828
  560    HG1  THR  16           1HG      THR  16   3.406   5.302  -0.772
  561   1HG2  THR  16          1HG2      THR  16   3.540   4.076   1.656
  562   2HG2  THR  16          2HG2      THR  16   2.945   2.474   1.232
  563   3HG2  THR  16          3HG2      THR  16   2.110   3.911   0.643
  564    H    THR  17           H        THR  17   5.396   5.478  -1.930
  565    HA   THR  17           HA       THR  17   5.753   7.751  -0.128
  566    HB   THR  17           HB       THR  17   7.538   8.679  -1.586
  567    HG1  THR  17           1HG      THR  17   7.635   7.694  -3.440
  568   1HG2  THR  17          1HG2      THR  17   9.360   7.187  -0.869
  569   2HG2  THR  17          2HG2      THR  17   8.153   6.022  -0.323
  570   3HG2  THR  17          3HG2      THR  17   8.253   7.612   0.436
  571    H    THR  18           H        THR  18   4.247   9.168  -0.558
  572    HA   THR  18           HA       THR  18   3.223   9.467  -3.310
  573    HB   THR  18           HB       THR  18   1.556   8.922  -1.558
  574    HG1  THR  18           1HG      THR  18   1.038  10.292  -3.370
  575   1HG2  THR  18          1HG2      THR  18   0.919  10.920  -0.060
  576   2HG2  THR  18          2HG2      THR  18   2.599  11.409  -0.279
  577   3HG2  THR  18          3HG2      THR  18   2.224   9.848   0.449
  578    H    GLU  19           H        GLU  19   3.274  11.460  -4.306
  579    HA   GLU  19           HA       GLU  19   4.968  13.494  -3.027
  580   1HB   GLU  19          2HB       GLU  19   5.626  12.652  -5.271
  581   2HB   GLU  19          1HB       GLU  19   4.096  13.228  -5.918
  582   1HG   GLU  19          2HG       GLU  19   5.762  14.813  -6.484
  583   2HG   GLU  19          1HG       GLU  19   4.753  15.529  -5.227
  584    H    ALA  20           H        ALA  20   3.840  15.073  -1.964
  585    HA   ALA  20           HA       ALA  20   1.591  16.292  -3.348
  586   1HB   ALA  20          1HB       ALA  20   1.009  14.348  -1.595
  587   2HB   ALA  20          2HB       ALA  20  -0.034  15.740  -1.887
  588   3HB   ALA  20          3HB       ALA  20   1.061  15.733  -0.504
  589    H    VAL  21           H        VAL  21   1.085  18.347  -2.682
  590    HA   VAL  21           HA       VAL  21   3.120  20.060  -2.012
  591    HB   VAL  21           HB       VAL  21   0.226  20.594  -1.353
  592   1HG1  VAL  21          1HG1      VAL  21   0.763  22.901  -1.679
  593   2HG1  VAL  21          2HG1      VAL  21   2.392  22.499  -2.223
  594   3HG1  VAL  21          3HG1      VAL  21   1.931  22.223  -0.545
  595   1HG2  VAL  21          1HG2      VAL  21   0.065  19.904  -3.551
  596   2HG2  VAL  21          2HG2      VAL  21   1.666  20.513  -3.971
  597   3HG2  VAL  21          3HG2      VAL  21   0.330  21.638  -3.730
  598    H    ASP  22           H        ASP  22   1.038  18.300   0.177
  599    HA   ASP  22           HA       ASP  22   2.778  19.000   2.376
  600   1HB   ASP  22          2HB       ASP  22   0.849  19.717   3.841
  601   2HB   ASP  22          1HB       ASP  22   1.321  20.863   2.590
  602    H    ALA  23           H        ALA  23   1.961  17.926   4.471
  603    HA   ALA  23           HA       ALA  23   1.852  15.179   4.057
  604   1HB   ALA  23          1HB       ALA  23   1.367  16.920   6.434
  605   2HB   ALA  23          2HB       ALA  23   2.676  15.778   6.129
  606   3HB   ALA  23          3HB       ALA  23   1.064  15.185   6.532
  607    H    ALA  24           H        ALA  24  -0.756  17.468   4.724
  608    HA   ALA  24           HA       ALA  24  -2.798  15.534   4.999
  609   1HB   ALA  24          1HB       ALA  24  -3.627  17.504   5.753
  610   2HB   ALA  24          2HB       ALA  24  -4.166  17.674   4.082
  611   3HB   ALA  24          3HB       ALA  24  -2.680  18.462   4.613
  612    H    THR  25           H        THR  25  -1.891  17.568   2.186
  613    HA   THR  25           HA       THR  25  -3.639  16.433   0.355
  614    HB   THR  25           HB       THR  25  -1.923  17.106  -1.359
  615    HG1  THR  25           1HG      THR  25   0.007  17.549  -0.775
  616   1HG2  THR  25          1HG2      THR  25  -1.894  19.548  -0.758
  617   2HG2  THR  25          2HG2      THR  25  -2.749  19.095   0.717
  618   3HG2  THR  25          3HG2      THR  25  -3.480  18.784  -0.859
  619    H    ALA  26           H        ALA  26  -0.388  15.468   1.345
  620    HA   ALA  26           HA       ALA  26  -0.097  13.262  -0.368
  621   1HB   ALA  26          1HB       ALA  26   1.842  12.920   0.724
  622   2HB   ALA  26          2HB       ALA  26   1.071  12.950   2.309
  623   3HB   ALA  26          3HB       ALA  26   1.485  14.463   1.501
  624    H    GLU  27           H        GLU  27  -1.262  13.451   3.010
  625    HA   GLU  27           HA       GLU  27  -1.901  10.788   3.366
  626   1HB   GLU  27          2HB       GLU  27  -1.937  12.488   5.159
  627   2HB   GLU  27          1HB       GLU  27  -3.404  13.158   4.462
  628   1HG   GLU  27          2HG       GLU  27  -4.568  11.060   4.873
  629   2HG   GLU  27          1HG       GLU  27  -3.099  10.380   5.569
  630    H    LYS  28           H        LYS  28  -3.891  13.413   2.054
  631    HA   LYS  28           HA       LYS  28  -6.222  11.884   1.643
  632   1HB   LYS  28          2HB       LYS  28  -5.251  14.370   0.221
  633   2HB   LYS  28          1HB       LYS  28  -6.873  13.705   0.080
  634   1HG   LYS  28          2HG       LYS  28  -5.601  14.755   2.598
  635   2HG   LYS  28          1HG       LYS  28  -6.829  15.571   1.629
  636   1HD   LYS  28          2HD       LYS  28  -7.177  12.915   3.020
  637   2HD   LYS  28          1HD       LYS  28  -7.785  14.465   3.608
  638   1HE   LYS  28          2HE       LYS  28  -8.557  13.112   1.024
  639   2HE   LYS  28          1HE       LYS  28  -9.543  13.200   2.482
  640   1HZ   LYS  28          1HZ       LYS  28  -8.924  15.798   1.967
  641   2HZ   LYS  28          2HZ       LYS  28 -10.384  15.037   1.581
  642   3HZ   LYS  28          3HZ       LYS  28  -9.161  15.152   0.419
  643    H    VAL  29           H        VAL  29  -3.532  12.745  -0.504
  644    HA   VAL  29           HA       VAL  29  -4.435  11.528  -2.829
  645    HB   VAL  29           HB       VAL  29  -1.591  11.732  -1.816
  646   1HG1  VAL  29          1HG1      VAL  29  -1.199  11.691  -4.401
  647   2HG1  VAL  29          2HG1      VAL  29  -2.737  10.831  -4.417
  648   3HG1  VAL  29          3HG1      VAL  29  -1.374  10.184  -3.502
  649   1HG2  VAL  29          1HG2      VAL  29  -2.463  13.492  -3.981
  650   2HG2  VAL  29          2HG2      VAL  29  -1.546  13.859  -2.519
  651   3HG2  VAL  29          3HG2      VAL  29  -3.306  13.766  -2.457
  652    H    VAL  30           H        VAL  30  -2.695  10.168  -0.083
  653    HA   VAL  30           HA       VAL  30  -2.362   7.568  -1.126
  654    HB   VAL  30           HB       VAL  30  -2.733   8.324   1.776
  655   1HG1  VAL  30          1HG1      VAL  30  -2.747   5.854   0.882
  656   2HG1  VAL  30          2HG1      VAL  30  -1.862   6.279   2.348
  657   3HG1  VAL  30          3HG1      VAL  30  -1.002   6.096   0.818
  658   1HG2  VAL  30          1HG2      VAL  30  -0.847   9.394   0.158
  659   2HG2  VAL  30          2HG2      VAL  30  -0.014   7.948   0.720
  660   3HG2  VAL  30          3HG2      VAL  30  -0.629   9.119   1.886
  661    H    LYS  31           H        LYS  31  -4.934   9.077   0.839
  662    HA   LYS  31           HA       LYS  31  -6.572   6.938   1.332
  663   1HB   LYS  31          2HB       LYS  31  -7.535   9.647   0.396
  664   2HB   LYS  31          1HB       LYS  31  -8.482   8.463   1.277
  665   1HG   LYS  31          2HG       LYS  31  -6.141  10.039   2.294
  666   2HG   LYS  31          1HG       LYS  31  -7.827  10.192   2.774
  667   1HD   LYS  31          2HD       LYS  31  -7.614   7.729   3.497
  668   2HD   LYS  31          1HD       LYS  31  -5.875   8.011   3.392
  669   1HE   LYS  31          2HE       LYS  31  -6.702   8.347   5.668
  670   2HE   LYS  31          1HE       LYS  31  -6.040   9.828   4.984
  671   1HZ   LYS  31          1HZ       LYS  31  -8.534   9.484   6.102
  672   2HZ   LYS  31          2HZ       LYS  31  -8.815   9.632   4.442
  673   3HZ   LYS  31          3HZ       LYS  31  -7.973  10.844   5.267
  674    H    GLN  32           H        GLN  32  -6.565   8.973  -1.564
  675    HA   GLN  32           HA       GLN  32  -8.498   7.539  -3.017
  676   1HB   GLN  32          2HB       GLN  32  -7.682   9.799  -3.646
  677   2HB   GLN  32          1HB       GLN  32  -6.138   9.093  -4.103
  678   1HG   GLN  32          2HG       GLN  32  -7.442   9.480  -6.070
  679   2HG   GLN  32          1HG       GLN  32  -7.283   7.747  -5.811
  680   1HE2  GLN  32          1HE2      GLN  32  -9.463   9.093  -3.611
  681   2HE2  GLN  32          2HE2      GLN  32 -10.921   8.705  -4.445
  682    H    PHE  33           H        PHE  33  -5.030   7.154  -2.683
  683    HA   PHE  33           HA       PHE  33  -4.503   5.293  -4.664
  684   1HB   PHE  33          2HB       PHE  33  -2.831   6.440  -3.167
  685   2HB   PHE  33          1HB       PHE  33  -3.278   5.313  -1.894
  686    HD1  PHE  33           1HD      PHE  33  -2.058   5.398  -5.393
  687    HD2  PHE  33           2HD      PHE  33  -2.115   3.323  -1.669
  688    HE1  PHE  33           1HE      PHE  33  -0.436   3.767  -6.265
  689    HE2  PHE  33           2HE      PHE  33  -0.485   1.701  -2.552
  690    HZ   PHE  33           HZ       PHE  33   0.344   1.935  -4.862
  691    H    PHE  34           H        PHE  34  -5.086   4.564  -1.247
  692    HA   PHE  34           HA       PHE  34  -5.555   1.784  -1.679
  693   1HB   PHE  34          2HB       PHE  34  -6.199   3.517   0.711
  694   2HB   PHE  34          1HB       PHE  34  -6.249   1.751   0.692
  695    HD1  PHE  34           1HD      PHE  34  -3.932   0.999  -0.808
  696    HD2  PHE  34           2HD      PHE  34  -4.383   4.151   2.013
  697    HE1  PHE  34           1HE      PHE  34  -1.516   0.942  -0.374
  698    HE2  PHE  34           2HE      PHE  34  -1.961   4.098   2.457
  699    HZ   PHE  34           HZ       PHE  34  -0.532   2.497   1.248
  700    H    ASN  35           H        ASN  35  -7.653   4.571  -1.322
  701    HA   ASN  35           HA       ASN  35 -10.140   3.388  -1.117
  702   1HB   ASN  35          2HB       ASN  35  -9.731   5.822  -1.045
  703   2HB   ASN  35          1HB       ASN  35  -9.374   5.810  -2.768
  704   1HD2  ASN  35          1HD2      ASN  35 -11.517   6.926  -0.865
  705   2HD2  ASN  35          2HD2      ASN  35 -12.989   6.612  -1.713
  706    H    ASP  36           H        ASP  36  -8.125   3.903  -3.926
  707    HA   ASP  36           HA       ASP  36 -10.074   2.625  -5.686
  708   1HB   ASP  36          2HB       ASP  36  -7.456   3.994  -6.318
  709   2HB   ASP  36          1HB       ASP  36  -8.535   3.289  -7.518
  710    H    ASN  37           H        ASN  37  -7.104   1.849  -4.056
  711    HA   ASN  37           HA       ASN  37  -6.479  -0.355  -5.820
  712   1HB   ASN  37          2HB       ASN  37  -5.366   0.368  -3.097
  713   2HB   ASN  37          1HB       ASN  37  -4.787  -0.966  -4.086
  714   1HD2  ASN  37          1HD2      ASN  37  -3.629   1.666  -3.083
  715   2HD2  ASN  37          2HD2      ASN  37  -2.920   2.354  -4.502
  716    H    GLY  38           H        GLY  38  -7.776   0.095  -2.590
  717   1HA   GLY  38          2HA       GLY  38  -8.254  -1.892  -1.191
  718   2HA   GLY  38          1HA       GLY  38  -9.699  -1.192  -1.884
  719    H    VAL  39           H        VAL  39 -11.048  -2.572  -2.735
  720    HA   VAL  39           HA       VAL  39 -10.058  -5.242  -3.475
  721    HB   VAL  39           HB       VAL  39 -12.866  -4.414  -2.832
  722   1HG1  VAL  39          1HG1      VAL  39 -12.781  -7.010  -2.225
  723   2HG1  VAL  39          2HG1      VAL  39 -11.544  -6.980  -3.479
  724   3HG1  VAL  39          3HG1      VAL  39 -13.175  -6.423  -3.841
  725   1HG2  VAL  39          1HG2      VAL  39 -10.955  -5.796  -0.961
  726   2HG2  VAL  39          2HG2      VAL  39 -12.558  -5.151  -0.598
  727   3HG2  VAL  39          3HG2      VAL  39 -11.224  -4.052  -0.955
  728    H    ASP  40           H        ASP  40 -10.858  -2.533  -5.207
  729    HA   ASP  40           HA       ASP  40 -12.043  -4.184  -7.330
  730   1HB   ASP  40          2HB       ASP  40 -12.669  -1.295  -6.695
  731   2HB   ASP  40          1HB       ASP  40 -13.284  -2.184  -8.087
  732    H    GLY  41           H        GLY  41  -9.220  -3.015  -6.580
  733   1HA   GLY  41          2HA       GLY  41  -8.633  -1.342  -8.854
  734   2HA   GLY  41          1HA       GLY  41  -7.478  -1.949  -7.680
  735    H    GLU  42           H        GLU  42  -6.675  -1.886 -10.210
  736    HA   GLU  42           HA       GLU  42  -7.069  -4.555 -11.366
  737   1HB   GLU  42          2HB       GLU  42  -5.808  -2.030 -12.439
  738   2HB   GLU  42          1HB       GLU  42  -5.666  -3.575 -13.260
  739   1HG   GLU  42          2HG       GLU  42  -7.415  -2.312 -14.280
  740   2HG   GLU  42          1HG       GLU  42  -8.129  -3.675 -13.421
  741    H    TRP  43           H        TRP  43  -5.778  -6.019 -10.396
  742    HA   TRP  43           HA       TRP  43  -3.038  -5.250  -9.696
  743   1HB   TRP  43          2HB       TRP  43  -4.653  -7.672  -8.890
  744   2HB   TRP  43          1HB       TRP  43  -3.037  -7.282  -8.314
  745    HD1  TRP  43           HD       TRP  43  -5.866  -4.653  -8.522
  746    HE1  TRP  43           1HE      TRP  43  -6.398  -3.878  -6.125
  747    HE3  TRP  43           3HE      TRP  43  -2.896  -7.916  -5.935
  748    HZ2  TRP  43           2HZ      TRP  43  -5.654  -4.565  -3.485
  749    HZ3  TRP  43           3HZ      TRP  43  -2.860  -7.789  -3.485
  750    HH2  TRP  43           HH       TRP  43  -4.216  -6.146  -2.284
  751    H    THR  44           H        THR  44  -1.371  -5.906 -10.894
  752    HA   THR  44           HA       THR  44  -1.716  -8.261 -12.632
  753    HB   THR  44           HB       THR  44   0.118  -7.285 -14.011
  754    HG1  THR  44           1HG      THR  44  -0.224  -5.047 -12.307
  755   1HG2  THR  44          1HG2      THR  44  -1.135  -5.669 -15.153
  756   2HG2  THR  44          2HG2      THR  44  -2.042  -5.229 -13.706
  757   3HG2  THR  44          3HG2      THR  44  -2.317  -6.790 -14.479
  758    H    TYR  45           H        TYR  45  -0.229  -9.920 -12.471
  759    HA   TYR  45           HA       TYR  45   1.755  -9.639 -10.308
  760   1HB   TYR  45          2HB       TYR  45  -0.063 -11.267  -9.897
  761   2HB   TYR  45          1HB       TYR  45   0.425 -12.153 -11.337
  762    HD1  TYR  45           1HD      TYR  45   2.729 -10.643  -8.856
  763    HD2  TYR  45           2HD      TYR  45   0.977 -14.224 -10.342
  764    HE1  TYR  45           1HE      TYR  45   4.297 -11.965  -7.501
  765    HE2  TYR  45           2HE      TYR  45   2.540 -15.556  -8.991
  766    HH   TYR  45           HH       TYR  45   3.961 -15.389  -7.112
  767    H    ASP  46           H        ASP  46   3.840 -10.403 -10.566
  768    HA   ASP  46           HA       ASP  46   4.612 -11.194 -13.295
  769   1HB   ASP  46          2HB       ASP  46   5.307  -8.883 -12.847
  770   2HB   ASP  46          1HB       ASP  46   6.152  -9.410 -11.394
  771    H    ASP  47           H        ASP  47   4.469 -13.392 -12.593
  772    HA   ASP  47           HA       ASP  47   5.578 -14.622 -10.434
  773   1HB   ASP  47          2HB       ASP  47   5.664 -15.671 -13.271
  774   2HB   ASP  47          1HB       ASP  47   5.790 -16.641 -11.808
  775    H    ALA  48           H        ALA  48   7.290 -13.447 -13.271
  776    HA   ALA  48           HA       ALA  48   9.704 -14.712 -13.083
  777   1HB   ALA  48          1HB       ALA  48  10.658 -12.904 -14.293
  778   2HB   ALA  48          2HB       ALA  48   9.435 -11.781 -13.702
  779   3HB   ALA  48          3HB       ALA  48   8.986 -13.065 -14.825
  780    H    THR  49           H        THR  49   8.550 -12.071 -11.061
  781    HA   THR  49           HA       THR  49  10.969 -12.412  -9.413
  782    HB   THR  49           HB       THR  49  10.871 -10.003  -8.867
  783    HG1  THR  49           1HG      THR  49   9.484  -8.670  -9.932
  784   1HG2  THR  49          1HG2      THR  49  11.112  -9.340 -11.522
  785   2HG2  THR  49          2HG2      THR  49  11.533 -11.052 -11.484
  786   3HG2  THR  49          3HG2      THR  49  12.405  -9.907 -10.464
  787    H    LYS  50           H        LYS  50   8.011 -13.329  -9.346
  788    HA   LYS  50           HA       LYS  50   6.335 -13.594  -7.805
  789   1HB   LYS  50          2HB       LYS  50   8.710 -13.381  -5.950
  790   2HB   LYS  50          1HB       LYS  50   7.123 -13.981  -5.486
  791   1HG   LYS  50          2HG       LYS  50   7.744 -15.505  -7.690
  792   2HG   LYS  50          1HG       LYS  50   9.297 -15.322  -6.868
  793   1HD   LYS  50          2HD       LYS  50   8.267 -16.096  -4.778
  794   2HD   LYS  50          1HD       LYS  50   6.730 -16.296  -5.625
  795   1HE   LYS  50          2HE       LYS  50   7.892 -18.429  -5.397
  796   2HE   LYS  50          1HE       LYS  50   7.746 -17.961  -7.091
  797   1HZ   LYS  50          1HZ       LYS  50  10.165 -16.976  -5.981
  798   2HZ   LYS  50          2HZ       LYS  50   9.939 -18.003  -7.306
  799   3HZ   LYS  50          3HZ       LYS  50  10.052 -18.648  -5.747
  800    H    THR  51           H        THR  51   6.713 -10.922  -8.681
  801    HA   THR  51           HA       THR  51   5.907  -9.435  -6.274
  802    HB   THR  51           HB       THR  51   7.428  -8.412  -8.679
  803    HG1  THR  51           1HG      THR  51   8.754  -9.533  -7.261
  804   1HG2  THR  51          1HG2      THR  51   5.788  -6.955  -6.937
  805   2HG2  THR  51          2HG2      THR  51   6.947  -6.334  -8.112
  806   3HG2  THR  51          3HG2      THR  51   7.449  -6.634  -6.449
  807    H    PHE  52           H        PHE  52   4.102  -8.213  -6.377
  808    HA   PHE  52           HA       PHE  52   2.515  -8.380  -8.853
  809   1HB   PHE  52          2HB       PHE  52   1.518  -7.756  -6.064
  810   2HB   PHE  52          1HB       PHE  52   0.546  -8.130  -7.480
  811    HD1  PHE  52           1HD      PHE  52  -0.386 -10.217  -7.543
  812    HD2  PHE  52           2HD      PHE  52   3.319  -9.693  -5.517
  813    HE1  PHE  52           1HE      PHE  52  -0.417 -12.586  -6.875
  814    HE2  PHE  52           2HE      PHE  52   3.300 -12.058  -4.856
  815    HZ   PHE  52           HZ       PHE  52   1.431 -13.507  -5.534
  816    H    THR  53           H        THR  53   1.554  -6.493  -9.696
  817    HA   THR  53           HA       THR  53   2.489  -3.984  -8.471
  818    HB   THR  53           HB       THR  53   2.178  -3.085 -10.899
  819    HG1  THR  53           1HG      THR  53   2.553  -5.852 -11.350
  820   1HG2  THR  53          1HG2      THR  53   4.529  -4.244 -11.453
  821   2HG2  THR  53          2HG2      THR  53   4.466  -4.487  -9.707
  822   3HG2  THR  53          3HG2      THR  53   4.341  -2.857 -10.376
  823    H    VAL  54           H        VAL  54   0.988  -2.737  -7.719
  824    HA   VAL  54           HA       VAL  54  -1.784  -3.112  -8.611
  825    HB   VAL  54           HB       VAL  54  -0.768  -1.715  -6.126
  826   1HG1  VAL  54          1HG1      VAL  54  -3.451  -2.079  -7.322
  827   2HG1  VAL  54          2HG1      VAL  54  -2.817  -0.764  -6.333
  828   3HG1  VAL  54          3HG1      VAL  54  -3.318  -2.276  -5.574
  829   1HG2  VAL  54          1HG2      VAL  54  -1.772  -3.720  -4.974
  830   2HG2  VAL  54          2HG2      VAL  54  -0.292  -4.026  -5.882
  831   3HG2  VAL  54          3HG2      VAL  54  -1.852  -4.490  -6.559
  832    H    THR  55           H        THR  55  -2.272  -1.769 -10.227
  833    HA   THR  55           HA       THR  55  -1.183   0.949 -10.197
  834    HB   THR  55           HB       THR  55  -2.760  -0.366 -12.408
  835    HG1  THR  55           1HG      THR  55  -1.021  -1.545 -12.573
  836   1HG2  THR  55          1HG2      THR  55  -0.985   2.054 -12.312
  837   2HG2  THR  55          2HG2      THR  55  -2.694   1.974 -12.751
  838   3HG2  THR  55          3HG2      THR  55  -1.476   1.262 -13.810
  839    H    GLU  56           H        GLU  56  -2.368   2.450  -9.206
  840    HA   GLU  56           HA       GLU  56  -4.838   2.257  -8.156
  841   1HB   GLU  56          2HB       GLU  56  -4.957   4.647  -8.095
  842   2HB   GLU  56          1HB       GLU  56  -3.266   4.189  -7.927
  843   1HG   GLU  56          2HG       GLU  56  -3.234   5.987  -9.384
  844   2HG   GLU  56          1HG       GLU  56  -3.097   4.582 -10.440
  Start of MODEL   24
    1   1H    MET   1          1HT       MET   1   6.611 -20.019   2.322
    2   2H    MET   1          2HT       MET   1   5.215 -19.078   2.486
    3   3H    MET   1          3HT       MET   1   6.651 -18.593   3.234
    4    HA   MET   1           HA       MET   1   7.689 -18.373   1.018
    5   1HB   MET   1          2HB       MET   1   4.826 -18.855   0.168
    6   2HB   MET   1          1HB       MET   1   6.091 -18.266  -0.900
    7   1HG   MET   1          2HG       MET   1   6.080 -20.920   0.518
    8   2HG   MET   1          1HG       MET   1   5.705 -20.651  -1.185
    9   1HE   MET   1          1HE       MET   1   7.836 -18.378  -1.895
   10   2HE   MET   1          2HE       MET   1   7.506 -19.744  -2.961
   11   3HE   MET   1          3HE       MET   1   9.169 -19.345  -2.528
   12    H    GLN   2           H        GLN   2   8.087 -16.280   0.655
   13    HA   GLN   2           HA       GLN   2   6.111 -14.323   1.615
   14   1HB   GLN   2          2HB       GLN   2   8.263 -14.264   2.790
   15   2HB   GLN   2          1HB       GLN   2   9.103 -14.041   1.262
   16   1HG   GLN   2          2HG       GLN   2   7.979 -11.893   0.957
   17   2HG   GLN   2          1HG       GLN   2   7.139 -12.118   2.490
   18   1HE2  GLN   2          1HE2      GLN   2   7.991 -11.005   4.081
   19   2HE2  GLN   2          2HE2      GLN   2   9.664 -10.625   4.287
   20    H    TYR   3           H        TYR   3   5.538 -12.570   0.344
   21    HA   TYR   3           HA       TYR   3   6.536 -12.597  -2.427
   22   1HB   TYR   3          2HB       TYR   3   3.672 -12.211  -1.533
   23   2HB   TYR   3          1HB       TYR   3   4.248 -12.015  -3.185
   24    HD1  TYR   3           1HD      TYR   3   4.124 -13.819  -4.631
   25    HD2  TYR   3           2HD      TYR   3   4.180 -14.545  -0.439
   26    HE1  TYR   3           1HE      TYR   3   3.761 -16.216  -5.047
   27    HE2  TYR   3           2HE      TYR   3   3.818 -16.943  -0.844
   28    HH   TYR   3           HH       TYR   3   4.102 -18.579  -2.592
   29    H    LYS   4           H        LYS   4   6.705 -10.599  -3.456
   30    HA   LYS   4           HA       LYS   4   6.585  -8.303  -1.615
   31   1HB   LYS   4          2HB       LYS   4   8.825  -8.857  -2.494
   32   2HB   LYS   4          1HB       LYS   4   8.226  -8.634  -4.132
   33   1HG   LYS   4          2HG       LYS   4   7.804  -6.292  -3.694
   34   2HG   LYS   4          1HG       LYS   4   8.304  -6.496  -2.013
   35   1HD   LYS   4          2HD       LYS   4  10.551  -7.139  -2.779
   36   2HD   LYS   4          1HD       LYS   4  10.043  -6.882  -4.449
   37   1HE   LYS   4          2HE       LYS   4   9.605  -4.532  -3.961
   38   2HE   LYS   4          1HE       LYS   4  10.083  -4.784  -2.284
   39   1HZ   LYS   4          1HZ       LYS   4  11.737  -4.583  -4.676
   40   2HZ   LYS   4          2HZ       LYS   4  12.248  -5.674  -3.489
   41   3HZ   LYS   4          3HZ       LYS   4  12.041  -4.041  -3.103
   42    H    VAL   5           H        VAL   5   4.825  -7.118  -1.889
   43    HA   VAL   5           HA       VAL   5   3.602  -6.932  -4.534
   44    HB   VAL   5           HB       VAL   5   2.578  -5.924  -1.875
   45   1HG1  VAL   5          1HG1      VAL   5   1.801  -5.171  -4.426
   46   2HG1  VAL   5          2HG1      VAL   5   0.870  -4.968  -2.943
   47   3HG1  VAL   5          3HG1      VAL   5   0.615  -6.388  -3.956
   48   1HG2  VAL   5          1HG2      VAL   5   2.819  -8.530  -2.637
   49   2HG2  VAL   5          2HG2      VAL   5   1.191  -8.138  -3.189
   50   3HG2  VAL   5          3HG2      VAL   5   1.626  -7.914  -1.495
   51    H    ILE   6           H        ILE   6   3.782  -5.232  -5.778
   52    HA   ILE   6           HA       ILE   6   5.124  -2.833  -4.757
   53    HB   ILE   6           HB       ILE   6   4.746  -3.852  -7.574
   54   1HG1  ILE   6          2HG1      ILE   6   7.217  -3.508  -5.861
   55   2HG1  ILE   6          1HG1      ILE   6   6.443  -5.039  -6.259
   56   1HG2  ILE   6          1HG2      ILE   6   6.582  -1.830  -7.738
   57   2HG2  ILE   6          2HG2      ILE   6   5.407  -1.184  -6.592
   58   3HG2  ILE   6          3HG2      ILE   6   4.882  -1.710  -8.192
   59   1HD1  ILE   6          1HD1      ILE   6   7.804  -3.156  -8.167
   60   2HD1  ILE   6          2HD1      ILE   6   6.930  -4.612  -8.644
   61   3HD1  ILE   6          3HD1      ILE   6   8.375  -4.739  -7.641
   62    H    LEU   7           H        LEU   7   3.968  -1.066  -4.390
   63    HA   LEU   7           HA       LEU   7   1.288  -0.853  -5.568
   64   1HB   LEU   7          2HB       LEU   7   2.367   0.909  -3.388
   65   2HB   LEU   7          1HB       LEU   7   0.695   0.526  -3.760
   66    HG   LEU   7           HG       LEU   7   2.727  -1.257  -2.438
   67   1HD1  LEU   7          1HD1      LEU   7   1.649   0.389  -1.001
   68   2HD1  LEU   7          2HD1      LEU   7   1.133  -1.249  -0.601
   69   3HD1  LEU   7          3HD1      LEU   7   0.065  -0.185  -1.519
   70   1HD2  LEU   7          1HD2      LEU   7   1.427  -2.546  -4.069
   71   2HD2  LEU   7          2HD2      LEU   7  -0.065  -1.964  -3.332
   72   3HD2  LEU   7          3HD2      LEU   7   1.032  -2.995  -2.410
   73    H    ASN   8           H        ASN   8   2.099  -0.198  -7.618
   74    HA   ASN   8           HA       ASN   8   3.527   2.333  -7.774
   75   1HB   ASN   8          2HB       ASN   8   4.138   0.313  -9.157
   76   2HB   ASN   8          1HB       ASN   8   2.625   0.533 -10.027
   77   1HD2  ASN   8          1HD2      ASN   8   5.718   0.893 -10.424
   78   2HD2  ASN   8          2HD2      ASN   8   5.792   2.342 -11.366
   79    H    GLY   9           H        GLY   9   2.329   4.124  -7.645
   80   1HA   GLY   9          2HA       GLY   9  -0.211   4.180  -9.158
   81   2HA   GLY   9          1HA       GLY   9   0.032   5.052  -7.652
   82    H    LYS  10           H        LYS  10  -0.755   6.837  -9.101
   83    HA   LYS  10           HA       LYS  10   1.213   7.862 -10.974
   84   1HB   LYS  10          2HB       LYS  10  -1.420   9.040 -10.059
   85   2HB   LYS  10          1HB       LYS  10  -0.422   9.649 -11.373
   86   1HG   LYS  10          2HG       LYS  10  -0.785   7.630 -12.641
   87   2HG   LYS  10          1HG       LYS  10  -1.686   6.919 -11.304
   88   1HD   LYS  10          2HD       LYS  10  -3.254   7.715 -12.931
   89   2HD   LYS  10          1HD       LYS  10  -3.342   8.766 -11.520
   90   1HE   LYS  10          2HE       LYS  10  -1.705   9.398 -13.966
   91   2HE   LYS  10          1HE       LYS  10  -3.370   9.930 -13.752
   92   1HZ   LYS  10          1HZ       LYS  10  -2.131  10.693 -11.447
   93   2HZ   LYS  10          2HZ       LYS  10  -2.495  11.698 -12.756
   94   3HZ   LYS  10          3HZ       LYS  10  -0.962  10.997 -12.634
   95    H    THR  11           H        THR  11  -0.432   9.086  -8.067
   96    HA   THR  11           HA       THR  11   1.722  11.003  -7.639
   97    HB   THR  11           HB       THR  11   0.134  11.779  -5.783
   98    HG1  THR  11           1HG      THR  11  -2.082  11.111  -6.262
   99   1HG2  THR  11          1HG2      THR  11   0.317  12.691  -8.228
  100   2HG2  THR  11          2HG2      THR  11  -0.989  13.210  -7.162
  101   3HG2  THR  11          3HG2      THR  11  -1.286  11.974  -8.384
  102    H    LEU  12           H        LEU  12   0.963   7.888  -6.783
  103    HA   LEU  12           HA       LEU  12   2.658   8.075  -4.406
  104   1HB   LEU  12          2HB       LEU  12   0.345   7.919  -3.649
  105   2HB   LEU  12          1HB       LEU  12   0.109   6.476  -4.616
  106    HG   LEU  12           HG       LEU  12   1.510   5.188  -3.210
  107   1HD1  LEU  12          1HD1      LEU  12   2.377   6.739  -1.130
  108   2HD1  LEU  12          2HD1      LEU  12   2.591   7.800  -2.519
  109   3HD1  LEU  12          3HD1      LEU  12   3.357   6.218  -2.504
  110   1HD2  LEU  12          1HD2      LEU  12   0.322   6.672  -0.998
  111   2HD2  LEU  12          2HD2      LEU  12   0.053   5.013  -1.528
  112   3HD2  LEU  12          3HD2      LEU  12  -0.807   6.337  -2.311
  113    H    LYS  13           H        LYS  13   4.177   6.541  -4.226
  114    HA   LYS  13           HA       LYS  13   4.015   4.118  -5.851
  115   1HB   LYS  13          2HB       LYS  13   6.354   6.032  -5.990
  116   2HB   LYS  13          1HB       LYS  13   6.279   4.451  -6.756
  117   1HG   LYS  13          2HG       LYS  13   4.466   5.192  -8.179
  118   2HG   LYS  13          1HG       LYS  13   4.453   6.763  -7.376
  119   1HD   LYS  13          2HD       LYS  13   5.643   6.871  -9.506
  120   2HD   LYS  13          1HD       LYS  13   6.731   7.183  -8.153
  121   1HE   LYS  13          2HE       LYS  13   7.779   5.713  -9.788
  122   2HE   LYS  13          1HE       LYS  13   7.525   4.873  -8.259
  123   1HZ   LYS  13          1HZ       LYS  13   5.375   4.628 -10.190
  124   2HZ   LYS  13          2HZ       LYS  13   6.066   3.458  -9.183
  125   3HZ   LYS  13          3HZ       LYS  13   6.828   3.881 -10.631
  126    H    GLY  14           H        GLY  14   5.189   2.379  -5.002
  127   1HA   GLY  14          2HA       GLY  14   7.203   2.601  -3.054
  128   2HA   GLY  14          1HA       GLY  14   5.663   2.416  -2.234
  129    H    GLU  15           H        GLU  15   6.878   0.486  -1.439
  130    HA   GLU  15           HA       GLU  15   6.104  -1.814  -3.053
  131   1HB   GLU  15          2HB       GLU  15   8.894  -1.464  -1.940
  132   2HB   GLU  15          1HB       GLU  15   8.275  -2.929  -2.688
  133   1HG   GLU  15          2HG       GLU  15   7.977  -1.736  -4.793
  134   2HG   GLU  15          1HG       GLU  15   8.586  -0.260  -4.046
  135    H    THR  16           H        THR  16   5.824  -3.740  -1.841
  136    HA   THR  16           HA       THR  16   6.148  -3.630   1.035
  137    HB   THR  16           HB       THR  16   4.040  -2.672   1.095
  138    HG1  THR  16           1HG      THR  16   3.386  -5.396   0.928
  139   1HG2  THR  16          1HG2      THR  16   2.141  -3.346  -0.323
  140   2HG2  THR  16          2HG2      THR  16   3.236  -4.382  -1.236
  141   3HG2  THR  16          3HG2      THR  16   3.478  -2.637  -1.229
  142    H    THR  17           H        THR  17   5.364  -5.769   2.052
  143    HA   THR  17           HA       THR  17   5.526  -8.003   0.170
  144    HB   THR  17           HB       THR  17   7.260  -9.108   1.569
  145    HG1  THR  17           1HG      THR  17   7.355  -6.558   2.798
  146   1HG2  THR  17          1HG2      THR  17   8.138  -8.157  -0.376
  147   2HG2  THR  17          2HG2      THR  17   9.169  -7.568   0.928
  148   3HG2  THR  17          3HG2      THR  17   7.938  -6.514   0.234
  149    H    THR  18           H        THR  18   4.001  -9.412   0.600
  150    HA   THR  18           HA       THR  18   2.982  -9.689   3.364
  151    HB   THR  18           HB       THR  18   1.319  -8.978   1.657
  152    HG1  THR  18           1HG      THR  18   0.713 -10.315   3.444
  153   1HG2  THR  18          1HG2      THR  18   1.458  -9.837  -0.382
  154   2HG2  THR  18          2HG2      THR  18   0.669 -11.263   0.294
  155   3HG2  THR  18          3HG2      THR  18   2.428 -11.205   0.166
  156    H    GLU  19           H        GLU  19   2.723 -11.787   4.229
  157    HA   GLU  19           HA       GLU  19   4.282 -13.860   2.833
  158   1HB   GLU  19          2HB       GLU  19   5.143 -13.103   5.043
  159   2HB   GLU  19          1HB       GLU  19   3.648 -13.655   5.783
  160   1HG   GLU  19          2HG       GLU  19   5.401 -15.511   4.217
  161   2HG   GLU  19          1HG       GLU  19   5.696 -15.171   5.920
  162    H    ALA  20           H        ALA  20   3.134 -15.450   1.930
  163    HA   ALA  20           HA       ALA  20   0.833 -16.528   3.344
  164   1HB   ALA  20          1HB       ALA  20   0.384 -14.613   1.460
  165   2HB   ALA  20          2HB       ALA  20  -0.776 -15.848   1.951
  166   3HB   ALA  20          3HB       ALA  20   0.224 -16.095   0.518
  167    H    VAL  21           H        VAL  21   0.192 -18.572   2.665
  168    HA   VAL  21           HA       VAL  21   2.151 -20.394   2.038
  169    HB   VAL  21           HB       VAL  21  -0.755 -20.773   1.320
  170   1HG1  VAL  21          1HG1      VAL  21   1.208 -22.822   2.312
  171   2HG1  VAL  21          2HG1      VAL  21   0.964 -22.483   0.599
  172   3HG1  VAL  21          3HG1      VAL  21  -0.374 -23.086   1.578
  173   1HG2  VAL  21          1HG2      VAL  21   0.619 -20.763   3.976
  174   2HG2  VAL  21          2HG2      VAL  21  -0.780 -21.802   3.701
  175   3HG2  VAL  21          3HG2      VAL  21  -0.930 -20.054   3.510
  176    H    ASP  22           H        ASP  22   0.226 -18.482  -0.148
  177    HA   ASP  22           HA       ASP  22   1.921 -19.305  -2.348
  178   1HB   ASP  22          2HB       ASP  22  -0.078 -19.774  -3.834
  179   2HB   ASP  22          1HB       ASP  22   0.291 -21.002  -2.628
  180    H    ALA  23           H        ALA  23   1.275 -18.098  -4.416
  181    HA   ALA  23           HA       ALA  23   1.417 -15.364  -3.930
  182   1HB   ALA  23          1HB       ALA  23   1.629 -17.011  -6.151
  183   2HB   ALA  23          2HB       ALA  23   1.866 -15.264  -6.108
  184   3HB   ALA  23          3HB       ALA  23   0.290 -15.930  -6.534
  185    H    ALA  24           H        ALA  24  -1.377 -17.371  -4.728
  186    HA   ALA  24           HA       ALA  24  -3.226 -15.255  -4.996
  187   1HB   ALA  24          1HB       ALA  24  -4.797 -17.283  -4.146
  188   2HB   ALA  24          2HB       ALA  24  -3.377 -18.185  -4.672
  189   3HB   ALA  24          3HB       ALA  24  -4.216 -17.125  -5.803
  190    H    THR  25           H        THR  25  -2.596 -17.430  -2.220
  191    HA   THR  25           HA       THR  25  -4.265 -16.207  -0.392
  192    HB   THR  25           HB       THR  25  -2.619 -17.050   1.334
  193    HG1  THR  25           1HG      THR  25  -1.118 -17.387  -0.957
  194   1HG2  THR  25          1HG2      THR  25  -3.558 -18.944  -0.792
  195   2HG2  THR  25          2HG2      THR  25  -4.352 -18.545   0.731
  196   3HG2  THR  25          3HG2      THR  25  -2.843 -19.459   0.735
  197    H    ALA  26           H        ALA  26  -0.911 -15.437  -1.256
  198    HA   ALA  26           HA       ALA  26  -0.564 -13.303   0.546
  199   1HB   ALA  26          1HB       ALA  26   0.744 -13.114  -2.105
  200   2HB   ALA  26          2HB       ALA  26   1.084 -14.562  -1.157
  201   3HB   ALA  26          3HB       ALA  26   1.434 -12.969  -0.488
  202    H    GLU  27           H        GLU  27  -1.530 -13.335  -2.892
  203    HA   GLU  27           HA       GLU  27  -1.996 -10.646  -3.247
  204   1HB   GLU  27          2HB       GLU  27  -2.035 -12.263  -5.070
  205   2HB   GLU  27          1HB       GLU  27  -3.496 -12.990  -4.416
  206   1HG   GLU  27          2HG       GLU  27  -4.718 -10.921  -4.825
  207   2HG   GLU  27          1HG       GLU  27  -3.252 -10.181  -5.469
  208    H    LYS  28           H        LYS  28  -4.267 -13.137  -2.102
  209    HA   LYS  28           HA       LYS  28  -6.499 -11.484  -1.791
  210   1HB   LYS  28          2HB       LYS  28  -5.717 -13.971  -0.262
  211   2HB   LYS  28          1HB       LYS  28  -7.306 -13.221  -0.199
  212   1HG   LYS  28          2HG       LYS  28  -5.990 -14.425  -2.625
  213   2HG   LYS  28          1HG       LYS  28  -7.334 -15.104  -1.705
  214   1HD   LYS  28          2HD       LYS  28  -8.704 -13.154  -2.293
  215   2HD   LYS  28          1HD       LYS  28  -7.361 -12.506  -3.238
  216   1HE   LYS  28          2HE       LYS  28  -8.793 -15.114  -3.744
  217   2HE   LYS  28          1HE       LYS  28  -8.997 -13.627  -4.669
  218   1HZ   LYS  28          1HZ       LYS  28  -6.466 -15.165  -4.430
  219   2HZ   LYS  28          2HZ       LYS  28  -6.688 -13.758  -5.343
  220   3HZ   LYS  28          3HZ       LYS  28  -7.500 -15.178  -5.771
  221    H    VAL  29           H        VAL  29  -3.852 -12.237   0.413
  222    HA   VAL  29           HA       VAL  29  -4.883 -10.954   2.691
  223    HB   VAL  29           HB       VAL  29  -1.980 -11.269   1.888
  224   1HG1  VAL  29          1HG1      VAL  29  -1.593 -11.156   4.358
  225   2HG1  VAL  29          2HG1      VAL  29  -3.270 -10.638   4.535
  226   3HG1  VAL  29          3HG1      VAL  29  -2.132  -9.644   3.626
  227   1HG2  VAL  29          1HG2      VAL  29  -3.004 -13.059   3.938
  228   2HG2  VAL  29          2HG2      VAL  29  -2.070 -13.419   2.487
  229   3HG2  VAL  29          3HG2      VAL  29  -3.824 -13.262   2.391
  230    H    VAL  30           H        VAL  30  -3.160  -9.775  -0.115
  231    HA   VAL  30           HA       VAL  30  -2.631  -7.166   0.880
  232    HB   VAL  30           HB       VAL  30  -3.044  -7.872  -2.022
  233   1HG1  VAL  30          1HG1      VAL  30  -1.024  -5.966  -0.908
  234   2HG1  VAL  30          2HG1      VAL  30  -2.701  -5.468  -1.127
  235   3HG1  VAL  30          3HG1      VAL  30  -1.753  -6.006  -2.513
  236   1HG2  VAL  30          1HG2      VAL  30  -1.487  -9.471  -1.642
  237   2HG2  VAL  30          2HG2      VAL  30  -0.895  -8.698  -0.171
  238   3HG2  VAL  30          3HG2      VAL  30  -0.386  -8.096  -1.748
  239    H    LYS  31           H        LYS  31  -5.222  -8.509  -1.216
  240    HA   LYS  31           HA       LYS  31  -6.726  -6.255  -1.676
  241   1HB   LYS  31          2HB       LYS  31  -7.542  -9.104  -1.192
  242   2HB   LYS  31          1HB       LYS  31  -8.761  -7.861  -1.429
  243   1HG   LYS  31          2HG       LYS  31  -8.296  -9.034  -3.495
  244   2HG   LYS  31          1HG       LYS  31  -7.812  -7.341  -3.614
  245   1HD   LYS  31          2HD       LYS  31  -5.490  -7.987  -3.181
  246   2HD   LYS  31          1HD       LYS  31  -5.991  -9.676  -3.079
  247   1HE   LYS  31          2HE       LYS  31  -5.018  -8.895  -5.302
  248   2HE   LYS  31          1HE       LYS  31  -6.547  -9.770  -5.355
  249   1HZ   LYS  31          1HZ       LYS  31  -7.673  -7.942  -6.015
  250   2HZ   LYS  31          2HZ       LYS  31  -6.164  -7.502  -6.633
  251   3HZ   LYS  31          3HZ       LYS  31  -6.689  -6.866  -5.158
  252    H    GLN  32           H        GLN  32  -6.757  -8.352   1.146
  253    HA   GLN  32           HA       GLN  32  -8.744  -6.892   2.554
  254   1HB   GLN  32          2HB       GLN  32  -8.258  -9.217   3.052
  255   2HB   GLN  32          1HB       GLN  32  -6.626  -8.794   3.552
  256   1HG   GLN  32          2HG       GLN  32  -7.458  -7.577   5.439
  257   2HG   GLN  32          1HG       GLN  32  -9.120  -7.787   4.895
  258   1HE2  GLN  32          1HE2      GLN  32  -7.694 -10.609   4.130
  259   2HE2  GLN  32          2HE2      GLN  32  -8.008 -11.506   5.570
  260    H    PHE  33           H        PHE  33  -5.230  -6.847   2.468
  261    HA   PHE  33           HA       PHE  33  -4.640  -5.148   4.570
  262   1HB   PHE  33          2HB       PHE  33  -2.987  -6.312   3.080
  263   2HB   PHE  33          1HB       PHE  33  -3.335  -5.123   1.834
  264    HD1  PHE  33           1HD      PHE  33  -2.188  -5.367   5.362
  265    HD2  PHE  33           2HD      PHE  33  -2.032  -3.219   1.684
  266    HE1  PHE  33           1HE      PHE  33  -0.451  -3.895   6.292
  267    HE2  PHE  33           2HE      PHE  33  -0.293  -1.748   2.615
  268    HZ   PHE  33           HZ       PHE  33   0.498  -2.090   4.925
  269    H    PHE  34           H        PHE  34  -5.440  -4.350   1.236
  270    HA   PHE  34           HA       PHE  34  -5.585  -1.512   1.744
  271   1HB   PHE  34          2HB       PHE  34  -6.379  -3.125  -0.684
  272   2HB   PHE  34          1HB       PHE  34  -6.343  -1.361  -0.603
  273    HD1  PHE  34           1HD      PHE  34  -3.939  -0.840   0.916
  274    HD2  PHE  34           2HD      PHE  34  -4.644  -3.723  -2.130
  275    HE1  PHE  34           1HE      PHE  34  -1.540  -0.868   0.398
  276    HE2  PHE  34           2HE      PHE  34  -2.243  -3.752  -2.659
  277    HZ   PHE  34           HZ       PHE  34  -0.694  -2.326  -1.381
  278    H    ASN  35           H        ASN  35  -7.827  -4.185   1.421
  279    HA   ASN  35           HA       ASN  35 -10.260  -2.882   1.287
  280   1HB   ASN  35          2HB       ASN  35 -10.003  -5.348   1.249
  281   2HB   ASN  35          1HB       ASN  35  -9.585  -5.321   2.961
  282   1HD2  ASN  35          1HD2      ASN  35 -11.974  -5.977   0.904
  283   2HD2  ASN  35          2HD2      ASN  35 -13.346  -5.667   1.905
  284    H    ASP  36           H        ASP  36  -8.190  -3.515   4.032
  285    HA   ASP  36           HA       ASP  36  -9.980  -2.091   5.840
  286   1HB   ASP  36          2HB       ASP  36  -7.440  -3.627   6.408
  287   2HB   ASP  36          1HB       ASP  36  -8.474  -2.893   7.630
  288    H    ASN  37           H        ASN  37  -6.973  -1.531   4.150
  289    HA   ASN  37           HA       ASN  37  -6.191   0.632   5.903
  290   1HB   ASN  37          2HB       ASN  37  -5.175  -0.188   3.170
  291   2HB   ASN  37          1HB       ASN  37  -4.529   1.167   4.087
  292   1HD2  ASN  37          1HD2      ASN  37  -3.393  -1.457   3.156
  293   2HD2  ASN  37          2HD2      ASN  37  -2.700  -2.147   4.581
  294    H    GLY  38           H        GLY  38  -7.571   0.262   2.689
  295   1HA   GLY  38          2HA       GLY  38  -8.006   2.271   1.313
  296   2HA   GLY  38          1HA       GLY  38  -9.456   1.637   2.054
  297    H    VAL  39           H        VAL  39 -10.715   3.121   2.811
  298    HA   VAL  39           HA       VAL  39  -9.561   5.691   3.668
  299    HB   VAL  39           HB       VAL  39 -12.356   5.071   2.766
  300   1HG1  VAL  39          1HG1      VAL  39 -12.711   7.027   3.857
  301   2HG1  VAL  39          2HG1      VAL  39 -12.083   7.712   2.357
  302   3HG1  VAL  39          3HG1      VAL  39 -11.020   7.517   3.750
  303   1HG2  VAL  39          1HG2      VAL  39  -9.918   5.530   1.268
  304   2HG2  VAL  39          2HG2      VAL  39 -11.173   6.700   0.863
  305   3HG2  VAL  39          3HG2      VAL  39 -11.497   4.973   0.714
  306    H    ASP  40           H        ASP  40 -10.647   2.994   5.226
  307    HA   ASP  40           HA       ASP  40 -11.831   4.629   7.361
  308   1HB   ASP  40          2HB       ASP  40 -12.611   1.815   6.575
  309   2HB   ASP  40          1HB       ASP  40 -13.242   2.693   7.964
  310    H    GLY  41           H        GLY  41  -9.070   3.253   6.670
  311   1HA   GLY  41          2HA       GLY  41  -8.721   1.477   8.919
  312   2HA   GLY  41          1HA       GLY  41  -7.475   1.996   7.796
  313    H    GLU  42           H        GLU  42  -6.678   1.830  10.289
  314    HA   GLU  42           HA       GLU  42  -6.943   4.445  11.578
  315   1HB   GLU  42          2HB       GLU  42  -5.545   1.932  12.516
  316   2HB   GLU  42          1HB       GLU  42  -5.740   3.404  13.457
  317   1HG   GLU  42          2HG       GLU  42  -7.964   1.632  12.471
  318   2HG   GLU  42          1HG       GLU  42  -7.343   1.702  14.120
  319    H    TRP  43           H        TRP  43  -5.660   5.908  10.579
  320    HA   TRP  43           HA       TRP  43  -2.927   5.134   9.865
  321   1HB   TRP  43          2HB       TRP  43  -4.504   7.603   9.139
  322   2HB   TRP  43          1HB       TRP  43  -2.904   7.191   8.536
  323    HD1  TRP  43           HD       TRP  43  -5.924   4.764   8.706
  324    HE1  TRP  43           1HE      TRP  43  -6.449   4.008   6.301
  325    HE3  TRP  43           3HE      TRP  43  -2.587   7.691   6.192
  326    HZ2  TRP  43           2HZ      TRP  43  -5.566   4.575   3.691
  327    HZ3  TRP  43           3HZ      TRP  43  -2.487   7.531   3.746
  328    HH2  TRP  43           HH       TRP  43  -3.953   6.003   2.517
  329    H    THR  44           H        THR  44  -1.281   5.698  11.117
  330    HA   THR  44           HA       THR  44  -1.604   7.970  12.958
  331    HB   THR  44           HB       THR  44   0.351   6.979  14.165
  332    HG1  THR  44           1HG      THR  44   1.440   5.569  13.082
  333   1HG2  THR  44          1HG2      THR  44  -0.808   5.344  15.324
  334   2HG2  THR  44          2HG2      THR  44  -1.708   4.830  13.899
  335   3HG2  THR  44          3HG2      THR  44  -2.087   6.368  14.674
  336    H    TYR  45           H        TYR  45  -0.300   9.743  12.720
  337    HA   TYR  45           HA       TYR  45   1.635   9.627  10.502
  338   1HB   TYR  45          2HB       TYR  45  -0.278  11.130  10.141
  339   2HB   TYR  45          1HB       TYR  45   0.148  12.016  11.602
  340    HD1  TYR  45           1HD      TYR  45   2.377  10.743   8.900
  341    HD2  TYR  45           2HD      TYR  45   0.719  14.145  10.844
  342    HE1  TYR  45           1HE      TYR  45   3.844  12.206   7.576
  343    HE2  TYR  45           2HE      TYR  45   2.182  15.618   9.525
  344    HH   TYR  45           HH       TYR  45   4.236  15.543   8.275
  345    H    ASP  46           H        ASP  46   3.658  10.525  10.687
  346    HA   ASP  46           HA       ASP  46   4.479  11.383  13.382
  347   1HB   ASP  46          2HB       ASP  46   5.316   9.115  12.921
  348   2HB   ASP  46          1HB       ASP  46   6.071   9.691  11.438
  349    H    ASP  47           H        ASP  47   4.125  13.555  12.624
  350    HA   ASP  47           HA       ASP  47   5.116  14.767  10.381
  351   1HB   ASP  47          2HB       ASP  47   5.004  15.936  13.167
  352   2HB   ASP  47          1HB       ASP  47   5.158  16.868  11.681
  353    H    ALA  48           H        ALA  48   6.879  13.940  13.309
  354    HA   ALA  48           HA       ALA  48   9.193  15.385  13.020
  355   1HB   ALA  48          1HB       ALA  48   9.675  12.608  13.814
  356   2HB   ALA  48          2HB       ALA  48   8.359  13.399  14.685
  357   3HB   ALA  48          3HB       ALA  48   9.972  14.111  14.688
  358    H    THR  49           H        THR  49   8.161  12.619  11.147
  359    HA   THR  49           HA       THR  49  10.617  12.878   9.543
  360    HB   THR  49           HB       THR  49  10.537  10.446   9.117
  361    HG1  THR  49           1HG      THR  49   8.371  10.585  10.923
  362   1HG2  THR  49          1HG2      THR  49  10.555  10.174  11.963
  363   2HG2  THR  49          2HG2      THR  49  11.377  11.661  11.492
  364   3HG2  THR  49          3HG2      THR  49  11.898  10.115  10.824
  365    H    LYS  50           H        LYS  50   7.562  13.650   9.431
  366    HA   LYS  50           HA       LYS  50   5.924  13.832   7.839
  367   1HB   LYS  50          2HB       LYS  50   8.351  13.730   6.048
  368   2HB   LYS  50          1HB       LYS  50   6.747  14.245   5.540
  369   1HG   LYS  50          2HG       LYS  50   7.229  15.805   7.752
  370   2HG   LYS  50          1HG       LYS  50   8.811  15.702   6.975
  371   1HD   LYS  50          2HD       LYS  50   6.236  16.523   5.642
  372   2HD   LYS  50          1HD       LYS  50   7.521  17.619   6.157
  373   1HE   LYS  50          2HE       LYS  50   7.769  15.435   4.090
  374   2HE   LYS  50          1HE       LYS  50   7.657  17.163   3.761
  375   1HZ   LYS  50          1HZ       LYS  50   9.726  17.109   5.429
  376   2HZ   LYS  50          2HZ       LYS  50   9.885  16.999   3.749
  377   3HZ   LYS  50          3HZ       LYS  50   9.914  15.597   4.695
  378    H    THR  51           H        THR  51   6.503  11.156   8.730
  379    HA   THR  51           HA       THR  51   5.790   9.643   6.308
  380    HB   THR  51           HB       THR  51   7.328   8.708   8.739
  381    HG1  THR  51           1HG      THR  51   9.024   8.518   7.284
  382   1HG2  THR  51          1HG2      THR  51   5.758   7.133   7.080
  383   2HG2  THR  51          2HG2      THR  51   7.037   6.593   8.167
  384   3HG2  THR  51          3HG2      THR  51   7.402   6.931   6.476
  385    H    PHE  52           H        PHE  52   4.005   8.390   6.364
  386    HA   PHE  52           HA       PHE  52   2.407   8.458   8.833
  387   1HB   PHE  52          2HB       PHE  52   1.469   7.880   6.014
  388   2HB   PHE  52          1HB       PHE  52   0.456   8.126   7.431
  389    HD1  PHE  52           1HD      PHE  52  -0.530  10.177   7.686
  390    HD2  PHE  52           2HD      PHE  52   3.116   9.907   5.508
  391    HE1  PHE  52           1HE      PHE  52  -0.676  12.575   7.150
  392    HE2  PHE  52           2HE      PHE  52   2.981  12.305   4.975
  393    HZ   PHE  52           HZ       PHE  52   1.082  13.641   5.796
  394    H    THR  53           H        THR  53   1.517   6.547   9.656
  395    HA   THR  53           HA       THR  53   2.468   4.074   8.381
  396    HB   THR  53           HB       THR  53   2.347   3.156  10.816
  397    HG1  THR  53           1HG      THR  53   2.868   5.883  11.353
  398   1HG2  THR  53          1HG2      THR  53   4.478   3.000  10.143
  399   2HG2  THR  53          2HG2      THR  53   4.692   4.378  11.227
  400   3HG2  THR  53          3HG2      THR  53   4.509   4.642   9.493
  401    H    VAL  54           H        VAL  54   1.011   2.626   7.892
  402    HA   VAL  54           HA       VAL  54  -1.730   2.980   8.913
  403    HB   VAL  54           HB       VAL  54  -0.850   1.527   6.405
  404   1HG1  VAL  54          1HG1      VAL  54  -3.183   1.397   5.856
  405   2HG1  VAL  54          2HG1      VAL  54  -3.617   2.342   7.279
  406   3HG1  VAL  54          3HG1      VAL  54  -2.950   0.720   7.467
  407   1HG2  VAL  54          1HG2      VAL  54  -2.459   3.968   6.155
  408   2HG2  VAL  54          2HG2      VAL  54  -1.082   3.411   5.204
  409   3HG2  VAL  54          3HG2      VAL  54  -0.816   4.223   6.746
  410    H    THR  55           H        THR  55  -2.089   1.635  10.573
  411    HA   THR  55           HA       THR  55  -0.791  -0.990  10.533
  412    HB   THR  55           HB       THR  55  -2.262   0.251  12.850
  413    HG1  THR  55           1HG      THR  55  -0.345   1.102  13.497
  414   1HG2  THR  55          1HG2      THR  55  -0.657  -1.192  14.138
  415   2HG2  THR  55          2HG2      THR  55  -0.268  -1.980  12.608
  416   3HG2  THR  55          3HG2      THR  55  -1.912  -2.050  13.245
  417    H    GLU  56           H        GLU  56  -1.889  -2.644   9.790
  418    HA   GLU  56           HA       GLU  56  -4.609  -2.655   9.186
  419   1HB   GLU  56          2HB       GLU  56  -3.019  -4.194   8.157
  420   2HB   GLU  56          1HB       GLU  56  -2.758  -4.989   9.703
  421   1HG   GLU  56          2HG       GLU  56  -4.221  -6.295   8.274
  422   2HG   GLU  56          1HG       GLU  56  -5.068  -5.751   9.722
  423   1H    MET   1          1HT       MET   1   7.128  19.903  -2.136
  424   2H    MET   1          2HT       MET   1   5.712  18.997  -2.319
  425   3H    MET   1          3HT       MET   1   7.148  18.477  -3.047
  426    HA   MET   1           HA       MET   1   8.147  18.235  -0.817
  427   1HB   MET   1          2HB       MET   1   5.284  18.784  -0.007
  428   2HB   MET   1          1HB       MET   1   6.520  18.165   1.079
  429   1HG   MET   1          2HG       MET   1   6.593  20.818  -0.338
  430   2HG   MET   1          1HG       MET   1   6.188  20.560   1.357
  431   1HE   MET   1          1HE       MET   1   8.253  18.236   2.098
  432   2HE   MET   1          2HE       MET   1   7.941  19.609   3.160
  433   3HE   MET   1          3HE       MET   1   9.600  19.170   2.751
  434    H    GLN   2           H        GLN   2   8.488  16.131  -0.448
  435    HA   GLN   2           HA       GLN   2   6.481  14.223  -1.436
  436   1HB   GLN   2          2HB       GLN   2   8.646  14.111  -2.581
  437   2HB   GLN   2          1HB       GLN   2   9.460  13.867  -1.042
  438   1HG   GLN   2          2HG       GLN   2   8.279  11.748  -0.753
  439   2HG   GLN   2          1HG       GLN   2   7.466  11.992  -2.298
  440   1HE2  GLN   2          1HE2      GLN   2   8.313  10.859  -3.877
  441   2HE2  GLN   2          2HE2      GLN   2   9.978  10.438  -4.059
  442    H    TYR   3           H        TYR   3   5.846  12.483  -0.173
  443    HA   TYR   3           HA       TYR   3   6.806  12.488   2.610
  444   1HB   TYR   3          2HB       TYR   3   3.945  12.171   1.676
  445   2HB   TYR   3          1HB       TYR   3   4.494  11.961   3.336
  446    HD1  TYR   3           1HD      TYR   3   4.393  13.768   4.781
  447    HD2  TYR   3           2HD      TYR   3   4.527  14.492   0.591
  448    HE1  TYR   3           1HE      TYR   3   4.082  16.172   5.191
  449    HE2  TYR   3           2HE      TYR   3   4.217  16.898   0.989
  450    HH   TYR   3           HH       TYR   3   4.515  18.528   2.742
  451    H    LYS   4           H        LYS   4   6.911  10.486   3.642
  452    HA   LYS   4           HA       LYS   4   6.761   8.193   1.799
  453   1HB   LYS   4          2HB       LYS   4   9.001   8.693   2.709
  454   2HB   LYS   4          1HB       LYS   4   8.375   8.484   4.339
  455   1HG   LYS   4          2HG       LYS   4   7.903   6.154   3.894
  456   2HG   LYS   4          1HG       LYS   4   8.430   6.344   2.220
  457   1HD   LYS   4          2HD       LYS   4  10.681   6.934   3.019
  458   2HD   LYS   4          1HD       LYS   4  10.144   6.690   4.682
  459   1HE   LYS   4          2HE       LYS   4   9.656   4.350   4.187
  460   2HE   LYS   4          1HE       LYS   4  10.164   4.591   2.516
  461   1HZ   LYS   4          1HZ       LYS   4  11.778   4.350   4.932
  462   2HZ   LYS   4          2HZ       LYS   4  12.332   5.428   3.753
  463   3HZ   LYS   4          3HZ       LYS   4  12.091   3.800   3.363
  464    H    VAL   5           H        VAL   5   4.969   7.051   2.049
  465    HA   VAL   5           HA       VAL   5   3.705   6.895   4.675
  466    HB   VAL   5           HB       VAL   5   2.694   5.913   2.001
  467   1HG1  VAL   5          1HG1      VAL   5   1.862   5.179   4.541
  468   2HG1  VAL   5          2HG1      VAL   5   0.949   4.998   3.045
  469   3HG1  VAL   5          3HG1      VAL   5   0.714   6.425   4.054
  470   1HG2  VAL   5          1HG2      VAL   5   2.989   8.511   2.768
  471   2HG2  VAL   5          2HG2      VAL   5   1.343   8.160   3.296
  472   3HG2  VAL   5          3HG2      VAL   5   1.796   7.925   1.609
  473    H    ILE   6           H        ILE   6   3.826   5.192   5.922
  474    HA   ILE   6           HA       ILE   6   5.125   2.762   4.918
  475    HB   ILE   6           HB       ILE   6   4.731   3.789   7.730
  476   1HG1  ILE   6          2HG1      ILE   6   7.216   3.385   6.053
  477   2HG1  ILE   6          1HG1      ILE   6   6.474   4.934   6.440
  478   1HG2  ILE   6          1HG2      ILE   6   6.516   1.723   7.920
  479   2HG2  ILE   6          2HG2      ILE   6   5.340   1.106   6.758
  480   3HG2  ILE   6          3HG2      ILE   6   4.806   1.645   8.350
  481   1HD1  ILE   6          1HD1      ILE   6   7.763   3.020   8.365
  482   2HD1  ILE   6          2HD1      ILE   6   6.918   4.496   8.830
  483   3HD1  ILE   6          3HD1      ILE   6   8.379   4.588   7.847
  484    H    LEU   7           H        LEU   7   3.930   1.024   4.536
  485    HA   LEU   7           HA       LEU   7   1.230   0.875   5.677
  486   1HB   LEU   7          2HB       LEU   7   2.295  -0.912   3.509
  487   2HB   LEU   7          1HB       LEU   7   0.630  -0.489   3.859
  488    HG   LEU   7           HG       LEU   7   2.723   1.243   2.566
  489   1HD1  LEU   7          1HD1      LEU   7   1.625  -0.377   1.113
  490   2HD1  LEU   7          2HD1      LEU   7   1.154   1.272   0.706
  491   3HD1  LEU   7          3HD1      LEU   7   0.048   0.236   1.609
  492   1HD2  LEU   7          1HD2      LEU   7   1.429   2.564   4.178
  493   2HD2  LEU   7          2HD2      LEU   7  -0.065   2.020   3.420
  494   3HD2  LEU   7          3HD2      LEU   7   1.069   3.022   2.513
  495    H    ASN   8           H        ASN   8   1.998   0.202   7.736
  496    HA   ASN   8           HA       ASN   8   3.360  -2.364   7.912
  497   1HB   ASN   8          2HB       ASN   8   4.000  -0.359   9.304
  498   2HB   ASN   8          1HB       ASN   8   2.469  -0.544  10.153
  499   1HD2  ASN   8          1HD2      ASN   8   5.547  -0.978  10.593
  500   2HD2  ASN   8          2HD2      ASN   8   5.572  -2.427  11.536
  501    H    GLY   9           H        GLY   9   2.119  -4.126   7.766
  502   1HA   GLY   9          2HA       GLY   9  -0.440  -4.119   9.244
  503   2HA   GLY   9          1HA       GLY   9  -0.200  -4.997   7.741
  504    H    LYS  10           H        LYS  10  -1.049  -6.764   9.178
  505    HA   LYS  10           HA       LYS  10   0.867  -7.835  11.079
  506   1HB   LYS  10          2HB       LYS  10  -1.781  -8.948  10.126
  507   2HB   LYS  10          1HB       LYS  10  -0.817  -9.582  11.453
  508   1HG   LYS  10          2HG       LYS  10  -1.149  -7.554  12.718
  509   2HG   LYS  10          1HG       LYS  10  -2.013  -6.821  11.368
  510   1HD   LYS  10          2HD       LYS  10  -3.622  -7.579  12.973
  511   2HD   LYS  10          1HD       LYS  10  -3.716  -8.628  11.559
  512   1HE   LYS  10          2HE       LYS  10  -2.129  -9.298  14.029
  513   2HE   LYS  10          1HE       LYS  10  -3.804  -9.790  13.790
  514   1HZ   LYS  10          1HZ       LYS  10  -2.551 -10.584  11.503
  515   2HZ   LYS  10          2HZ       LYS  10  -2.960 -11.580  12.807
  516   3HZ   LYS  10          3HZ       LYS  10  -1.409 -10.915  12.707
  517    H    THR  11           H        THR  11  -0.766  -9.018   8.146
  518    HA   THR  11           HA       THR  11   1.346 -10.989   7.750
  519    HB   THR  11           HB       THR  11  -0.234 -11.725   5.872
  520    HG1  THR  11           1HG      THR  11  -2.440 -11.003   6.319
  521   1HG2  THR  11          1HG2      THR  11  -0.106 -12.640   8.319
  522   2HG2  THR  11          2HG2      THR  11  -1.410 -13.128   7.235
  523   3HG2  THR  11          3HG2      THR  11  -1.695 -11.885   8.453
  524    H    LEU  12           H        LEU  12   0.675  -7.855   6.884
  525    HA   LEU  12           HA       LEU  12   2.399  -8.083   4.530
  526   1HB   LEU  12          2HB       LEU  12   0.100  -7.871   3.741
  527   2HB   LEU  12          1HB       LEU  12  -0.113  -6.424   4.707
  528    HG   LEU  12           HG       LEU  12   1.337  -5.171   3.320
  529   1HD1  LEU  12          1HD1      LEU  12   2.198  -6.742   1.253
  530   2HD1  LEU  12          2HD1      LEU  12   2.364  -7.808   2.643
  531   3HD1  LEU  12          3HD1      LEU  12   3.170  -6.246   2.639
  532   1HD2  LEU  12          1HD2      LEU  12   0.146  -6.625   1.091
  533   2HD2  LEU  12          2HD2      LEU  12  -0.090  -4.958   1.616
  534   3HD2  LEU  12          3HD2      LEU  12  -0.992  -6.264   2.388
  535    H    LYS  13           H        LYS  13   3.958  -6.587   4.373
  536    HA   LYS  13           HA       LYS  13   3.830  -4.161   5.995
  537   1HB   LYS  13          2HB       LYS  13   6.120  -6.131   6.168
  538   2HB   LYS  13          1HB       LYS  13   6.073  -4.548   6.931
  539   1HG   LYS  13          2HG       LYS  13   4.222  -5.245   8.330
  540   2HG   LYS  13          1HG       LYS  13   4.182  -6.816   7.526
  541   1HD   LYS  13          2HD       LYS  13   5.340  -6.953   9.673
  542   2HD   LYS  13          1HD       LYS  13   6.440  -7.290   8.334
  543   1HE   LYS  13          2HE       LYS  13   7.499  -5.846   9.984
  544   2HE   LYS  13          1HE       LYS  13   7.287  -5.000   8.452
  545   1HZ   LYS  13          1HZ       LYS  13   5.118  -4.703  10.354
  546   2HZ   LYS  13          2HZ       LYS  13   5.850  -3.550   9.356
  547   3HZ   LYS  13          3HZ       LYS  13   6.581  -3.992  10.816
  548    H    GLY  14           H        GLY  14   5.059  -2.452   5.163
  549   1HA   GLY  14          2HA       GLY  14   7.093  -2.723   3.245
  550   2HA   GLY  14          1HA       GLY  14   5.571  -2.501   2.402
  551    H    GLU  15           H        GLU  15   6.843  -0.599   1.626
  552    HA   GLU  15           HA       GLU  15   6.103   1.718   3.228
  553   1HB   GLU  15          2HB       GLU  15   8.899   1.301   2.154
  554   2HB   GLU  15          1HB       GLU  15   8.305   2.780   2.894
  555   1HG   GLU  15          2HG       GLU  15   7.950   1.595   4.995
  556   2HG   GLU  15          1HG       GLU  15   8.531   0.104   4.256
  557    H    THR  16           H        THR  16   5.887   3.650   2.014
  558    HA   THR  16           HA       THR  16   6.248   3.532  -0.858
  559    HB   THR  16           HB       THR  16   4.120   2.624  -0.949
  560    HG1  THR  16           1HG      THR  16   3.530   5.364  -0.791
  561   1HG2  THR  16          1HG2      THR  16   2.217   3.345   0.443
  562   2HG2  THR  16          2HG2      THR  16   3.324   4.353   1.372
  563   3HG2  THR  16          3HG2      THR  16   3.524   2.603   1.368
  564    H    THR  17           H        THR  17   5.531   5.691  -1.887
  565    HA   THR  17           HA       THR  17   5.720   7.918  -0.001
  566    HB   THR  17           HB       THR  17   7.502   8.980  -1.375
  567    HG1  THR  17           1HG      THR  17   7.551   6.429  -2.605
  568   1HG2  THR  17          1HG2      THR  17   8.328   8.009   0.581
  569   2HG2  THR  17          2HG2      THR  17   9.362   7.396  -0.707
  570   3HG2  THR  17          3HG2      THR  17   8.095   6.372  -0.030
  571    H    THR  18           H        THR  18   4.237   9.364  -0.453
  572    HA   THR  18           HA       THR  18   3.263   9.665  -3.231
  573    HB   THR  18           HB       THR  18   1.561   8.995  -1.547
  574    HG1  THR  18           1HG      THR  18   1.011  10.346  -3.341
  575   1HG2  THR  18          1HG2      THR  18   1.691   9.851   0.494
  576   2HG2  THR  18          2HG2      THR  18   0.946  11.295  -0.193
  577   3HG2  THR  18          3HG2      THR  18   2.700  11.196  -0.040
  578    H    GLU  19           H        GLU  19   3.067  11.769  -4.099
  579    HA   GLU  19           HA       GLU  19   4.657  13.804  -2.679
  580   1HB   GLU  19          2HB       GLU  19   5.529  13.026  -4.877
  581   2HB   GLU  19          1HB       GLU  19   4.060  13.614  -5.640
  582   1HG   GLU  19          2HG       GLU  19   5.835  15.427  -4.049
  583   2HG   GLU  19          1HG       GLU  19   6.146  15.079  -5.747
  584    H    ALA  20           H        ALA  20   3.536  15.420  -1.793
  585    HA   ALA  20           HA       ALA  20   1.282  16.555  -3.239
  586   1HB   ALA  20          1HB       ALA  20   0.760  14.652  -1.364
  587   2HB   ALA  20          2HB       ALA  20  -0.364  15.914  -1.869
  588   3HB   ALA  20          3HB       ALA  20   0.622  16.137  -0.422
  589    H    VAL  21           H        VAL  21   0.680  18.613  -2.570
  590    HA   VAL  21           HA       VAL  21   2.674  20.389  -1.916
  591    HB   VAL  21           HB       VAL  21  -0.232  20.838  -1.238
  592   1HG1  VAL  21          1HG1      VAL  21   1.795  22.838  -2.202
  593   2HG1  VAL  21          2HG1      VAL  21   1.518  22.506  -0.492
  594   3HG1  VAL  21          3HG1      VAL  21   0.210  23.140  -1.490
  595   1HG2  VAL  21          1HG2      VAL  21   1.179  20.794  -3.875
  596   2HG2  VAL  21          2HG2      VAL  21  -0.198  21.867  -3.619
  597   3HG2  VAL  21          3HG2      VAL  21  -0.392  20.123  -3.430
  598    H    ASP  22           H        ASP  22   0.672  18.525   0.244
  599    HA   ASP  22           HA       ASP  22   2.357  19.306   2.466
  600   1HB   ASP  22          2HB       ASP  22   0.349  19.824   3.925
  601   2HB   ASP  22          1HB       ASP  22   0.766  21.041   2.724
  602    H    ALA  23           H        ALA  23   1.650  18.116   4.526
  603    HA   ALA  23           HA       ALA  23   1.734  15.378   4.041
  604   1HB   ALA  23          1HB       ALA  23   1.955  17.020   6.265
  605   2HB   ALA  23          2HB       ALA  23   2.150  15.268   6.226
  606   3HB   ALA  23          3HB       ALA  23   0.583  15.971   6.629
  607    H    ALA  24           H        ALA  24  -1.020  17.452   4.802
  608    HA   ALA  24           HA       ALA  24  -2.925  15.382   5.043
  609   1HB   ALA  24          1HB       ALA  24  -4.434  17.448   4.171
  610   2HB   ALA  24          2HB       ALA  24  -2.999  18.316   4.717
  611   3HB   ALA  24          3HB       ALA  24  -3.879  17.276   5.836
  612    H    THR  25           H        THR  25  -2.204  17.541   2.276
  613    HA   THR  25           HA       THR  25  -3.874  16.359   0.423
  614    HB   THR  25           HB       THR  25  -2.186  17.160  -1.279
  615    HG1  THR  25           1HG      THR  25  -0.707  17.462   1.031
  616   1HG2  THR  25          1HG2      THR  25  -3.108  19.078   0.835
  617   2HG2  THR  25          2HG2      THR  25  -3.889  18.698  -0.700
  618   3HG2  THR  25          3HG2      THR  25  -2.359  19.575  -0.682
  619    H    ALA  26           H        ALA  26  -0.552  15.508   1.335
  620    HA   ALA  26           HA       ALA  26  -0.232  13.365  -0.462
  621   1HB   ALA  26          1HB       ALA  26   1.034  13.145   2.207
  622   2HB   ALA  26          2HB       ALA  26   1.421  14.584   1.264
  623   3HB   ALA  26          3HB       ALA  26   1.743  12.983   0.601
  624    H    GLU  27           H        GLU  27  -1.245  13.421   2.961
  625    HA   GLU  27           HA       GLU  27  -1.782  10.743   3.309
  626   1HB   GLU  27          2HB       GLU  27  -1.809  12.362   5.132
  627   2HB   GLU  27          1HB       GLU  27  -3.242  13.124   4.457
  628   1HG   GLU  27          2HG       GLU  27  -4.518  11.086   4.849
  629   2HG   GLU  27          1HG       GLU  27  -3.080  10.311   5.514
  630    H    LYS  28           H        LYS  28  -3.974  13.291   2.133
  631    HA   LYS  28           HA       LYS  28  -6.243  11.691   1.790
  632   1HB   LYS  28          2HB       LYS  28  -5.379  14.158   0.272
  633   2HB   LYS  28          1HB       LYS  28  -6.984  13.447   0.188
  634   1HG   LYS  28          2HG       LYS  28  -5.675  14.620   2.632
  635   2HG   LYS  28          1HG       LYS  28  -6.989  15.331   1.692
  636   1HD   LYS  28          2HD       LYS  28  -8.412  13.414   2.261
  637   2HD   LYS  28          1HD       LYS  28  -7.099  12.735   3.225
  638   1HE   LYS  28          2HE       LYS  28  -8.475  15.376   3.711
  639   2HE   LYS  28          1HE       LYS  28  -8.728  13.894   4.633
  640   1HZ   LYS  28          1HZ       LYS  28  -6.158  15.371   4.430
  641   2HZ   LYS  28          2HZ       LYS  28  -6.427  13.970   5.340
  642   3HZ   LYS  28          3HZ       LYS  28  -7.210  15.409   5.755
  643    H    VAL  29           H        VAL  29  -3.547  12.379  -0.376
  644    HA   VAL  29           HA       VAL  29  -4.578  11.122  -2.669
  645    HB   VAL  29           HB       VAL  29  -1.679  11.366  -1.825
  646   1HG1  VAL  29          1HG1      VAL  29  -1.259  11.243  -4.289
  647   2HG1  VAL  29          2HG1      VAL  29  -2.946  10.766  -4.490
  648   3HG1  VAL  29          3HG1      VAL  29  -1.845   9.745  -3.563
  649   1HG2  VAL  29          1HG2      VAL  29  -2.631  13.179  -3.889
  650   2HG2  VAL  29          2HG2      VAL  29  -1.709  13.517  -2.423
  651   3HG2  VAL  29          3HG2      VAL  29  -3.467  13.403  -2.352
  652    H    VAL  30           H        VAL  30  -2.924   9.902   0.160
  653    HA   VAL  30           HA       VAL  30  -2.444   7.282  -0.826
  654    HB   VAL  30           HB       VAL  30  -2.879   7.997   2.070
  655   1HG1  VAL  30          1HG1      VAL  30  -0.893   6.042   0.984
  656   2HG1  VAL  30          2HG1      VAL  30  -2.585   5.586   1.178
  657   3HG1  VAL  30          3HG1      VAL  30  -1.643   6.099   2.578
  658   1HG2  VAL  30          1HG2      VAL  30  -1.279   9.557   1.712
  659   2HG2  VAL  30          2HG2      VAL  30  -0.686   8.771   0.248
  660   3HG2  VAL  30          3HG2      VAL  30  -0.214   8.156   1.833
  661    H    LYS  31           H        LYS  31  -5.030   8.688   1.232
  662    HA   LYS  31           HA       LYS  31  -6.594   6.469   1.671
  663   1HB   LYS  31          2HB       LYS  31  -7.335   9.338   1.176
  664   2HB   LYS  31          1HB       LYS  31  -8.586   8.125   1.398
  665   1HG   LYS  31          2HG       LYS  31  -8.122   9.286   3.468
  666   2HG   LYS  31          1HG       LYS  31  -7.681   7.583   3.593
  667   1HD   LYS  31          2HD       LYS  31  -5.338   8.171   3.194
  668   2HD   LYS  31          1HD       LYS  31  -5.797   9.873   3.084
  669   1HE   LYS  31          2HE       LYS  31  -4.874   9.067   5.321
  670   2HE   LYS  31          1HE       LYS  31  -6.383   9.981   5.355
  671   1HZ   LYS  31          1HZ       LYS  31  -7.562   8.179   5.996
  672   2HZ   LYS  31          2HZ       LYS  31  -6.072   7.702   6.635
  673   3HZ   LYS  31          3HZ       LYS  31  -6.592   7.079   5.152
  674    H    GLN  32           H        GLN  32  -6.535   8.566  -1.150
  675    HA   GLN  32           HA       GLN  32  -8.536   7.155  -2.587
  676   1HB   GLN  32          2HB       GLN  32  -7.989   9.466  -3.078
  677   2HB   GLN  32          1HB       GLN  32  -6.359   9.004  -3.555
  678   1HG   GLN  32          2HG       GLN  32  -7.193   7.808  -5.454
  679   2HG   GLN  32          1HG       GLN  32  -8.859   8.058  -4.933
  680   1HE2  GLN  32          1HE2      GLN  32  -7.375  10.845  -4.148
  681   2HE2  GLN  32          2HE2      GLN  32  -7.645  11.749  -5.591
  682    H    PHE  33           H        PHE  33  -5.026   7.023  -2.451
  683    HA   PHE  33           HA       PHE  33  -4.448   5.311  -4.545
  684   1HB   PHE  33          2HB       PHE  33  -2.788   6.435  -3.033
  685   2HB   PHE  33          1HB       PHE  33  -3.183   5.256  -1.791
  686    HD1  PHE  33           1HD      PHE  33  -1.982   5.469  -5.303
  687    HD2  PHE  33           2HD      PHE  33  -1.929   3.320  -1.622
  688    HE1  PHE  33           1HE      PHE  33  -0.268   3.956  -6.209
  689    HE2  PHE  33           2HE      PHE  33  -0.213   1.808  -2.528
  690    HZ   PHE  33           HZ       PHE  33   0.620   2.128  -4.827
  691    H    PHE  34           H        PHE  34  -5.316   4.533  -1.223
  692    HA   PHE  34           HA       PHE  34  -5.523   1.699  -1.734
  693   1HB   PHE  34          2HB       PHE  34  -6.310   3.332   0.684
  694   2HB   PHE  34          1HB       PHE  34  -6.316   1.568   0.605
  695    HD1  PHE  34           1HD      PHE  34  -3.904   0.987  -0.882
  696    HD2  PHE  34           2HD      PHE  34  -4.583   3.887   2.154
  697    HE1  PHE  34           1HE      PHE  34  -1.513   0.956  -0.330
  698    HE2  PHE  34           2HE      PHE  34  -2.187   3.858   2.717
  699    HZ   PHE  34           HZ       PHE  34  -0.658   2.395   1.461
  700    H    ASN  35           H        ASN  35  -7.703   4.427  -1.442
  701    HA   ASN  35           HA       ASN  35 -10.169   3.183  -1.341
  702   1HB   ASN  35          2HB       ASN  35  -9.851   5.641  -1.300
  703   2HB   ASN  35          1HB       ASN  35  -9.410   5.605  -3.006
  704   1HD2  ASN  35          1HD2      ASN  35 -11.810   6.319  -0.983
  705   2HD2  ASN  35          2HD2      ASN  35 -13.176   6.042  -2.002
  706    H    ASP  36           H        ASP  36  -8.046   3.765  -4.057
  707    HA   ASP  36           HA       ASP  36  -9.843   2.384  -5.891
  708   1HB   ASP  36          2HB       ASP  36  -7.258   3.859  -6.423
  709   2HB   ASP  36          1HB       ASP  36  -8.294   3.149  -7.660
  710    H    ASN  37           H        ASN  37  -6.874   1.753  -4.159
  711    HA   ASN  37           HA       ASN  37  -6.119  -0.429  -5.900
  712   1HB   ASN  37          2HB       ASN  37  -5.124   0.366  -3.154
  713   2HB   ASN  37          1HB       ASN  37  -4.497  -1.006  -4.060
  714   1HD2  ASN  37          1HD2      ASN  37  -3.310   1.591  -3.114
  715   2HD2  ASN  37          2HD2      ASN  37  -2.581   2.265  -4.530
  716    H    GLY  38           H        GLY  38  -7.537  -0.026  -2.706
  717   1HA   GLY  38          2HA       GLY  38  -8.040  -2.023  -1.336
  718   2HA   GLY  38          1HA       GLY  38  -9.464  -1.354  -2.098
  719    H    VAL  39           H        VAL  39 -10.748  -2.808  -2.875
  720    HA   VAL  39           HA       VAL  39  -9.644  -5.404  -3.714
  721    HB   VAL  39           HB       VAL  39 -12.437  -4.717  -2.852
  722   1HG1  VAL  39          1HG1      VAL  39 -12.822  -6.664  -3.946
  723   2HG1  VAL  39          2HG1      VAL  39 -12.233  -7.363  -2.439
  724   3HG1  VAL  39          3HG1      VAL  39 -11.145  -7.197  -3.817
  725   1HG2  VAL  39          1HG2      VAL  39 -10.031  -5.235  -1.321
  726   2HG2  VAL  39          2HG2      VAL  39 -11.319  -6.373  -0.933
  727   3HG2  VAL  39          3HG2      VAL  39 -11.602  -4.640  -0.788
  728    H    ASP  40           H        ASP  40 -10.641  -2.683  -5.288
  729    HA   ASP  40           HA       ASP  40 -11.836  -4.288  -7.440
  730   1HB   ASP  40          2HB       ASP  40 -12.557  -1.457  -6.663
  731   2HB   ASP  40          1HB       ASP  40 -13.190  -2.319  -8.062
  732    H    GLY  41           H        GLY  41  -9.051  -2.978  -6.710
  733   1HA   GLY  41          2HA       GLY  41  -8.628  -1.213  -8.953
  734   2HA   GLY  41          1HA       GLY  41  -7.413  -1.761  -7.812
  735    H    GLU  42           H        GLU  42  -6.575  -1.616 -10.294
  736    HA   GLU  42           HA       GLU  42  -6.885  -4.224 -11.587
  737   1HB   GLU  42          2HB       GLU  42  -5.412  -1.747 -12.505
  738   2HB   GLU  42          1HB       GLU  42  -5.631  -3.213 -13.449
  739   1HG   GLU  42          2HG       GLU  42  -7.823  -1.388 -12.492
  740   2HG   GLU  42          1HG       GLU  42  -7.183  -1.473 -14.132
  741    H    TRP  43           H        TRP  43  -5.651  -5.717 -10.568
  742    HA   TRP  43           HA       TRP  43  -2.910  -5.010  -9.815
  743   1HB   TRP  43          2HB       TRP  43  -4.557  -7.441  -9.113
  744   2HB   TRP  43          1HB       TRP  43  -2.958  -7.067  -8.487
  745    HD1  TRP  43           HD       TRP  43  -5.914  -4.567  -8.700
  746    HE1  TRP  43           1HE      TRP  43  -6.454  -3.799  -6.303
  747    HE3  TRP  43           3HE      TRP  43  -2.687  -7.576  -6.139
  748    HZ2  TRP  43           2HZ      TRP  43  -5.622  -4.386  -3.681
  749    HZ3  TRP  43           3HZ      TRP  43  -2.617  -7.417  -3.693
  750    HH2  TRP  43           HH       TRP  43  -4.061  -5.853  -2.485
  751    H    THR  44           H        THR  44  -1.262  -5.615 -11.046
  752    HA   THR  44           HA       THR  44  -1.613  -7.877 -12.891
  753    HB   THR  44           HB       THR  44   0.382  -6.936 -14.071
  754    HG1  THR  44           1HG      THR  44   1.490  -5.552 -12.972
  755   1HG2  THR  44          1HG2      THR  44  -0.719  -5.272 -15.247
  756   2HG2  THR  44          2HG2      THR  44  -1.627  -4.737 -13.834
  757   3HG2  THR  44          3HG2      THR  44  -2.033  -6.265 -14.616
  758    H    TYR  45           H        TYR  45  -0.356  -9.681 -12.635
  759    HA   TYR  45           HA       TYR  45   1.549  -9.613 -10.390
  760   1HB   TYR  45          2HB       TYR  45  -0.405 -11.070 -10.057
  761   2HB   TYR  45          1HB       TYR  45   0.020 -11.967 -11.511
  762    HD1  TYR  45           1HD      TYR  45   2.241 -10.746  -8.777
  763    HD2  TYR  45           2HD      TYR  45   0.528 -14.107 -10.745
  764    HE1  TYR  45           1HE      TYR  45   3.653 -12.245  -7.434
  765    HE2  TYR  45           2HE      TYR  45   1.936 -15.616  -9.407
  766    HH   TYR  45           HH       TYR  45   3.974 -15.591  -8.128
  767    H    ASP  46           H        ASP  46   3.552 -10.560 -10.547
  768    HA   ASP  46           HA       ASP  46   4.389 -11.438 -13.230
  769   1HB   ASP  46          2HB       ASP  46   5.276  -9.191 -12.757
  770   2HB   ASP  46          1HB       ASP  46   5.996  -9.784 -11.263
  771    H    ASP  47           H        ASP  47   3.973 -13.601 -12.477
  772    HA   ASP  47           HA       ASP  47   4.901 -14.835 -10.221
  773   1HB   ASP  47          2HB       ASP  47   4.801 -16.003 -13.009
  774   2HB   ASP  47          1HB       ASP  47   4.911 -16.939 -11.520
  775    H    ALA  48           H        ALA  48   6.725 -14.053 -13.124
  776    HA   ALA  48           HA       ALA  48   9.000 -15.554 -12.803
  777   1HB   ALA  48          1HB       ALA  48   9.559 -12.790 -13.590
  778   2HB   ALA  48          2HB       ALA  48   8.237 -13.548 -14.478
  779   3HB   ALA  48          3HB       ALA  48   9.832 -14.301 -14.459
  780    H    THR  49           H        THR  49   8.009 -12.762 -10.942
  781    HA   THR  49           HA       THR  49  10.436 -13.082  -9.305
  782    HB   THR  49           HB       THR  49  10.409 -10.648  -8.881
  783    HG1  THR  49           1HG      THR  49   8.266 -10.735 -10.716
  784   1HG2  THR  49          1HG2      THR  49  10.472 -10.376 -11.725
  785   2HG2  THR  49          2HG2      THR  49  11.251 -11.884 -11.243
  786   3HG2  THR  49          3HG2      THR  49  11.801 -10.351 -10.566
  787    H    LYS  50           H        LYS  50   7.359 -13.778  -9.237
  788    HA   LYS  50           HA       LYS  50   5.697 -13.922  -7.668
  789   1HB   LYS  50          2HB       LYS  50   8.099 -13.877  -5.843
  790   2HB   LYS  50          1HB       LYS  50   6.477 -14.353  -5.357
  791   1HG   LYS  50          2HG       LYS  50   6.951 -15.924  -7.564
  792   2HG   LYS  50          1HG       LYS  50   8.524 -15.861  -6.765
  793   1HD   LYS  50          2HD       LYS  50   5.913 -16.617  -5.466
  794   2HD   LYS  50          1HD       LYS  50   7.176 -17.744  -5.965
  795   1HE   LYS  50          2HE       LYS  50   7.447 -15.568  -3.892
  796   2HE   LYS  50          1HE       LYS  50   7.289 -17.293  -3.565
  797   1HZ   LYS  50          1HZ       LYS  50   9.383 -17.289  -5.205
  798   2HZ   LYS  50          2HZ       LYS  50   9.521 -17.182  -3.523
  799   3HZ   LYS  50          3HZ       LYS  50   9.598 -15.781  -4.467
  800    H    THR  51           H        THR  51   6.352 -11.260  -8.550
  801    HA   THR  51           HA       THR  51   5.642  -9.728  -6.138
  802    HB   THR  51           HB       THR  51   7.236  -8.831  -8.547
  803    HG1  THR  51           1HG      THR  51   8.916  -8.684  -7.068
  804   1HG2  THR  51          1HG2      THR  51   5.682  -7.218  -6.910
  805   2HG2  THR  51          2HG2      THR  51   6.989  -6.711  -7.979
  806   3HG2  THR  51          3HG2      THR  51   7.322  -7.058  -6.283
  807    H    PHE  52           H        PHE  52   3.891  -8.435  -6.220
  808    HA   PHE  52           HA       PHE  52   2.326  -8.464  -8.711
  809   1HB   PHE  52          2HB       PHE  52   1.362  -7.861  -5.906
  810   2HB   PHE  52          1HB       PHE  52   0.364  -8.083  -7.336
  811    HD1  PHE  52           1HD      PHE  52  -0.668 -10.109  -7.605
  812    HD2  PHE  52           2HD      PHE  52   2.951  -9.928  -5.376
  813    HE1  PHE  52           1HE      PHE  52  -0.880 -12.503  -7.072
  814    HE2  PHE  52           2HE      PHE  52   2.750 -12.321  -4.844
  815    HZ   PHE  52           HZ       PHE  52   0.832 -13.611  -5.693
  816    H    THR  53           H        THR  53   1.494  -6.530  -9.545
  817    HA   THR  53           HA       THR  53   2.486  -4.080  -8.255
  818    HB   THR  53           HB       THR  53   2.422  -3.162 -10.695
  819    HG1  THR  53           1HG      THR  53   2.884  -5.899 -11.224
  820   1HG2  THR  53          1HG2      THR  53   4.546  -3.057  -9.990
  821   2HG2  THR  53          2HG2      THR  53   4.742  -4.440 -11.071
  822   3HG2  THR  53          3HG2      THR  53   4.529  -4.697  -9.340
  823    H    VAL  54           H        VAL  54   1.059  -2.598  -7.788
  824    HA   VAL  54           HA       VAL  54  -1.676  -2.886  -8.847
  825    HB   VAL  54           HB       VAL  54  -0.796  -1.455  -6.327
  826   1HG1  VAL  54          1HG1      VAL  54  -3.133  -1.269  -5.811
  827   2HG1  VAL  54          2HG1      VAL  54  -3.571  -2.201  -7.241
  828   3HG1  VAL  54          3HG1      VAL  54  -2.861  -0.599  -7.418
  829   1HG2  VAL  54          1HG2      VAL  54  -2.467  -3.857  -6.100
  830   2HG2  VAL  54          2HG2      VAL  54  -1.091  -3.333  -5.130
  831   3HG2  VAL  54          3HG2      VAL  54  -0.824  -4.152  -6.669
  832    H    THR  55           H        THR  55  -1.979  -1.534 -10.513
  833    HA   THR  55           HA       THR  55  -0.617   1.059 -10.455
  834    HB   THR  55           HB       THR  55  -2.086  -0.145 -12.793
  835    HG1  THR  55           1HG      THR  55  -0.181  -1.043 -13.411
  836   1HG2  THR  55          1HG2      THR  55  -0.428   1.259 -14.057
  837   2HG2  THR  55          2HG2      THR  55  -0.041   2.037 -12.521
  838   3HG2  THR  55          3HG2      THR  55  -1.674   2.147 -13.181
  839    H    GLU  56           H        GLU  56  -1.685   2.741  -9.727
  840    HA   GLU  56           HA       GLU  56  -4.413   2.817  -9.161
  841   1HB   GLU  56          2HB       GLU  56  -2.801   4.318  -8.109
  842   2HB   GLU  56          1HB       GLU  56  -2.499   5.105  -9.651
  843   1HG   GLU  56          2HG       GLU  56  -3.949   6.448  -8.243
  844   2HG   GLU  56          1HG       GLU  56  -4.788   5.923  -9.703
  Start of MODEL   25
    1   1H    MET   1          1HT       MET   1   5.927 -19.610   2.433
    2   2H    MET   1          2HT       MET   1   4.566 -18.765   1.891
    3   3H    MET   1          3HT       MET   1   5.504 -18.139   3.152
    4    HA   MET   1           HA       MET   1   7.411 -18.203   1.441
    5   1HB   MET   1          2HB       MET   1   6.136 -19.447  -0.230
    6   2HB   MET   1          1HB       MET   1   4.924 -18.176  -0.282
    7   1HG   MET   1          2HG       MET   1   6.383 -18.037  -2.199
    8   2HG   MET   1          1HG       MET   1   6.587 -16.623  -1.167
    9   1HE   MET   1          1HE       MET   1   8.434 -17.276  -3.425
   10   2HE   MET   1          2HE       MET   1  10.096 -17.427  -2.851
   11   3HE   MET   1          3HE       MET   1   9.117 -16.042  -2.364
   12    H    GLN   2           H        GLN   2   8.098 -16.148   0.792
   13    HA   GLN   2           HA       GLN   2   6.431 -13.953   1.793
   14   1HB   GLN   2          2HB       GLN   2   8.648 -14.158   2.812
   15   2HB   GLN   2          1HB       GLN   2   9.401 -14.067   1.225
   16   1HG   GLN   2          2HG       GLN   2   9.581 -11.950   2.377
   17   2HG   GLN   2          1HG       GLN   2   8.558 -11.792   0.951
   18   1HE2  GLN   2          1HE2      GLN   2   8.859 -10.859   4.044
   19   2HE2  GLN   2          2HE2      GLN   2   7.202 -10.581   4.448
   20    H    TYR   3           H        TYR   3   5.761 -12.318   0.492
   21    HA   TYR   3           HA       TYR   3   6.756 -12.286  -2.277
   22   1HB   TYR   3          2HB       TYR   3   3.872 -12.009  -1.408
   23   2HB   TYR   3          1HB       TYR   3   4.461 -11.802  -3.055
   24    HD1  TYR   3           1HD      TYR   3   4.838 -13.674  -4.460
   25    HD2  TYR   3           2HD      TYR   3   4.005 -14.264  -0.331
   26    HE1  TYR   3           1HE      TYR   3   4.542 -16.081  -4.870
   27    HE2  TYR   3           2HE      TYR   3   3.710 -16.672  -0.730
   28    HH   TYR   3           HH       TYR   3   3.395 -18.000  -3.826
   29    H    LYS   4           H        LYS   4   6.891 -10.267  -3.257
   30    HA   LYS   4           HA       LYS   4   6.524  -7.990  -1.424
   31   1HB   LYS   4          2HB       LYS   4   8.872  -8.405  -2.007
   32   2HB   LYS   4          1HB       LYS   4   8.474  -8.286  -3.716
   33   1HG   LYS   4          2HG       LYS   4   7.910  -5.962  -3.478
   34   2HG   LYS   4          1HG       LYS   4   8.125  -6.052  -1.728
   35   1HD   LYS   4          2HD       LYS   4  10.065  -5.029  -2.814
   36   2HD   LYS   4          1HD       LYS   4  10.493  -6.551  -2.032
   37   1HE   LYS   4          2HE       LYS   4  10.350  -7.691  -4.202
   38   2HE   LYS   4          1HE       LYS   4   9.945  -6.158  -4.973
   39   1HZ   LYS   4          1HZ       LYS   4  12.083  -5.628  -5.085
   40   2HZ   LYS   4          2HZ       LYS   4  12.465  -7.187  -4.553
   41   3HZ   LYS   4          3HZ       LYS   4  12.324  -5.925  -3.436
   42    H    VAL   5           H        VAL   5   4.747  -6.906  -1.911
   43    HA   VAL   5           HA       VAL   5   3.812  -6.810  -4.670
   44    HB   VAL   5           HB       VAL   5   2.483  -5.821  -2.145
   45   1HG1  VAL   5          1HG1      VAL   5   0.683  -5.159  -3.347
   46   2HG1  VAL   5          2HG1      VAL   5   0.926  -6.377  -4.595
   47   3HG1  VAL   5          3HG1      VAL   5   1.907  -4.912  -4.590
   48   1HG2  VAL   5          1HG2      VAL   5   2.592  -8.441  -3.469
   49   2HG2  VAL   5          2HG2      VAL   5   0.981  -7.898  -3.003
   50   3HG2  VAL   5          3HG2      VAL   5   2.255  -8.029  -1.790
   51    H    ILE   6           H        ILE   6   3.906  -5.099  -5.920
   52    HA   ILE   6           HA       ILE   6   5.100  -2.643  -4.843
   53    HB   ILE   6           HB       ILE   6   4.907  -3.671  -7.676
   54   1HG1  ILE   6          2HG1      ILE   6   7.289  -3.100  -5.903
   55   2HG1  ILE   6          1HG1      ILE   6   6.619  -4.697  -6.204
   56   1HG2  ILE   6          1HG2      ILE   6   4.859  -1.490  -8.233
   57   2HG2  ILE   6          2HG2      ILE   6   6.578  -1.558  -7.848
   58   3HG2  ILE   6          3HG2      ILE   6   5.431  -0.965  -6.649
   59   1HD1  ILE   6          1HD1      ILE   6   8.595  -4.296  -7.554
   60   2HD1  ILE   6          2HD1      ILE   6   7.833  -2.873  -8.266
   61   3HD1  ILE   6          3HD1      ILE   6   7.166  -4.477  -8.573
   62    H    LEU   7           H        LEU   7   3.932  -0.867  -4.627
   63    HA   LEU   7           HA       LEU   7   1.242  -0.820  -5.806
   64   1HB   LEU   7          2HB       LEU   7   2.192   0.981  -3.595
   65   2HB   LEU   7          1HB       LEU   7   0.553   0.495  -3.987
   66    HG   LEU   7           HG       LEU   7   2.672  -1.254  -2.751
   67   1HD1  LEU   7          1HD1      LEU   7   1.653   0.458  -1.270
   68   2HD1  LEU   7          2HD1      LEU   7   1.307  -1.198  -0.781
   69   3HD1  LEU   7          3HD1      LEU   7   0.074  -0.247  -1.606
   70   1HD2  LEU   7          1HD2      LEU   7   1.004  -2.980  -2.650
   71   2HD2  LEU   7          2HD2      LEU   7   1.186  -2.458  -4.324
   72   3HD2  LEU   7          3HD2      LEU   7  -0.201  -1.918  -3.380
   73    H    ASN   8           H        ASN   8   1.924  -0.058  -7.847
   74    HA   ASN   8           HA       ASN   8   3.303   2.493  -8.006
   75   1HB   ASN   8          2HB       ASN   8   2.406   0.498 -10.076
   76   2HB   ASN   8          1HB       ASN   8   3.040   2.077 -10.518
   77   1HD2  ASN   8          1HD2      ASN   8   4.650   1.321  -7.774
   78   2HD2  ASN   8          2HD2      ASN   8   6.025   0.538  -8.453
   79    H    GLY   9           H        GLY   9   2.034   4.169  -7.507
   80   1HA   GLY   9          2HA       GLY   9  -0.515   4.436  -8.982
   81   2HA   GLY   9          1HA       GLY   9  -0.269   5.068  -7.362
   82    H    LYS  10           H        LYS  10  -1.062   6.451  -9.817
   83    HA   LYS  10           HA       LYS  10   0.820   7.907 -11.101
   84   1HB   LYS  10          2HB       LYS  10  -1.777   8.980  -9.991
   85   2HB   LYS  10          1HB       LYS  10  -0.840   9.717 -11.282
   86   1HG   LYS  10          2HG       LYS  10  -1.215   7.772 -12.689
   87   2HG   LYS  10          1HG       LYS  10  -2.121   6.994 -11.391
   88   1HD   LYS  10          2HD       LYS  10  -2.866   9.593 -12.731
   89   2HD   LYS  10          1HD       LYS  10  -3.598   8.023 -13.069
   90   1HE   LYS  10          2HE       LYS  10  -4.334   7.888 -10.723
   91   2HE   LYS  10          1HE       LYS  10  -3.645   9.485 -10.429
   92   1HZ   LYS  10          1HZ       LYS  10  -5.995   8.759 -12.056
   93   2HZ   LYS  10          2HZ       LYS  10  -5.170  10.206 -12.344
   94   3HZ   LYS  10          3HZ       LYS  10  -5.866   9.919 -10.830
   95    H    THR  11           H        THR  11  -0.681   8.933  -8.031
   96    HA   THR  11           HA       THR  11   1.459  10.871  -7.631
   97    HB   THR  11           HB       THR  11  -0.106  11.540  -5.694
   98    HG1  THR  11           1HG      THR  11  -1.994  10.114  -7.227
   99   1HG2  THR  11          1HG2      THR  11  -1.202  13.063  -6.989
  100   2HG2  THR  11          2HG2      THR  11  -1.537  11.896  -8.268
  101   3HG2  THR  11          3HG2      THR  11   0.080  12.579  -8.100
  102    H    LEU  12           H        LEU  12   0.809   7.727  -6.769
  103    HA   LEU  12           HA       LEU  12   2.543   7.976  -4.422
  104   1HB   LEU  12          2HB       LEU  12   0.259   7.758  -3.604
  105   2HB   LEU  12          1HB       LEU  12   0.025   6.322  -4.580
  106    HG   LEU  12           HG       LEU  12   1.483   5.046  -3.227
  107   1HD1  LEU  12          1HD1      LEU  12   2.564   7.650  -2.561
  108   2HD1  LEU  12          2HD1      LEU  12   3.323   6.068  -2.503
  109   3HD1  LEU  12          3HD1      LEU  12   2.344   6.630  -1.144
  110   1HD2  LEU  12          1HD2      LEU  12   0.280   6.527  -1.003
  111   2HD2  LEU  12          2HD2      LEU  12   0.103   4.837  -1.470
  112   3HD2  LEU  12          3HD2      LEU  12  -0.841   6.081  -2.287
  113    H    LYS  13           H        LYS  13   4.103   6.460  -4.253
  114    HA   LYS  13           HA       LYS  13   3.933   4.033  -5.859
  115   1HB   LYS  13          2HB       LYS  13   6.209   6.008  -6.117
  116   2HB   LYS  13          1HB       LYS  13   6.192   4.394  -6.816
  117   1HG   LYS  13          2HG       LYS  13   4.276   5.006  -8.197
  118   2HG   LYS  13          1HG       LYS  13   4.278   6.620  -7.487
  119   1HD   LYS  13          2HD       LYS  13   6.527   5.396  -9.085
  120   2HD   LYS  13          1HD       LYS  13   5.373   6.594  -9.678
  121   1HE   LYS  13          2HE       LYS  13   6.167   8.184  -7.993
  122   2HE   LYS  13          1HE       LYS  13   7.324   6.987  -7.413
  123   1HZ   LYS  13          1HZ       LYS  13   8.613   8.212  -8.827
  124   2HZ   LYS  13          2HZ       LYS  13   7.350   8.539  -9.904
  125   3HZ   LYS  13          3HZ       LYS  13   8.075   7.010  -9.891
  126    H    GLY  14           H        GLY  14   5.173   2.321  -5.056
  127   1HA   GLY  14          2HA       GLY  14   7.230   2.588  -3.157
  128   2HA   GLY  14          1HA       GLY  14   5.716   2.377  -2.301
  129    H    GLU  15           H        GLU  15   6.991   0.491  -1.521
  130    HA   GLU  15           HA       GLU  15   6.250  -1.848  -3.097
  131   1HB   GLU  15          2HB       GLU  15   9.029  -1.436  -1.971
  132   2HB   GLU  15          1HB       GLU  15   8.435  -2.926  -2.689
  133   1HG   GLU  15          2HG       GLU  15   9.702  -1.915  -4.361
  134   2HG   GLU  15          1HG       GLU  15   8.030  -1.570  -4.797
  135    H    THR  16           H        THR  16   5.638  -3.571  -1.881
  136    HA   THR  16           HA       THR  16   6.042  -3.452   1.011
  137    HB   THR  16           HB       THR  16   3.922  -2.539   0.992
  138    HG1  THR  16           1HG      THR  16   3.318  -5.277   0.884
  139   1HG2  THR  16          1HG2      THR  16   3.380  -2.546  -1.319
  140   2HG2  THR  16          2HG2      THR  16   2.064  -3.338  -0.450
  141   3HG2  THR  16          3HG2      THR  16   3.244  -4.303  -1.337
  142    H    THR  17           H        THR  17   5.280  -5.573   2.081
  143    HA   THR  17           HA       THR  17   5.538  -7.855   0.279
  144    HB   THR  17           HB       THR  17   7.276  -8.876   1.731
  145    HG1  THR  17           1HG      THR  17   6.781  -7.456   3.554
  146   1HG2  THR  17          1HG2      THR  17   9.160  -7.370   1.078
  147   2HG2  THR  17          2HG2      THR  17   7.953  -6.253   0.437
  148   3HG2  THR  17          3HG2      THR  17   8.103  -7.873  -0.242
  149    H    THR  18           H        THR  18   4.014  -9.254   0.700
  150    HA   THR  18           HA       THR  18   2.931  -9.509   3.445
  151    HB   THR  18           HB       THR  18   1.288  -8.848   1.717
  152    HG1  THR  18           1HG      THR  18   0.684 -10.254   3.465
  153   1HG2  THR  18          1HG2      THR  18   0.591 -10.780   0.147
  154   2HG2  THR  18          2HG2      THR  18   2.264 -11.304   0.340
  155   3HG2  THR  18          3HG2      THR  18   1.911  -9.708  -0.321
  156    H    GLU  19           H        GLU  19   2.783 -11.557   4.371
  157    HA   GLU  19           HA       GLU  19   4.375 -13.643   3.040
  158   1HB   GLU  19          2HB       GLU  19   5.199 -12.932   5.236
  159   2HB   GLU  19          1HB       GLU  19   3.639 -13.305   5.958
  160   1HG   GLU  19          2HG       GLU  19   3.950 -15.664   5.402
  161   2HG   GLU  19          1HG       GLU  19   5.517 -15.285   4.689
  162    H    ALA  20           H        ALA  20   3.212 -15.191   2.042
  163    HA   ALA  20           HA       ALA  20   0.903 -16.309   3.419
  164   1HB   ALA  20          1HB       ALA  20   0.386 -14.370   1.666
  165   2HB   ALA  20          2HB       ALA  20  -0.683 -15.751   1.906
  166   3HB   ALA  20          3HB       ALA  20   0.452 -15.737   0.555
  167    H    VAL  21           H        VAL  21   0.336 -18.367   2.776
  168    HA   VAL  21           HA       VAL  21   2.326 -20.148   2.139
  169    HB   VAL  21           HB       VAL  21  -0.585 -20.595   1.482
  170   1HG1  VAL  21          1HG1      VAL  21  -0.124 -22.787   1.295
  171   2HG1  VAL  21          2HG1      VAL  21   1.065 -22.756   2.597
  172   3HG1  VAL  21          3HG1      VAL  21   1.516 -22.225   0.977
  173   1HG2  VAL  21          1HG2      VAL  21   0.854 -20.495   4.094
  174   2HG2  VAL  21          2HG2      VAL  21  -0.472 -21.639   3.879
  175   3HG2  VAL  21          3HG2      VAL  21  -0.756 -19.911   3.670
  176    H    ASP  22           H        ASP  22   0.131 -18.522  -0.078
  177    HA   ASP  22           HA       ASP  22   1.893 -19.258  -2.281
  178   1HB   ASP  22          2HB       ASP  22   0.114 -20.073  -3.717
  179   2HB   ASP  22          1HB       ASP  22   0.171 -21.029  -2.241
  180    H    ALA  23           H        ALA  23   1.115 -18.147  -4.383
  181    HA   ALA  23           HA       ALA  23   1.156 -15.397  -3.965
  182   1HB   ALA  23          1HB       ALA  23   0.393 -15.350  -6.440
  183   2HB   ALA  23          2HB       ALA  23   0.570 -17.103  -6.349
  184   3HB   ALA  23          3HB       ALA  23   1.955 -16.059  -6.035
  185    H    ALA  24           H        ALA  24  -1.567 -17.532  -4.688
  186    HA   ALA  24           HA       ALA  24  -3.508 -15.507  -4.966
  187   1HB   ALA  24          1HB       ALA  24  -4.982 -17.570  -4.040
  188   2HB   ALA  24          2HB       ALA  24  -3.531 -18.431  -4.550
  189   3HB   ALA  24          3HB       ALA  24  -4.422 -17.442  -5.707
  190    H    THR  25           H        THR  25  -2.733 -17.573  -2.158
  191    HA   THR  25           HA       THR  25  -4.414 -16.399  -0.305
  192    HB   THR  25           HB       THR  25  -2.788 -17.199   1.390
  193    HG1  THR  25           1HG      THR  25  -0.803 -17.466   0.889
  194   1HG2  THR  25          1HG2      THR  25  -3.567 -19.001  -0.842
  195   2HG2  THR  25          2HG2      THR  25  -4.136 -18.963   0.827
  196   3HG2  THR  25          3HG2      THR  25  -2.535 -19.603   0.457
  197    H    ALA  26           H        ALA  26  -1.114 -15.523  -1.252
  198    HA   ALA  26           HA       ALA  26  -0.787 -13.337   0.483
  199   1HB   ALA  26          1HB       ALA  26   1.224 -13.737  -0.468
  200   2HB   ALA  26          2HB       ALA  26   0.665 -12.590  -1.685
  201   3HB   ALA  26          3HB       ALA  26   0.510 -14.323  -1.970
  202    H    GLU  27           H        GLU  27  -1.837 -13.457  -2.928
  203    HA   GLU  27           HA       GLU  27  -2.446 -10.828  -3.363
  204   1HB   GLU  27          2HB       GLU  27  -2.547 -12.427  -5.143
  205   2HB   GLU  27          1HB       GLU  27  -3.809 -13.338  -4.330
  206   1HG   GLU  27          2HG       GLU  27  -4.651 -12.035  -6.220
  207   2HG   GLU  27          1HG       GLU  27  -5.390 -11.562  -4.692
  208    H    LYS  28           H        LYS  28  -4.557 -13.328  -1.982
  209    HA   LYS  28           HA       LYS  28  -6.778 -11.643  -1.556
  210   1HB   LYS  28          2HB       LYS  28  -5.995 -14.171  -0.089
  211   2HB   LYS  28          1HB       LYS  28  -7.580 -13.411  -0.038
  212   1HG   LYS  28          2HG       LYS  28  -6.244 -14.685  -2.412
  213   2HG   LYS  28          1HG       LYS  28  -7.680 -15.247  -1.555
  214   1HD   LYS  28          2HD       LYS  28  -8.890 -13.248  -2.261
  215   2HD   LYS  28          1HD       LYS  28  -7.449 -12.664  -3.097
  216   1HE   LYS  28          2HE       LYS  28  -9.020 -13.694  -4.661
  217   2HE   LYS  28          1HE       LYS  28  -7.512 -14.602  -4.578
  218   1HZ   LYS  28          1HZ       LYS  28  -8.510 -16.339  -3.496
  219   2HZ   LYS  28          2HZ       LYS  28  -9.781 -15.830  -4.490
  220   3HZ   LYS  28          3HZ       LYS  28  -9.757 -15.392  -2.857
  221    H    VAL  29           H        VAL  29  -4.112 -12.646   0.557
  222    HA   VAL  29           HA       VAL  29  -4.964 -11.309   2.865
  223    HB   VAL  29           HB       VAL  29  -2.130 -11.877   1.975
  224   1HG1  VAL  29          1HG1      VAL  29  -2.520 -10.163   3.850
  225   2HG1  VAL  29          2HG1      VAL  29  -1.403 -11.491   4.155
  226   3HG1  VAL  29          3HG1      VAL  29  -3.038 -11.546   4.814
  227   1HG2  VAL  29          1HG2      VAL  29  -2.369 -14.003   2.638
  228   2HG2  VAL  29          2HG2      VAL  29  -4.099 -13.704   2.476
  229   3HG2  VAL  29          3HG2      VAL  29  -3.323 -13.554   4.052
  230    H    VAL  30           H        VAL  30  -3.047 -10.236   0.110
  231    HA   VAL  30           HA       VAL  30  -2.406  -7.672   1.157
  232    HB   VAL  30           HB       VAL  30  -2.661  -8.486  -1.745
  233   1HG1  VAL  30          1HG1      VAL  30  -0.892  -6.337  -0.617
  234   2HG1  VAL  30          2HG1      VAL  30  -2.554  -6.006  -1.102
  235   3HG1  VAL  30          3HG1      VAL  30  -1.389  -6.591  -2.289
  236   1HG2  VAL  30          1HG2      VAL  30  -0.988  -9.636   0.064
  237   2HG2  VAL  30          2HG2      VAL  30   0.009  -8.316  -0.548
  238   3HG2  VAL  30          3HG2      VAL  30  -0.662  -9.505  -1.665
  239    H    LYS  31           H        LYS  31  -4.952  -8.840  -1.079
  240    HA   LYS  31           HA       LYS  31  -6.266  -6.473  -1.559
  241   1HB   LYS  31          2HB       LYS  31  -7.350  -9.261  -1.222
  242   2HB   LYS  31          1HB       LYS  31  -8.373  -7.902  -1.665
  243   1HG   LYS  31          2HG       LYS  31  -7.061  -7.528  -3.666
  244   2HG   LYS  31          1HG       LYS  31  -5.970  -8.835  -3.216
  245   1HD   LYS  31          2HD       LYS  31  -7.515  -9.643  -4.871
  246   2HD   LYS  31          1HD       LYS  31  -7.886 -10.406  -3.326
  247   1HE   LYS  31          2HE       LYS  31  -9.312  -7.959  -4.352
  248   2HE   LYS  31          1HE       LYS  31  -9.866  -9.603  -4.668
  249   1HZ   LYS  31          1HZ       LYS  31  -9.476  -9.534  -1.965
  250   2HZ   LYS  31          2HZ       LYS  31 -10.965  -9.430  -2.757
  251   3HZ   LYS  31          3HZ       LYS  31 -10.151  -8.019  -2.305
  252    H    GLN  32           H        GLN  32  -6.582  -8.646   1.188
  253    HA   GLN  32           HA       GLN  32  -8.640  -7.269   2.530
  254   1HB   GLN  32          2HB       GLN  32  -7.870  -9.554   3.138
  255   2HB   GLN  32          1HB       GLN  32  -6.376  -8.866   3.755
  256   1HG   GLN  32          2HG       GLN  32  -7.837  -9.325   5.588
  257   2HG   GLN  32          1HG       GLN  32  -7.679  -7.580   5.401
  258   1HE2  GLN  32          1HE2      GLN  32  -9.647  -8.843   2.970
  259   2HE2  GLN  32          2HE2      GLN  32 -11.175  -8.509   3.693
  260    H    PHE  33           H        PHE  33  -5.173  -6.855   2.413
  261    HA   PHE  33           HA       PHE  33  -4.735  -5.078   4.495
  262   1HB   PHE  33          2HB       PHE  33  -3.028  -6.168   2.941
  263   2HB   PHE  33          1HB       PHE  33  -3.408  -4.902   1.781
  264    HD1  PHE  33           1HD      PHE  33  -2.633  -5.095   5.427
  265    HD2  PHE  33           2HD      PHE  33  -1.868  -3.212   1.672
  266    HE1  PHE  33           1HE      PHE  33  -1.007  -3.591   6.499
  267    HE2  PHE  33           2HE      PHE  33  -0.229  -1.730   2.753
  268    HZ   PHE  33           HZ       PHE  33   0.201  -1.925   5.171
  269    H    PHE  34           H        PHE  34  -5.153  -4.203   1.090
  270    HA   PHE  34           HA       PHE  34  -5.658  -1.450   1.617
  271   1HB   PHE  34          2HB       PHE  34  -6.253  -3.046  -0.879
  272   2HB   PHE  34          1HB       PHE  34  -6.210  -1.285  -0.763
  273    HD1  PHE  34           1HD      PHE  34  -3.880  -0.800   0.881
  274    HD2  PHE  34           2HD      PHE  34  -4.470  -3.643  -2.220
  275    HE1  PHE  34           1HE      PHE  34  -1.460  -0.845   0.473
  276    HE2  PHE  34           2HE      PHE  34  -2.048  -3.696  -2.642
  277    HZ   PHE  34           HZ       PHE  34  -0.545  -2.298  -1.282
  278    H    ASN  35           H        ASN  35  -7.722  -4.226   1.003
  279    HA   ASN  35           HA       ASN  35 -10.206  -3.031   0.726
  280   1HB   ASN  35          2HB       ASN  35  -9.813  -5.453   0.541
  281   2HB   ASN  35          1HB       ASN  35  -9.489  -5.540   2.269
  282   1HD2  ASN  35          1HD2      ASN  35 -11.622  -6.466   0.209
  283   2HD2  ASN  35          2HD2      ASN  35 -13.102  -6.226   1.069
  284    H    ASP  36           H        ASP  36  -8.287  -3.690   3.571
  285    HA   ASP  36           HA       ASP  36 -10.285  -2.530   5.357
  286   1HB   ASP  36          2HB       ASP  36  -7.648  -3.878   5.978
  287   2HB   ASP  36          1HB       ASP  36  -8.806  -3.317   7.180
  288    H    ASN  37           H        ASN  37  -7.214  -1.670   3.915
  289    HA   ASN  37           HA       ASN  37  -6.673   0.447   5.802
  290   1HB   ASN  37          2HB       ASN  37  -5.504  -0.105   3.062
  291   2HB   ASN  37          1HB       ASN  37  -4.955   1.177   4.134
  292   1HD2  ASN  37          1HD2      ASN  37  -3.775  -1.404   2.997
  293   2HD2  ASN  37          2HD2      ASN  37  -3.061  -2.148   4.382
  294    H    GLY  38           H        GLY  38  -7.953   0.132   2.572
  295   1HA   GLY  38          2HA       GLY  38  -8.415   2.148   1.211
  296   2HA   GLY  38          1HA       GLY  38  -9.865   1.455   1.903
  297    H    VAL  39           H        VAL  39 -11.189   2.853   2.724
  298    HA   VAL  39           HA       VAL  39 -10.353   5.556   3.164
  299    HB   VAL  39           HB       VAL  39 -13.043   4.240   3.265
  300   1HG1  VAL  39          1HG1      VAL  39 -13.635   6.861   3.075
  301   2HG1  VAL  39          2HG1      VAL  39 -12.213   6.944   4.115
  302   3HG1  VAL  39          3HG1      VAL  39 -13.608   5.981   4.606
  303   1HG2  VAL  39          1HG2      VAL  39 -13.223   4.746   1.102
  304   2HG2  VAL  39          2HG2      VAL  39 -11.474   4.974   1.139
  305   3HG2  VAL  39          3HG2      VAL  39 -12.551   6.360   1.333
  306    H    ASP  40           H        ASP  40 -12.080   3.251   5.357
  307    HA   ASP  40           HA       ASP  40 -11.641   5.106   7.523
  308   1HB   ASP  40          2HB       ASP  40 -13.008   2.416   7.461
  309   2HB   ASP  40          1HB       ASP  40 -12.975   3.504   8.846
  310    H    GLY  41           H        GLY  41  -9.277   3.625   6.368
  311   1HA   GLY  41          2HA       GLY  41  -8.480   1.701   8.324
  312   2HA   GLY  41          1HA       GLY  41  -7.428   2.478   7.149
  313    H    GLU  42           H        GLU  42  -6.682   1.929   9.831
  314    HA   GLU  42           HA       GLU  42  -6.809   4.481  11.238
  315   1HB   GLU  42          2HB       GLU  42  -5.477   1.872  12.004
  316   2HB   GLU  42          1HB       GLU  42  -5.603   3.291  13.035
  317   1HG   GLU  42          2HG       GLU  42  -7.904   1.662  11.986
  318   2HG   GLU  42          1HG       GLU  42  -7.257   1.612  13.625
  319    H    TRP  43           H        TRP  43  -5.511   5.936  10.183
  320    HA   TRP  43           HA       TRP  43  -2.789   5.118   9.486
  321   1HB   TRP  43          2HB       TRP  43  -4.263   7.658   8.791
  322   2HB   TRP  43          1HB       TRP  43  -2.700   7.160   8.163
  323    HD1  TRP  43           HD       TRP  43  -5.756   4.809   8.346
  324    HE1  TRP  43           1HE      TRP  43  -6.409   4.166   5.936
  325    HE3  TRP  43           3HE      TRP  43  -2.503   7.806   5.821
  326    HZ2  TRP  43           2HZ      TRP  43  -5.628   4.846   3.312
  327    HZ3  TRP  43           3HZ      TRP  43  -2.509   7.755   3.372
  328    HH2  TRP  43           HH       TRP  43  -4.042   6.307   2.137
  329    H    THR  44           H        THR  44  -1.154   5.597  10.783
  330    HA   THR  44           HA       THR  44  -1.420   7.844  12.662
  331    HB   THR  44           HB       THR  44   0.477   6.774  13.872
  332    HG1  THR  44           1HG      THR  44   1.218   5.633  11.926
  333   1HG2  THR  44          1HG2      THR  44  -1.468   4.562  13.558
  334   2HG2  THR  44          2HG2      THR  44  -2.057   6.113  14.157
  335   3HG2  THR  44          3HG2      THR  44  -0.772   5.264  15.017
  336    H    TYR  45           H        TYR  45  -0.071   9.589  12.472
  337    HA   TYR  45           HA       TYR  45   1.878   9.483  10.271
  338   1HB   TYR  45          2HB       TYR  45   0.062  11.095   9.949
  339   2HB   TYR  45          1HB       TYR  45   0.469  11.873  11.475
  340    HD1  TYR  45           1HD      TYR  45   2.782  10.675   8.818
  341    HD2  TYR  45           2HD      TYR  45   1.101  14.029  10.822
  342    HE1  TYR  45           1HE      TYR  45   4.347  12.158   7.636
  343    HE2  TYR  45           2HE      TYR  45   2.662  15.522   9.645
  344    HH   TYR  45           HH       TYR  45   4.782  15.445   8.509
  345    H    ASP  46           H        ASP  46   3.951  10.179  10.521
  346    HA   ASP  46           HA       ASP  46   4.784  10.941  13.240
  347   1HB   ASP  46          2HB       ASP  46   5.459   8.626  12.765
  348   2HB   ASP  46          1HB       ASP  46   6.276   9.161  11.299
  349    H    ASP  47           H        ASP  47   4.591  13.135  12.504
  350    HA   ASP  47           HA       ASP  47   5.705  14.326  10.316
  351   1HB   ASP  47          2HB       ASP  47   5.648  15.428  13.133
  352   2HB   ASP  47          1HB       ASP  47   5.895  16.385  11.674
  353    H    ALA  48           H        ALA  48   7.371  13.246  13.211
  354    HA   ALA  48           HA       ALA  48   9.782  14.533  13.021
  355   1HB   ALA  48          1HB       ALA  48   9.077  12.963  14.822
  356   2HB   ALA  48          2HB       ALA  48  10.740  12.745  14.279
  357   3HB   ALA  48          3HB       ALA  48   9.484  11.627  13.745
  358    H    THR  49           H        THR  49   8.627  11.874  11.038
  359    HA   THR  49           HA       THR  49  11.093  12.110   9.442
  360    HB   THR  49           HB       THR  49  10.929   9.695   8.940
  361    HG1  THR  49           1HG      THR  49   9.514   8.439  10.204
  362   1HG2  THR  49          1HG2      THR  49  11.924   8.900  10.855
  363   2HG2  THR  49          2HG2      THR  49  10.914   9.882  11.915
  364   3HG2  THR  49          3HG2      THR  49  12.206  10.635  10.980
  365    H    LYS  50           H        LYS  50   8.087  13.023   9.317
  366    HA   LYS  50           HA       LYS  50   6.509  13.366   7.692
  367   1HB   LYS  50          2HB       LYS  50   8.956  12.957   5.965
  368   2HB   LYS  50          1HB       LYS  50   7.409  13.512   5.345
  369   1HG   LYS  50          2HG       LYS  50   8.996  14.940   7.464
  370   2HG   LYS  50          1HG       LYS  50   9.054  15.320   5.742
  371   1HD   LYS  50          2HD       LYS  50   6.588  15.699   5.823
  372   2HD   LYS  50          1HD       LYS  50   6.668  15.507   7.576
  373   1HE   LYS  50          2HE       LYS  50   8.141  17.581   5.952
  374   2HE   LYS  50          1HE       LYS  50   6.693  17.867   6.915
  375   1HZ   LYS  50          1HZ       LYS  50   9.448  17.439   7.782
  376   2HZ   LYS  50          2HZ       LYS  50   8.225  16.822   8.772
  377   3HZ   LYS  50          3HZ       LYS  50   8.266  18.472   8.410
  378    H    THR  51           H        THR  51   6.888  10.655   8.675
  379    HA   THR  51           HA       THR  51   6.128   9.098   6.302
  380    HB   THR  51           HB       THR  51   7.255   8.180   8.951
  381    HG1  THR  51           1HG      THR  51   8.681   9.200   7.353
  382   1HG2  THR  51          1HG2      THR  51   7.574   6.092   7.256
  383   2HG2  THR  51          2HG2      THR  51   5.980   6.684   6.791
  384   3HG2  THR  51          3HG2      THR  51   6.297   6.228   8.465
  385    H    PHE  52           H        PHE  52   4.198   8.076   6.205
  386    HA   PHE  52           HA       PHE  52   2.394   8.456   8.500
  387   1HB   PHE  52          2HB       PHE  52   1.690   8.024   5.601
  388   2HB   PHE  52          1HB       PHE  52   0.547   8.262   6.916
  389    HD1  PHE  52           1HD      PHE  52  -0.336  10.357   7.165
  390    HD2  PHE  52           2HD      PHE  52   3.542   9.948   5.457
  391    HE1  PHE  52           1HE      PHE  52  -0.246  12.788   6.795
  392    HE2  PHE  52           2HE      PHE  52   3.638  12.379   5.087
  393    HZ   PHE  52           HZ       PHE  52   1.741  13.799   5.756
  394    H    THR  53           H        THR  53   2.759   6.664   9.631
  395    HA   THR  53           HA       THR  53   2.828   4.043   8.466
  396    HB   THR  53           HB       THR  53   2.554   3.336  10.961
  397    HG1  THR  53           1HG      THR  53   3.017   4.893  12.420
  398   1HG2  THR  53          1HG2      THR  53   4.631   2.902  10.127
  399   2HG2  THR  53          2HG2      THR  53   4.996   4.091  11.382
  400   3HG2  THR  53          3HG2      THR  53   4.931   4.587   9.690
  401    H    VAL  54           H        VAL  54   1.277   2.709   8.020
  402    HA   VAL  54           HA       VAL  54  -1.418   3.216   9.098
  403    HB   VAL  54           HB       VAL  54  -0.713   2.034   6.395
  404   1HG1  VAL  54          1HG1      VAL  54  -3.220   2.209   7.945
  405   2HG1  VAL  54          2HG1      VAL  54  -2.722   1.050   6.711
  406   3HG1  VAL  54          3HG1      VAL  54  -3.329   2.636   6.236
  407   1HG2  VAL  54          1HG2      VAL  54  -0.274   4.366   6.311
  408   2HG2  VAL  54          2HG2      VAL  54  -1.752   4.746   7.196
  409   3HG2  VAL  54          3HG2      VAL  54  -1.846   4.118   5.550
  410    H    THR  55           H        THR  55  -2.133   1.633  10.386
  411    HA   THR  55           HA       THR  55  -0.952  -1.040  10.047
  412    HB   THR  55           HB       THR  55  -2.005   0.120  12.625
  413    HG1  THR  55           1HG      THR  55   0.612   0.021  11.557
  414   1HG2  THR  55          1HG2      THR  55  -0.955  -1.679  13.725
  415   2HG2  THR  55          2HG2      THR  55  -0.140  -2.201  12.250
  416   3HG2  THR  55          3HG2      THR  55  -1.888  -2.384  12.404
  417    H    GLU  56           H        GLU  56  -2.254  -2.694   9.640
  418    HA   GLU  56           HA       GLU  56  -5.033  -2.262   9.221
  419   1HB   GLU  56          2HB       GLU  56  -3.749  -3.865   7.889
  420   2HB   GLU  56          1HB       GLU  56  -3.453  -4.838   9.322
  421   1HG   GLU  56          2HG       GLU  56  -5.850  -5.274   9.519
  422   2HG   GLU  56          1HG       GLU  56  -6.142  -4.300   8.079
  423   1H    MET   1          1HT       MET   1   6.436  19.513  -2.256
  424   2H    MET   1          2HT       MET   1   5.048  18.701  -1.733
  425   3H    MET   1          3HT       MET   1   5.987  18.052  -2.981
  426    HA   MET   1           HA       MET   1   7.871  18.069  -1.243
  427   1HB   MET   1          2HB       MET   1   6.603  19.344   0.410
  428   2HB   MET   1          1HB       MET   1   5.360  18.102   0.445
  429   1HG   MET   1          2HG       MET   1   6.788  17.930   2.382
  430   2HG   MET   1          1HG       MET   1   6.971  16.512   1.353
  431   1HE   MET   1          1HE       MET   1   8.802  17.118   3.634
  432   2HE   MET   1          2HE       MET   1  10.475  17.229   3.086
  433   3HE   MET   1          3HE       MET   1   9.470  15.869   2.585
  434    H    GLN   2           H        GLN   2   8.498  15.999  -0.583
  435    HA   GLN   2           HA       GLN   2   6.793  13.845  -1.611
  436   1HB   GLN   2          2HB       GLN   2   9.028  13.995  -2.598
  437   2HB   GLN   2          1HB       GLN   2   9.755  13.887  -1.001
  438   1HG   GLN   2          2HG       GLN   2   9.902  11.766  -2.150
  439   2HG   GLN   2          1HG       GLN   2   8.853  11.633  -0.739
  440   1HE2  GLN   2          1HE2      GLN   2   9.176  10.693  -3.827
  441   2HE2  GLN   2          2HE2      GLN   2   7.520  10.454  -4.254
  442    H    TYR   3           H        TYR   3   6.065  12.226  -0.319
  443    HA   TYR   3           HA       TYR   3   7.021  12.171   2.463
  444   1HB   TYR   3          2HB       TYR   3   4.143  11.963   1.554
  445   2HB   TYR   3          1HB       TYR   3   4.704  11.743   3.207
  446    HD1  TYR   3           1HD      TYR   3   5.106  13.604   4.620
  447    HD2  TYR   3           2HD      TYR   3   4.346  14.215   0.480
  448    HE1  TYR   3           1HE      TYR   3   4.863  16.018   5.027
  449    HE2  TYR   3           2HE      TYR   3   4.104  16.630   0.875
  450    HH   TYR   3           HH       TYR   3   3.777  17.963   3.967
  451    H    LYS   4           H        LYS   4   7.086  10.150   3.448
  452    HA   LYS   4           HA       LYS   4   6.695   7.883   1.607
  453   1HB   LYS   4          2HB       LYS   4   9.043   8.241   2.224
  454   2HB   LYS   4          1HB       LYS   4   8.618   8.132   3.926
  455   1HG   LYS   4          2HG       LYS   4   8.003   5.822   3.680
  456   2HG   LYS   4          1HG       LYS   4   8.242   5.907   1.934
  457   1HD   LYS   4          2HD       LYS   4  10.141   4.838   3.046
  458   2HD   LYS   4          1HD       LYS   4  10.617   6.349   2.271
  459   1HE   LYS   4          2HE       LYS   4  10.471   7.491   4.439
  460   2HE   LYS   4          1HE       LYS   4  10.020   5.967   5.204
  461   1HZ   LYS   4          1HZ       LYS   4  12.141   5.386   5.346
  462   2HZ   LYS   4          2HZ       LYS   4  12.569   6.935   4.819
  463   3HZ   LYS   4          3HZ       LYS   4  12.413   5.677   3.700
  464    H    VAL   5           H        VAL   5   4.885   6.841   2.068
  465    HA   VAL   5           HA       VAL   5   3.910   6.770   4.814
  466    HB   VAL   5           HB       VAL   5   2.593   5.812   2.270
  467   1HG1  VAL   5          1HG1      VAL   5   0.761   5.192   3.446
  468   2HG1  VAL   5          2HG1      VAL   5   1.016   6.405   4.697
  469   3HG1  VAL   5          3HG1      VAL   5   1.961   4.918   4.708
  470   1HG2  VAL   5          1HG2      VAL   5   2.749   8.428   3.597
  471   2HG2  VAL   5          2HG2      VAL   5   1.130   7.924   3.106
  472   3HG2  VAL   5          3HG2      VAL   5   2.424   8.024   1.911
  473    H    ILE   6           H        ILE   6   3.946   5.055   6.064
  474    HA   ILE   6           HA       ILE   6   5.096   2.572   5.005
  475    HB   ILE   6           HB       ILE   6   4.887   3.606   7.834
  476   1HG1  ILE   6          2HG1      ILE   6   7.280   2.974   6.097
  477   2HG1  ILE   6          1HG1      ILE   6   6.646   4.588   6.384
  478   1HG2  ILE   6          1HG2      ILE   6   4.779   1.426   8.390
  479   2HG2  ILE   6          2HG2      ILE   6   6.505   1.451   8.030
  480   3HG2  ILE   6          3HG2      ILE   6   5.360   0.886   6.815
  481   1HD1  ILE   6          1HD1      ILE   6   8.590   4.141   7.765
  482   2HD1  ILE   6          2HD1      ILE   6   7.783   2.739   8.467
  483   3HD1  ILE   6          3HD1      ILE   6   7.151   4.359   8.761
  484    H    LEU   7           H        LEU   7   3.887   0.825   4.771
  485    HA   LEU   7           HA       LEU   7   1.180   0.843   5.911
  486   1HB   LEU   7          2HB       LEU   7   2.116  -0.981   3.714
  487   2HB   LEU   7          1HB       LEU   7   0.485  -0.453   4.083
  488    HG   LEU   7           HG       LEU   7   2.662   1.241   2.874
  489   1HD1  LEU   7          1HD1      LEU   7   1.623  -0.446   1.381
  490   2HD1  LEU   7          2HD1      LEU   7   1.324   1.217   0.887
  491   3HD1  LEU   7          3HD1      LEU   7   0.057   0.296   1.694
  492   1HD2  LEU   7          1HD2      LEU   7   1.037   3.007   2.752
  493   2HD2  LEU   7          2HD2      LEU   7   1.182   2.482   4.428
  494   3HD2  LEU   7          3HD2      LEU   7  -0.203   1.974   3.463
  495    H    ASN   8           H        ASN   8   1.818   0.068   7.961
  496    HA   ASN   8           HA       ASN   8   3.128  -2.518   8.140
  497   1HB   ASN   8          2HB       ASN   8   2.250  -0.505  10.199
  498   2HB   ASN   8          1HB       ASN   8   2.840  -2.099  10.647
  499   1HD2  ASN   8          1HD2      ASN   8   4.506  -1.380   7.930
  500   2HD2  ASN   8          2HD2      ASN   8   5.890  -0.629   8.627
  501    H    GLY   9           H        GLY   9   1.825  -4.166   7.624
  502   1HA   GLY   9          2HA       GLY   9  -0.751  -4.367   9.060
  503   2HA   GLY   9          1HA       GLY   9  -0.496  -5.007   7.445
  504    H    LYS  10           H        LYS  10  -1.358  -6.370   9.888
  505    HA   LYS  10           HA       LYS  10   0.470  -7.869  11.201
  506   1HB   LYS  10          2HB       LYS  10  -2.134  -8.878  10.052
  507   2HB   LYS  10          1HB       LYS  10  -1.235  -9.639  11.356
  508   1HG   LYS  10          2HG       LYS  10  -1.584  -7.684  12.760
  509   2HG   LYS  10          1HG       LYS  10  -2.453  -6.886  11.448
  510   1HD   LYS  10          2HD       LYS  10  -3.277  -9.467  12.777
  511   2HD   LYS  10          1HD       LYS  10  -3.976  -7.880  13.105
  512   1HE   LYS  10          2HE       LYS  10  -4.675  -7.727  10.750
  513   2HE   LYS  10          1HE       LYS  10  -4.021  -9.339  10.464
  514   1HZ   LYS  10          1HZ       LYS  10  -6.377  -8.557  12.057
  515   2HZ   LYS  10          2HZ       LYS  10  -5.590 -10.024  12.356
  516   3HZ   LYS  10          3HZ       LYS  10  -6.258  -9.719  10.833
  517    H    THR  11           H        THR  11  -1.011  -8.862   8.110
  518    HA   THR  11           HA       THR  11   1.087 -10.850   7.740
  519    HB   THR  11           HB       THR  11  -0.464 -11.482   5.780
  520    HG1  THR  11           1HG      THR  11  -2.340 -10.009   7.283
  521   1HG2  THR  11          1HG2      THR  11  -1.617 -12.975   7.056
  522   2HG2  THR  11          2HG2      THR  11  -1.943 -11.802   8.331
  523   3HG2  THR  11          3HG2      THR  11  -0.342 -12.525   8.187
  524    H    LEU  12           H        LEU  12   0.520  -7.692   6.866
  525    HA   LEU  12           HA       LEU  12   2.284  -7.983   4.546
  526   1HB   LEU  12          2HB       LEU  12   0.017  -7.708   3.695
  527   2HB   LEU  12          1HB       LEU  12  -0.193  -6.265   4.669
  528    HG   LEU  12           HG       LEU  12   1.315  -5.028   3.334
  529   1HD1  LEU  12          1HD1      LEU  12   2.339  -7.660   2.688
  530   2HD1  LEU  12          2HD1      LEU  12   3.139  -6.095   2.636
  531   3HD1  LEU  12          3HD1      LEU  12   2.166  -6.638   1.266
  532   1HD2  LEU  12          1HD2      LEU  12   0.107  -6.482   1.095
  533   2HD2  LEU  12          2HD2      LEU  12  -0.036  -4.787   1.558
  534   3HD2  LEU  12          3HD2      LEU  12  -1.021  -6.007   2.362
  535    H    LYS  13           H        LYS  13   3.883  -6.505   4.401
  536    HA   LYS  13           HA       LYS  13   3.750  -4.073   6.004
  537   1HB   LYS  13          2HB       LYS  13   5.973  -6.104   6.292
  538   2HB   LYS  13          1HB       LYS  13   5.985  -4.490   6.992
  539   1HG   LYS  13          2HG       LYS  13   4.037  -5.055   8.346
  540   2HG   LYS  13          1HG       LYS  13   4.009  -6.670   7.636
  541   1HD   LYS  13          2HD       LYS  13   6.266  -5.500   9.266
  542   2HD   LYS  13          1HD       LYS  13   5.075  -6.669   9.844
  543   1HE   LYS  13          2HE       LYS  13   5.854  -8.279   8.167
  544   2HE   LYS  13          1HE       LYS  13   7.047  -7.110   7.604
  545   1HZ   LYS  13          1HZ       LYS  13   8.287  -8.365   9.037
  546   2HZ   LYS  13          2HZ       LYS  13   7.001  -8.662  10.094
  547   3HZ   LYS  13          3HZ       LYS  13   7.763  -7.152  10.093
  548    H    GLY  14           H        GLY  14   5.041  -2.392   5.216
  549   1HA   GLY  14          2HA       GLY  14   7.117  -2.709   3.347
  550   2HA   GLY  14          1HA       GLY  14   5.620  -2.462   2.470
  551    H    GLU  15           H        GLU  15   6.958  -0.608   1.710
  552    HA   GLU  15           HA       GLU  15   6.249   1.748   3.274
  553   1HB   GLU  15          2HB       GLU  15   9.032   1.272   2.187
  554   2HB   GLU  15          1HB       GLU  15   8.465   2.775   2.897
  555   1HG   GLU  15          2HG       GLU  15   9.681   1.734   4.588
  556   2HG   GLU  15          1HG       GLU  15   7.996   1.429   4.997
  557    H    THR  16           H        THR  16   5.694   3.485   2.051
  558    HA   THR  16           HA       THR  16   6.140   3.356  -0.834
  559    HB   THR  16           HB       THR  16   3.995   2.495  -0.846
  560    HG1  THR  16           1HG      THR  16   3.461   5.248  -0.747
  561   1HG2  THR  16          1HG2      THR  16   3.421   2.515   1.457
  562   2HG2  THR  16          2HG2      THR  16   2.138   3.342   0.571
  563   3HG2  THR  16          3HG2      THR  16   3.329   4.276   1.474
  564    H    THR  17           H        THR  17   5.443   5.494  -1.915
  565    HA   THR  17           HA       THR  17   5.729   7.771  -0.109
  566    HB   THR  17           HB       THR  17   7.511   8.748  -1.536
  567    HG1  THR  17           1HG      THR  17   7.008   7.344  -3.367
  568   1HG2  THR  17          1HG2      THR  17   9.349   7.199  -0.857
  569   2HG2  THR  17          2HG2      THR  17   8.108   6.112  -0.234
  570   3HG2  THR  17          3HG2      THR  17   8.289   7.728   0.448
  571    H    THR  18           H        THR  18   4.249   9.208  -0.550
  572    HA   THR  18           HA       THR  18   3.211   9.488  -3.311
  573    HB   THR  18           HB       THR  18   1.528   8.866  -1.607
  574    HG1  THR  18           1HG      THR  18   0.982  10.285  -3.362
  575   1HG2  THR  18          1HG2      THR  18   0.853  10.813  -0.046
  576   2HG2  THR  18          2HG2      THR  18   2.541  11.297  -0.216
  577   3HG2  THR  18          3HG2      THR  18   2.141   9.711   0.440
  578    H    GLU  19           H        GLU  19   3.125  11.536  -4.239
  579    HA   GLU  19           HA       GLU  19   4.747  13.586  -2.886
  580   1HB   GLU  19          2HB       GLU  19   5.584  12.854  -5.072
  581   2HB   GLU  19          1HB       GLU  19   4.044  13.266  -5.813
  582   1HG   GLU  19          2HG       GLU  19   4.405  15.617  -5.253
  583   2HG   GLU  19          1HG       GLU  19   5.951  15.200  -4.518
  584    H    ALA  20           H        ALA  20   3.605  15.160  -1.904
  585    HA   ALA  20           HA       ALA  20   1.346  16.334  -3.314
  586   1HB   ALA  20          1HB       ALA  20   0.758  14.408  -1.566
  587   2HB   ALA  20          2HB       ALA  20  -0.274  15.815  -1.822
  588   3HB   ALA  20          3HB       ALA  20   0.841  15.774  -0.455
  589    H    VAL  21           H        VAL  21   0.821  18.404  -2.678
  590    HA   VAL  21           HA       VAL  21   2.845  20.137  -2.014
  591    HB   VAL  21           HB       VAL  21  -0.062  20.653  -1.394
  592   1HG1  VAL  21          1HG1      VAL  21   0.448  22.834  -1.203
  593   2HG1  VAL  21          2HG1      VAL  21   1.653  22.773  -2.488
  594   3HG1  VAL  21          3HG1      VAL  21   2.069  22.232  -0.861
  595   1HG2  VAL  21          1HG2      VAL  21   1.405  20.520  -3.987
  596   2HG2  VAL  21          2HG2      VAL  21   0.106  21.695  -3.790
  597   3HG2  VAL  21          3HG2      VAL  21  -0.222  19.974  -3.584
  598    H    ASP  22           H        ASP  22   0.578  18.567   0.173
  599    HA   ASP  22           HA       ASP  22   2.327  19.258   2.402
  600   1HB   ASP  22          2HB       ASP  22   0.548  20.117   3.810
  601   2HB   ASP  22          1HB       ASP  22   0.650  21.072   2.337
  602    H    ALA  23           H        ALA  23   1.492  18.168   4.491
  603    HA   ALA  23           HA       ALA  23   1.473  15.416   4.073
  604   1HB   ALA  23          1HB       ALA  23   0.675  15.390   6.537
  605   2HB   ALA  23          2HB       ALA  23   0.893  17.138   6.446
  606   3HB   ALA  23          3HB       ALA  23   2.260  16.061   6.152
  607    H    ALA  24           H        ALA  24  -1.207  17.617   4.760
  608    HA   ALA  24           HA       ALA  24  -3.200  15.641   5.008
  609   1HB   ALA  24          1HB       ALA  24  -4.611  17.738   4.061
  610   2HB   ALA  24          2HB       ALA  24  -3.145  18.564   4.592
  611   3HB   ALA  24          3HB       ALA  24  -4.076  17.597   5.738
  612    H    THR  25           H        THR  25  -2.338  17.688   2.213
  613    HA   THR  25           HA       THR  25  -4.019  16.554   0.335
  614    HB   THR  25           HB       THR  25  -2.351  17.314  -1.337
  615    HG1  THR  25           1HG      THR  25  -0.367  17.532  -0.812
  616   1HG2  THR  25          1HG2      THR  25  -3.115  19.136   0.882
  617   2HG2  THR  25          2HG2      THR  25  -3.663  19.112  -0.794
  618   3HG2  THR  25          3HG2      THR  25  -2.051  19.712  -0.401
  619    H    ALA  26           H        ALA  26  -0.755  15.599   1.329
  620    HA   ALA  26           HA       ALA  26  -0.456  13.403  -0.402
  621   1HB   ALA  26          1HB       ALA  26   1.550  13.755   0.579
  622   2HB   ALA  26          2HB       ALA  26   0.944  12.622   1.787
  623   3HB   ALA  26          3HB       ALA  26   0.829  14.359   2.069
  624    H    GLU  27           H        GLU  27  -1.551  13.552   2.994
  625    HA   GLU  27           HA       GLU  27  -2.230  10.938   3.420
  626   1HB   GLU  27          2HB       GLU  27  -2.317  12.536   5.201
  627   2HB   GLU  27          1HB       GLU  27  -3.544  13.480   4.370
  628   1HG   GLU  27          2HG       GLU  27  -4.447  12.198   6.244
  629   2HG   GLU  27          1HG       GLU  27  -5.172  11.741   4.704
  630    H    LYS  28           H        LYS  28  -4.257  13.489   2.005
  631    HA   LYS  28           HA       LYS  28  -6.514  11.857   1.551
  632   1HB   LYS  28          2HB       LYS  28  -5.648  14.367   0.096
  633   2HB   LYS  28          1HB       LYS  28  -7.251  13.646   0.023
  634   1HG   LYS  28          2HG       LYS  28  -5.917  14.883   2.416
  635   2HG   LYS  28          1HG       LYS  28  -7.326  15.483   1.541
  636   1HD   LYS  28          2HD       LYS  28  -8.594  13.513   2.226
  637   2HD   LYS  28          1HD       LYS  28  -7.181  12.893   3.083
  638   1HE   LYS  28          2HE       LYS  28  -8.750  13.959   4.623
  639   2HE   LYS  28          1HE       LYS  28  -7.218  14.832   4.565
  640   1HZ   LYS  28          1HZ       LYS  28  -8.158  16.592   3.467
  641   2HZ   LYS  28          2HZ       LYS  28  -9.456  16.115   4.442
  642   3HZ   LYS  28          3HZ       LYS  28  -9.419  15.675   2.809
  643    H    VAL  29           H        VAL  29  -3.792  12.792  -0.523
  644    HA   VAL  29           HA       VAL  29  -4.647  11.478  -2.845
  645    HB   VAL  29           HB       VAL  29  -1.812  11.976  -1.913
  646   1HG1  VAL  29          1HG1      VAL  29  -2.214  10.275  -3.796
  647   2HG1  VAL  29          2HG1      VAL  29  -1.063  11.576  -4.085
  648   3HG1  VAL  29          3HG1      VAL  29  -2.685  11.670  -4.767
  649   1HG2  VAL  29          1HG2      VAL  29  -1.989  14.107  -2.581
  650   2HG2  VAL  29          2HG2      VAL  29  -3.728  13.852  -2.441
  651   3HG2  VAL  29          3HG2      VAL  29  -2.934  13.683  -4.008
  652    H    VAL  30           H        VAL  30  -2.796  10.360  -0.061
  653    HA   VAL  30           HA       VAL  30  -2.204   7.782  -1.100
  654    HB   VAL  30           HB       VAL  30  -2.477   8.601   1.798
  655   1HG1  VAL  30          1HG1      VAL  30  -0.749   6.408   0.691
  656   2HG1  VAL  30          2HG1      VAL  30  -2.424   6.121   1.152
  657   3HG1  VAL  30          3HG1      VAL  30  -1.261   6.673   2.356
  658   1HG2  VAL  30          1HG2      VAL  30  -0.753   9.710   0.014
  659   2HG2  VAL  30          2HG2      VAL  30   0.204   8.366   0.637
  660   3HG2  VAL  30          3HG2      VAL  30  -0.453   9.571   1.746
  661    H    LYS  31           H        LYS  31  -4.750   9.010   1.102
  662    HA   LYS  31           HA       LYS  31  -6.129   6.675   1.561
  663   1HB   LYS  31          2HB       LYS  31  -7.143   9.488   1.209
  664   2HB   LYS  31          1HB       LYS  31  -8.201   8.153   1.639
  665   1HG   LYS  31          2HG       LYS  31  -6.930   7.749   3.657
  666   2HG   LYS  31          1HG       LYS  31  -5.798   9.029   3.223
  667   1HD   LYS  31          2HD       LYS  31  -7.347   9.876   4.856
  668   2HD   LYS  31          1HD       LYS  31  -7.678  10.647   3.304
  669   1HE   LYS  31          2HE       LYS  31  -9.177   8.236   4.311
  670   2HE   LYS  31          1HE       LYS  31  -9.696   9.893   4.618
  671   1HZ   LYS  31          1HZ       LYS  31  -9.268   9.810   1.921
  672   2HZ   LYS  31          2HZ       LYS  31 -10.770   9.749   2.693
  673   3HZ   LYS  31          3HZ       LYS  31  -9.988   8.315   2.254
  674    H    GLN  32           H        GLN  32  -6.353   8.856  -1.191
  675    HA   GLN  32           HA       GLN  32  -8.423   7.527  -2.563
  676   1HB   GLN  32          2HB       GLN  32  -7.592   9.795  -3.157
  677   2HB   GLN  32          1HB       GLN  32  -6.106   9.070  -3.753
  678   1HG   GLN  32          2HG       GLN  32  -7.528   9.564  -5.606
  679   2HG   GLN  32          1HG       GLN  32  -7.416   7.818  -5.419
  680   1HE2  GLN  32          1HE2      GLN  32  -9.386   9.125  -3.015
  681   2HE2  GLN  32          2HE2      GLN  32 -10.912   8.830  -3.760
  682    H    PHE  33           H        PHE  33  -4.971   7.029  -2.394
  683    HA   PHE  33           HA       PHE  33  -4.547   5.242  -4.470
  684   1HB   PHE  33          2HB       PHE  33  -2.836   6.292  -2.893
  685   2HB   PHE  33          1HB       PHE  33  -3.262   5.034  -1.739
  686    HD1  PHE  33           1HD      PHE  33  -2.432   5.211  -5.374
  687    HD2  PHE  33           2HD      PHE  33  -1.767   3.309  -1.608
  688    HE1  PHE  33           1HE      PHE  33  -0.827   3.667  -6.422
  689    HE2  PHE  33           2HE      PHE  33  -0.149   1.788  -2.666
  690    HZ   PHE  33           HZ       PHE  33   0.320   1.973  -5.078
  691    H    PHE  34           H        PHE  34  -5.033   4.379  -1.070
  692    HA   PHE  34           HA       PHE  34  -5.597   1.640  -1.608
  693   1HB   PHE  34          2HB       PHE  34  -6.191   3.245   0.884
  694   2HB   PHE  34          1HB       PHE  34  -6.187   1.484   0.764
  695    HD1  PHE  34           1HD      PHE  34  -3.845   0.945  -0.843
  696    HD2  PHE  34           2HD      PHE  34  -4.411   3.803   2.250
  697    HE1  PHE  34           1HE      PHE  34  -1.431   0.933  -0.403
  698    HE2  PHE  34           2HE      PHE  34  -1.994   3.797   2.704
  699    HZ   PHE  34           HZ       PHE  34  -0.507   2.362   1.364
  700    H    ASN  35           H        ASN  35  -7.603   4.465  -1.023
  701    HA   ASN  35           HA       ASN  35 -10.118   3.330  -0.784
  702   1HB   ASN  35          2HB       ASN  35  -9.665   5.745  -0.594
  703   2HB   ASN  35          1HB       ASN  35  -9.319   5.822  -2.317
  704   1HD2  ASN  35          1HD2      ASN  35 -11.459   6.789  -0.275
  705   2HD2  ASN  35          2HD2      ASN  35 -12.929   6.590  -1.159
  706    H    ASP  36           H        ASP  36  -8.144   3.945  -3.600
  707    HA   ASP  36           HA       ASP  36 -10.142   2.830  -5.414
  708   1HB   ASP  36          2HB       ASP  36  -7.467   4.113  -5.994
  709   2HB   ASP  36          1HB       ASP  36  -8.620   3.580  -7.213
  710    H    ASN  37           H        ASN  37  -7.115   1.898  -3.926
  711    HA   ASN  37           HA       ASN  37  -6.600  -0.230  -5.807
  712   1HB   ASN  37          2HB       ASN  37  -5.455   0.291  -3.051
  713   2HB   ASN  37          1HB       ASN  37  -4.927  -1.003  -4.117
  714   1HD2  ASN  37          1HD2      ASN  37  -3.698   1.545  -2.957
  715   2HD2  ASN  37          2HD2      ASN  37  -2.943   2.271  -4.332
  716    H    GLY  38           H        GLY  38  -7.917   0.113  -2.596
  717   1HA   GLY  38          2HA       GLY  38  -8.445  -1.890  -1.243
  718   2HA   GLY  38          1HA       GLY  38  -9.869  -1.163  -1.951
  719    H    VAL  39           H        VAL  39 -11.217  -2.529  -2.792
  720    HA   VAL  39           HA       VAL  39 -10.443  -5.253  -3.222
  721    HB   VAL  39           HB       VAL  39 -13.098  -3.871  -3.355
  722   1HG1  VAL  39          1HG1      VAL  39 -13.761  -6.476  -3.176
  723   2HG1  VAL  39          2HG1      VAL  39 -12.329  -6.597  -4.197
  724   3HG1  VAL  39          3HG1      VAL  39 -13.689  -5.597  -4.705
  725   1HG2  VAL  39          1HG2      VAL  39 -13.311  -4.372  -1.195
  726   2HG2  VAL  39          2HG2      VAL  39 -11.569  -4.645  -1.217
  727   3HG2  VAL  39          3HG2      VAL  39 -12.677  -6.002  -1.420
  728    H    ASP  40           H        ASP  40 -12.074  -2.904  -5.441
  729    HA   ASP  40           HA       ASP  40 -11.651  -4.773  -7.599
  730   1HB   ASP  40          2HB       ASP  40 -12.953  -2.051  -7.557
  731   2HB   ASP  40          1HB       ASP  40 -12.928  -3.139  -8.942
  732    H    GLY  41           H        GLY  41  -9.272  -3.343  -6.409
  733   1HA   GLY  41          2HA       GLY  41  -8.401  -1.441  -8.351
  734   2HA   GLY  41          1HA       GLY  41  -7.384  -2.242  -7.163
  735    H    GLU  42           H        GLU  42  -6.584  -1.712  -9.836
  736    HA   GLU  42           HA       GLU  42  -6.756  -4.263 -11.242
  737   1HB   GLU  42          2HB       GLU  42  -5.348  -1.692 -11.997
  738   2HB   GLU  42          1HB       GLU  42  -5.497  -3.109 -13.026
  739   1HG   GLU  42          2HG       GLU  42  -7.772  -1.419 -12.011
  740   2HG   GLU  42          1HG       GLU  42  -7.098  -1.387 -13.639
  741    H    TRP  43           H        TRP  43  -5.510  -5.745 -10.167
  742    HA   TRP  43           HA       TRP  43  -2.777  -4.998  -9.433
  743   1HB   TRP  43          2HB       TRP  43  -4.326  -7.499  -8.765
  744   2HB   TRP  43          1HB       TRP  43  -2.760  -7.043  -8.113
  745    HD1  TRP  43           HD       TRP  43  -5.754  -4.616  -8.337
  746    HE1  TRP  43           1HE      TRP  43  -6.423  -3.958  -5.937
  747    HE3  TRP  43           3HE      TRP  43  -2.609  -7.692  -5.767
  748    HZ2  TRP  43           2HZ      TRP  43  -5.697  -4.656  -3.304
  749    HZ3  TRP  43           3HZ      TRP  43  -2.650  -7.641  -3.318
  750    HH2  TRP  43           HH       TRP  43  -4.163  -6.154  -2.104
  751    H    THR  44           H        THR  44  -1.136  -5.517 -10.710
  752    HA   THR  44           HA       THR  44  -1.432  -7.758 -12.591
  753    HB   THR  44           HB       THR  44   0.508  -6.740 -13.776
  754    HG1  THR  44           1HG      THR  44   1.250  -5.615 -11.819
  755   1HG2  THR  44          1HG2      THR  44  -1.385  -4.477 -13.489
  756   2HG2  THR  44          2HG2      THR  44  -2.002  -6.013 -14.099
  757   3HG2  THR  44          3HG2      THR  44  -0.684  -5.197 -14.940
  758    H    TYR  45           H        TYR  45  -0.125  -9.533 -12.388
  759    HA   TYR  45           HA       TYR  45   1.792  -9.476 -10.156
  760   1HB   TYR  45          2HB       TYR  45  -0.067 -11.043  -9.862
  761   2HB   TYR  45          1HB       TYR  45   0.342 -11.830 -11.381
  762    HD1  TYR  45           1HD      TYR  45   2.646 -10.688  -8.692
  763    HD2  TYR  45           2HD      TYR  45   0.913 -14.001 -10.720
  764    HE1  TYR  45           1HE      TYR  45   4.159 -12.208  -7.488
  765    HE2  TYR  45           2HE      TYR  45   2.420 -15.532  -9.521
  766    HH   TYR  45           HH       TYR  45   4.525 -15.506  -8.354
  767    H    ASP  46           H        ASP  46   3.851 -10.220 -10.377
  768    HA   ASP  46           HA       ASP  46   4.701 -11.004 -13.085
  769   1HB   ASP  46          2HB       ASP  46   5.429  -8.706 -12.599
  770   2HB   ASP  46          1HB       ASP  46   6.212  -9.260 -11.122
  771    H    ASP  47           H        ASP  47   4.447 -13.193 -12.353
  772    HA   ASP  47           HA       ASP  47   5.499 -14.410 -10.149
  773   1HB   ASP  47          2HB       ASP  47   5.456 -15.509 -12.966
  774   2HB   ASP  47          1HB       ASP  47   5.660 -16.472 -11.505
  775    H    ALA  48           H        ALA  48   7.231 -13.372 -13.018
  776    HA   ALA  48           HA       ALA  48   9.611 -14.716 -12.794
  777   1HB   ALA  48          1HB       ALA  48   8.966 -13.130 -14.605
  778   2HB   ALA  48          2HB       ALA  48  10.626 -12.952 -14.040
  779   3HB   ALA  48          3HB       ALA  48   9.390 -11.804 -13.523
  780    H    THR  49           H        THR  49   8.491 -12.031 -10.828
  781    HA   THR  49           HA       THR  49  10.929 -12.324  -9.199
  782    HB   THR  49           HB       THR  49  10.816  -9.907  -8.698
  783    HG1  THR  49           1HG      THR  49   9.451  -8.616  -9.982
  784   1HG2  THR  49          1HG2      THR  49  11.857  -9.135 -10.598
  785   2HG2  THR  49          2HG2      THR  49  10.839 -10.093 -11.673
  786   3HG2  THR  49          3HG2      THR  49  12.098 -10.879 -10.719
  787    H    LYS  50           H        LYS  50   7.900 -13.164  -9.116
  788    HA   LYS  50           HA       LYS  50   6.291 -13.469  -7.512
  789   1HB   LYS  50          2HB       LYS  50   8.724 -13.119  -5.752
  790   2HB   LYS  50          1HB       LYS  50   7.155 -13.637  -5.153
  791   1HG   LYS  50          2HG       LYS  50   8.735 -15.105  -7.251
  792   2HG   LYS  50          1HG       LYS  50   8.760 -15.485  -5.528
  793   1HD   LYS  50          2HD       LYS  50   6.287 -15.803  -5.643
  794   2HD   LYS  50          1HD       LYS  50   6.397 -15.614  -7.394
  795   1HE   LYS  50          2HE       LYS  50   7.796 -17.723  -5.751
  796   2HE   LYS  50          1HE       LYS  50   6.355 -17.974  -6.735
  797   1HZ   LYS  50          1HZ       LYS  50   9.131 -17.614  -7.562
  798   2HZ   LYS  50          2HZ       LYS  50   7.937 -16.966  -8.568
  799   3HZ   LYS  50          3HZ       LYS  50   7.932 -18.618  -8.207
  800    H    THR  51           H        THR  51   6.748 -10.768  -8.489
  801    HA   THR  51           HA       THR  51   5.994  -9.191  -6.125
  802    HB   THR  51           HB       THR  51   7.180  -8.303  -8.760
  803    HG1  THR  51           1HG      THR  51   8.558  -9.357  -7.142
  804   1HG2  THR  51          1HG2      THR  51   7.528  -6.223  -7.061
  805   2HG2  THR  51          2HG2      THR  51   5.912  -6.774  -6.619
  806   3HG2  THR  51          3HG2      THR  51   6.266  -6.327  -8.287
  807    H    PHE  52           H        PHE  52   4.088  -8.122  -6.056
  808    HA   PHE  52           HA       PHE  52   2.309  -8.459  -8.378
  809   1HB   PHE  52          2HB       PHE  52   1.572  -8.010  -5.490
  810   2HB   PHE  52          1HB       PHE  52   0.443  -8.220  -6.822
  811    HD1  PHE  52           1HD      PHE  52  -0.485 -10.294  -7.083
  812    HD2  PHE  52           2HD      PHE  52   3.374  -9.980  -5.319
  813    HE1  PHE  52           1HE      PHE  52  -0.462 -12.725  -6.713
  814    HE2  PHE  52           2HE      PHE  52   3.406 -12.411  -4.948
  815    HZ   PHE  52           HZ       PHE  52   1.486 -13.786  -5.644
  816    H    THR  53           H        THR  53   2.732  -6.679  -9.504
  817    HA   THR  53           HA       THR  53   2.848  -4.059  -8.340
  818    HB   THR  53           HB       THR  53   2.630  -3.349 -10.840
  819    HG1  THR  53           1HG      THR  53   3.072  -4.917 -12.290
  820   1HG2  THR  53          1HG2      THR  53   4.705  -2.966  -9.970
  821   2HG2  THR  53          2HG2      THR  53   5.058  -4.164 -11.220
  822   3HG2  THR  53          3HG2      THR  53   4.956  -4.658  -9.530
  823    H    VAL  54           H        VAL  54   1.323  -2.692  -7.909
  824    HA   VAL  54           HA       VAL  54  -1.369  -3.132  -9.029
  825    HB   VAL  54           HB       VAL  54  -0.672  -1.965  -6.317
  826   1HG1  VAL  54          1HG1      VAL  54  -3.161  -2.078  -7.900
  827   2HG1  VAL  54          2HG1      VAL  54  -2.652  -0.932  -6.660
  828   3HG1  VAL  54          3HG1      VAL  54  -3.304  -2.502  -6.194
  829   1HG2  VAL  54          1HG2      VAL  54  -0.292  -4.306  -6.224
  830   2HG2  VAL  54          2HG2      VAL  54  -1.766  -4.651  -7.129
  831   3HG2  VAL  54          3HG2      VAL  54  -1.867  -4.019  -5.485
  832    H    THR  55           H        THR  55  -2.027  -1.531 -10.325
  833    HA   THR  55           HA       THR  55  -0.784   1.111  -9.969
  834    HB   THR  55           HB       THR  55  -1.828  -0.022 -12.562
  835    HG1  THR  55           1HG      THR  55   0.777   0.015 -11.457
  836   1HG2  THR  55          1HG2      THR  55  -0.720   1.751 -13.647
  837   2HG2  THR  55          2HG2      THR  55   0.088   2.254 -12.160
  838   3HG2  THR  55          3HG2      THR  55  -1.653   2.478 -12.338
  839    H    GLU  56           H        GLU  56  -2.051   2.798  -9.581
  840    HA   GLU  56           HA       GLU  56  -4.844   2.433  -9.201
  841   1HB   GLU  56          2HB       GLU  56  -3.542   4.004  -7.851
  842   2HB   GLU  56          1HB       GLU  56  -3.202   4.970  -9.279
  843   1HG   GLU  56          2HG       GLU  56  -5.585   5.463  -9.511
  844   2HG   GLU  56          1HG       GLU  56  -5.921   4.498  -8.074
  Start of MODEL   26
    1   1H    MET   1          1HT       MET   1   4.643 -18.473   2.314
    2   2H    MET   1          2HT       MET   1   5.264 -19.915   1.684
    3   3H    MET   1          3HT       MET   1   4.236 -18.955   0.744
    4    HA   MET   1           HA       MET   1   7.054 -18.530   1.449
    5   1HB   MET   1          2HB       MET   1   6.345 -19.599  -0.688
    6   2HB   MET   1          1HB       MET   1   5.463 -18.136  -1.098
    7   1HG   MET   1          2HG       MET   1   7.483 -16.872  -1.228
    8   2HG   MET   1          1HG       MET   1   8.426 -18.221  -0.598
    9   1HE   MET   1          1HE       MET   1   5.522 -18.682  -3.381
   10   2HE   MET   1          2HE       MET   1   6.445 -18.063  -4.749
   11   3HE   MET   1          3HE       MET   1   6.088 -17.011  -3.379
   12    H    GLN   2           H        GLN   2   7.917 -16.382   0.628
   13    HA   GLN   2           HA       GLN   2   6.205 -14.242   1.660
   14   1HB   GLN   2          2HB       GLN   2   8.417 -14.463   2.698
   15   2HB   GLN   2          1HB       GLN   2   9.184 -14.291   1.125
   16   1HG   GLN   2          2HG       GLN   2   8.304 -12.023   0.938
   17   2HG   GLN   2          1HG       GLN   2   7.526 -12.194   2.509
   18   1HE2  GLN   2          1HE2      GLN   2  10.368 -13.843   2.746
   19   2HE2  GLN   2          2HE2      GLN   2  11.372 -12.590   3.376
   20    H    TYR   3           H        TYR   3   5.562 -12.546   0.410
   21    HA   TYR   3           HA       TYR   3   6.531 -12.498  -2.369
   22   1HB   TYR   3          2HB       TYR   3   3.680 -12.089  -1.447
   23   2HB   TYR   3          1HB       TYR   3   4.251 -11.928  -3.104
   24    HD1  TYR   3           1HD      TYR   3   4.154 -13.764  -4.523
   25    HD2  TYR   3           2HD      TYR   3   4.094 -14.403  -0.317
   26    HE1  TYR   3           1HE      TYR   3   3.749 -16.160  -4.899
   27    HE2  TYR   3           2HE      TYR   3   3.691 -16.801  -0.680
   28    HH   TYR   3           HH       TYR   3   3.864 -18.476  -2.311
   29    H    LYS   4           H        LYS   4   6.795 -10.514  -3.318
   30    HA   LYS   4           HA       LYS   4   6.602  -8.212  -1.493
   31   1HB   LYS   4          2HB       LYS   4   8.883  -8.801  -2.248
   32   2HB   LYS   4          1HB       LYS   4   8.374  -8.580  -3.917
   33   1HG   LYS   4          2HG       LYS   4   7.922  -6.223  -3.471
   34   2HG   LYS   4          1HG       LYS   4   8.427  -6.444  -1.794
   35   1HD   LYS   4          2HD       LYS   4  10.662  -7.112  -2.577
   36   2HD   LYS   4          1HD       LYS   4  10.148  -6.835  -4.243
   37   1HE   LYS   4          2HE       LYS   4  11.405  -4.930  -3.403
   38   2HE   LYS   4          1HE       LYS   4   9.730  -4.481  -3.719
   39   1HZ   LYS   4          1HZ       LYS   4  10.851  -5.144  -1.049
   40   2HZ   LYS   4          2HZ       LYS   4   9.260  -4.663  -1.367
   41   3HZ   LYS   4          3HZ       LYS   4  10.536  -3.581  -1.617
   42    H    VAL   5           H        VAL   5   4.821  -7.063  -1.900
   43    HA   VAL   5           HA       VAL   5   3.800  -6.911  -4.630
   44    HB   VAL   5           HB       VAL   5   2.565  -5.907  -2.062
   45   1HG1  VAL   5          1HG1      VAL   5   1.046  -6.394  -4.583
   46   2HG1  VAL   5          2HG1      VAL   5   1.929  -4.882  -4.381
   47   3HG1  VAL   5          3HG1      VAL   5   0.668  -5.327  -3.233
   48   1HG2  VAL   5          1HG2      VAL   5   0.994  -7.952  -2.911
   49   2HG2  VAL   5          2HG2      VAL   5   2.263  -8.099  -1.694
   50   3HG2  VAL   5          3HG2      VAL   5   2.596  -8.529  -3.371
   51    H    ILE   6           H        ILE   6   3.727  -5.095  -5.822
   52    HA   ILE   6           HA       ILE   6   5.043  -2.715  -4.693
   53    HB   ILE   6           HB       ILE   6   4.859  -3.640  -7.565
   54   1HG1  ILE   6          2HG1      ILE   6   7.240  -3.212  -5.748
   55   2HG1  ILE   6          1HG1      ILE   6   6.534  -4.775  -6.135
   56   1HG2  ILE   6          1HG2      ILE   6   6.346  -1.649  -8.009
   57   2HG2  ILE   6          2HG2      ILE   6   5.894  -1.061  -6.408
   58   3HG2  ILE   6          3HG2      ILE   6   4.659  -1.279  -7.648
   59   1HD1  ILE   6          1HD1      ILE   6   7.116  -4.471  -8.475
   60   2HD1  ILE   6          2HD1      ILE   6   8.539  -4.337  -7.443
   61   3HD1  ILE   6          3HD1      ILE   6   7.790  -2.884  -8.106
   62    H    LEU   7           H        LEU   7   3.877  -0.952  -4.432
   63    HA   LEU   7           HA       LEU   7   1.196  -0.862  -5.623
   64   1HB   LEU   7          2HB       LEU   7   2.178   0.958  -3.445
   65   2HB   LEU   7          1HB       LEU   7   0.531   0.490  -3.827
   66    HG   LEU   7           HG       LEU   7   2.634  -1.218  -2.514
   67   1HD1  LEU   7          1HD1      LEU   7  -0.049  -0.294  -1.505
   68   2HD1  LEU   7          2HD1      LEU   7   1.483   0.489  -1.121
   69   3HD1  LEU   7          3HD1      LEU   7   1.190  -1.173  -0.608
   70   1HD2  LEU   7          1HD2      LEU   7   1.246  -2.474  -4.155
   71   2HD2  LEU   7          2HD2      LEU   7  -0.185  -1.996  -3.245
   72   3HD2  LEU   7          3HD2      LEU   7   1.047  -3.009  -2.487
   73    H    ASN   8           H        ASN   8   1.996  -0.200  -7.671
   74    HA   ASN   8           HA       ASN   8   3.343   2.368  -7.869
   75   1HB   ASN   8          2HB       ASN   8   3.970   0.363  -9.257
   76   2HB   ASN   8          1HB       ASN   8   2.427   0.525 -10.083
   77   1HD2  ASN   8          1HD2      ASN   8   5.525   1.030 -10.504
   78   2HD2  ASN   8          2HD2      ASN   8   5.513   2.452 -11.486
   79    H    GLY   9           H        GLY   9   2.080   4.127  -7.696
   80   1HA   GLY   9          2HA       GLY   9  -0.498   4.095  -9.142
   81   2HA   GLY   9          1HA       GLY   9  -0.223   5.011  -7.670
   82    H    LYS  10           H        LYS  10  -1.122   6.721  -9.156
   83    HA   LYS  10           HA       LYS  10   0.687   7.724 -11.160
   84   1HB   LYS  10          2HB       LYS  10  -1.882   8.826 -10.015
   85   2HB   LYS  10          1HB       LYS  10  -0.956   9.632 -11.274
   86   1HG   LYS  10          2HG       LYS  10  -1.261   7.685 -12.732
   87   2HG   LYS  10          1HG       LYS  10  -2.212   6.901 -11.470
   88   1HD   LYS  10          2HD       LYS  10  -3.881   8.643 -11.589
   89   2HD   LYS  10          1HD       LYS  10  -2.902   9.549 -12.745
   90   1HE   LYS  10          2HE       LYS  10  -4.699   8.352 -13.874
   91   2HE   LYS  10          1HE       LYS  10  -3.125   7.730 -14.361
   92   1HZ   LYS  10          1HZ       LYS  10  -3.839   5.728 -13.794
   93   2HZ   LYS  10          2HZ       LYS  10  -5.285   6.351 -13.174
   94   3HZ   LYS  10          3HZ       LYS  10  -3.925   6.225 -12.178
   95    H    THR  11           H        THR  11  -0.558   8.918  -8.045
   96    HA   THR  11           HA       THR  11   1.688  10.787  -7.888
   97    HB   THR  11           HB       THR  11   0.269  11.733  -5.981
   98    HG1  THR  11           1HG      THR  11  -1.774  10.229  -7.223
   99   1HG2  THR  11          1HG2      THR  11  -0.275  11.925  -8.852
  100   2HG2  THR  11          2HG2      THR  11  -0.015  13.192  -7.652
  101   3HG2  THR  11          3HG2      THR  11  -1.598  12.431  -7.804
  102    H    LEU  12           H        LEU  12   0.995   7.731  -6.943
  103    HA   LEU  12           HA       LEU  12   2.707   7.984  -4.588
  104   1HB   LEU  12          2HB       LEU  12   0.413   7.887  -3.784
  105   2HB   LEU  12          1HB       LEU  12   0.130   6.424  -4.707
  106    HG   LEU  12           HG       LEU  12   1.597   5.165  -3.301
  107   1HD1  LEU  12          1HD1      LEU  12   2.346   6.819  -1.221
  108   2HD1  LEU  12          2HD1      LEU  12   2.621   7.793  -2.661
  109   3HD1  LEU  12          3HD1      LEU  12   3.389   6.220  -2.512
  110   1HD2  LEU  12          1HD2      LEU  12   0.345   6.581  -1.098
  111   2HD2  LEU  12          2HD2      LEU  12   0.076   4.942  -1.690
  112   3HD2  LEU  12          3HD2      LEU  12  -0.764   6.297  -2.439
  113    H    LYS  13           H        LYS  13   4.183   6.419  -4.324
  114    HA   LYS  13           HA       LYS  13   4.005   3.952  -5.882
  115   1HB   LYS  13          2HB       LYS  13   6.520   5.624  -5.903
  116   2HB   LYS  13          1HB       LYS  13   6.212   4.146  -6.802
  117   1HG   LYS  13          2HG       LYS  13   5.986   5.757  -8.421
  118   2HG   LYS  13          1HG       LYS  13   4.314   5.520  -7.906
  119   1HD   LYS  13          2HD       LYS  13   4.360   7.497  -6.581
  120   2HD   LYS  13          1HD       LYS  13   6.103   7.664  -6.784
  121   1HE   LYS  13          2HE       LYS  13   4.826   9.229  -8.195
  122   2HE   LYS  13          1HE       LYS  13   5.822   8.120  -9.138
  123   1HZ   LYS  13          1HZ       LYS  13   3.285   8.584  -9.687
  124   2HZ   LYS  13          2HZ       LYS  13   3.079   7.291  -8.616
  125   3HZ   LYS  13          3HZ       LYS  13   4.025   7.098 -10.005
  126    H    GLY  14           H        GLY  14   5.102   2.205  -4.921
  127   1HA   GLY  14          2HA       GLY  14   6.975   2.545  -2.812
  128   2HA   GLY  14          1HA       GLY  14   5.378   2.233  -2.160
  129    H    GLU  15           H        GLU  15   6.907   0.441  -1.334
  130    HA   GLU  15           HA       GLU  15   6.369  -1.923  -2.969
  131   1HB   GLU  15          2HB       GLU  15   9.047  -1.334  -1.693
  132   2HB   GLU  15          1HB       GLU  15   8.612  -2.826  -2.514
  133   1HG   GLU  15          2HG       GLU  15   8.351  -1.623  -4.606
  134   2HG   GLU  15          1HG       GLU  15   8.725  -0.102  -3.794
  135    H    THR  16           H        THR  16   5.673  -3.632  -1.811
  136    HA   THR  16           HA       THR  16   6.022  -3.596   1.096
  137    HB   THR  16           HB       THR  16   3.896  -2.691   1.026
  138    HG1  THR  16           1HG      THR  16   3.310  -5.434   0.853
  139   1HG2  THR  16          1HG2      THR  16   2.084  -3.575  -0.488
  140   2HG2  THR  16          2HG2      THR  16   3.369  -4.377  -1.389
  141   3HG2  THR  16          3HG2      THR  16   3.354  -2.620  -1.252
  142    H    THR  17           H        THR  17   5.312  -5.727   2.098
  143    HA   THR  17           HA       THR  17   5.557  -7.987   0.261
  144    HB   THR  17           HB       THR  17   7.295  -9.022   1.720
  145    HG1  THR  17           1HG      THR  17   8.416  -7.629   3.126
  146   1HG2  THR  17          1HG2      THR  17   9.180  -7.487   1.042
  147   2HG2  THR  17          2HG2      THR  17   7.947  -6.450   0.327
  148   3HG2  THR  17          3HG2      THR  17   8.155  -8.100  -0.257
  149    H    THR  18           H        THR  18   4.022  -9.392   0.694
  150    HA   THR  18           HA       THR  18   2.990  -9.640   3.456
  151    HB   THR  18           HB       THR  18   1.351  -8.955   1.702
  152    HG1  THR  18           1HG      THR  18   0.739 -10.215   3.549
  153   1HG2  THR  18          1HG2      THR  18   2.085 -11.596   0.497
  154   2HG2  THR  18          2HG2      THR  18   1.984 -10.016  -0.278
  155   3HG2  THR  18          3HG2      THR  18   0.513 -10.846   0.228
  156    H    GLU  19           H        GLU  19   2.767 -11.700   4.368
  157    HA   GLU  19           HA       GLU  19   4.337 -13.809   3.039
  158   1HB   GLU  19          2HB       GLU  19   5.215 -13.095   5.204
  159   2HB   GLU  19          1HB       GLU  19   3.661 -13.411   5.962
  160   1HG   GLU  19          2HG       GLU  19   5.228 -15.183   6.451
  161   2HG   GLU  19          1HG       GLU  19   3.900 -15.789   5.464
  162    H    ALA  20           H        ALA  20   3.178 -15.395   2.118
  163    HA   ALA  20           HA       ALA  20   0.881 -16.480   3.537
  164   1HB   ALA  20          1HB       ALA  20   0.537 -15.735   0.654
  165   2HB   ALA  20          2HB       ALA  20   0.128 -14.623   1.959
  166   3HB   ALA  20          3HB       ALA  20  -0.693 -16.178   1.838
  167    H    VAL  21           H        VAL  21   0.297 -18.551   2.926
  168    HA   VAL  21           HA       VAL  21   2.288 -20.341   2.324
  169    HB   VAL  21           HB       VAL  21  -0.620 -20.799   1.670
  170   1HG1  VAL  21          1HG1      VAL  21   1.058 -22.497   0.909
  171   2HG1  VAL  21          2HG1      VAL  21  -0.174 -23.109   2.012
  172   3HG1  VAL  21          3HG1      VAL  21   1.451 -22.771   2.607
  173   1HG2  VAL  21          1HG2      VAL  21  -0.554 -21.788   4.070
  174   2HG2  VAL  21          2HG2      VAL  21  -0.753 -20.049   3.851
  175   3HG2  VAL  21          3HG2      VAL  21   0.824 -20.709   4.285
  176    H    ASP  22           H        ASP  22   0.343 -18.525   0.090
  177    HA   ASP  22           HA       ASP  22   2.026 -19.413  -2.092
  178   1HB   ASP  22          2HB       ASP  22   0.233 -20.169  -3.547
  179   2HB   ASP  22          1HB       ASP  22   0.252 -21.127  -2.071
  180    H    ALA  23           H        ALA  23   1.197 -18.323  -4.234
  181    HA   ALA  23           HA       ALA  23   1.369 -15.563  -3.844
  182   1HB   ALA  23          1HB       ALA  23   0.971 -17.357  -6.135
  183   2HB   ALA  23          2HB       ALA  23   2.062 -15.985  -5.942
  184   3HB   ALA  23          3HB       ALA  23   0.369 -15.714  -6.352
  185    H    ALA  24           H        ALA  24  -1.437 -17.606  -4.512
  186    HA   ALA  24           HA       ALA  24  -3.299 -15.503  -4.770
  187   1HB   ALA  24          1HB       ALA  24  -4.157 -18.114  -3.613
  188   2HB   ALA  24          2HB       ALA  24  -3.500 -18.093  -5.251
  189   3HB   ALA  24          3HB       ALA  24  -4.922 -17.125  -4.856
  190    H    THR  25           H        THR  25  -2.581 -17.606  -1.969
  191    HA   THR  25           HA       THR  25  -4.193 -16.372  -0.103
  192    HB   THR  25           HB       THR  25  -2.525 -17.172   1.575
  193    HG1  THR  25           1HG      THR  25  -1.016 -17.531  -0.748
  194   1HG2  THR  25          1HG2      THR  25  -4.039 -18.848   1.056
  195   2HG2  THR  25          2HG2      THR  25  -2.468 -19.604   0.792
  196   3HG2  THR  25          3HG2      THR  25  -3.414 -19.033  -0.582
  197    H    ALA  26           H        ALA  26  -0.891 -15.580  -1.113
  198    HA   ALA  26           HA       ALA  26  -0.492 -13.386   0.598
  199   1HB   ALA  26          1HB       ALA  26   1.277 -12.727  -0.932
  200   2HB   ALA  26          2HB       ALA  26   0.637 -13.803  -2.173
  201   3HB   ALA  26          3HB       ALA  26   1.313 -14.473  -0.688
  202    H    GLU  27           H        GLU  27  -1.554 -13.497  -2.816
  203    HA   GLU  27           HA       GLU  27  -2.093 -10.822  -3.180
  204   1HB   GLU  27          2HB       GLU  27  -2.129 -12.579  -4.944
  205   2HB   GLU  27          1HB       GLU  27  -3.672 -13.132  -4.313
  206   1HG   GLU  27          2HG       GLU  27  -3.224 -10.334  -5.299
  207   2HG   GLU  27          1HG       GLU  27  -3.754 -11.651  -6.345
  208    H    LYS  28           H        LYS  28  -4.222 -13.364  -1.918
  209    HA   LYS  28           HA       LYS  28  -6.500 -11.755  -1.549
  210   1HB   LYS  28          2HB       LYS  28  -5.622 -14.248  -0.075
  211   2HB   LYS  28          1HB       LYS  28  -7.220 -13.526   0.049
  212   1HG   LYS  28          2HG       LYS  28  -5.976 -14.674  -2.440
  213   2HG   LYS  28          1HG       LYS  28  -7.252 -15.408  -1.469
  214   1HD   LYS  28          2HD       LYS  28  -8.722 -13.521  -1.981
  215   2HD   LYS  28          1HD       LYS  28  -7.443 -12.786  -2.949
  216   1HE   LYS  28          2HE       LYS  28  -7.475 -14.713  -4.454
  217   2HE   LYS  28          1HE       LYS  28  -8.744 -15.454  -3.483
  218   1HZ   LYS  28          1HZ       LYS  28  -9.398 -12.792  -4.320
  219   2HZ   LYS  28          2HZ       LYS  28 -10.294 -14.220  -4.469
  220   3HZ   LYS  28          3HZ       LYS  28  -9.125 -13.831  -5.628
  221    H    VAL  29           H        VAL  29  -3.806 -12.584   0.599
  222    HA   VAL  29           HA       VAL  29  -4.742 -11.291   2.898
  223    HB   VAL  29           HB       VAL  29  -1.884 -11.694   1.994
  224   1HG1  VAL  29          1HG1      VAL  29  -3.061 -10.700   4.555
  225   2HG1  VAL  29          2HG1      VAL  29  -1.673 -10.096   3.652
  226   3HG1  VAL  29          3HG1      VAL  29  -1.544 -11.597   4.566
  227   1HG2  VAL  29          1HG2      VAL  29  -3.745 -13.603   2.626
  228   2HG2  VAL  29          2HG2      VAL  29  -2.923 -13.347   4.165
  229   3HG2  VAL  29          3HG2      VAL  29  -1.997 -13.802   2.735
  230    H    VAL  30           H        VAL  30  -2.950 -10.104   0.111
  231    HA   VAL  30           HA       VAL  30  -2.435  -7.505   1.112
  232    HB   VAL  30           HB       VAL  30  -2.846  -8.288  -1.781
  233   1HG1  VAL  30          1HG1      VAL  30  -1.771  -6.323  -2.372
  234   2HG1  VAL  30          2HG1      VAL  30  -1.016  -6.142  -0.790
  235   3HG1  VAL  30          3HG1      VAL  30  -2.736  -5.816  -0.986
  236   1HG2  VAL  30          1HG2      VAL  30  -0.102  -8.063  -0.785
  237   2HG2  VAL  30          2HG2      VAL  30  -0.825  -9.259  -1.861
  238   3HG2  VAL  30          3HG2      VAL  30  -1.007  -9.420  -0.114
  239    H    LYS  31           H        LYS  31  -5.054  -8.859  -0.915
  240    HA   LYS  31           HA       LYS  31  -6.559  -6.621  -1.395
  241   1HB   LYS  31          2HB       LYS  31  -7.579  -9.364  -0.633
  242   2HB   LYS  31          1HB       LYS  31  -8.565  -8.095  -1.343
  243   1HG   LYS  31          2HG       LYS  31  -6.234  -9.487  -2.623
  244   2HG   LYS  31          1HG       LYS  31  -7.938  -9.680  -3.027
  245   1HD   LYS  31          2HD       LYS  31  -6.352  -7.132  -3.296
  246   2HD   LYS  31          1HD       LYS  31  -6.771  -8.217  -4.620
  247   1HE   LYS  31          2HE       LYS  31  -9.151  -7.825  -4.167
  248   2HE   LYS  31          1HE       LYS  31  -8.714  -6.719  -2.865
  249   1HZ   LYS  31          1HZ       LYS  31  -9.263  -5.782  -5.188
  250   2HZ   LYS  31          2HZ       LYS  31  -7.692  -6.262  -5.589
  251   3HZ   LYS  31          3HZ       LYS  31  -7.943  -5.148  -4.342
  252    H    GLN  32           H        GLN  32  -6.685  -8.716   1.444
  253    HA   GLN  32           HA       GLN  32  -8.621  -7.288   2.884
  254   1HB   GLN  32          2HB       GLN  32  -7.727  -9.606   3.395
  255   2HB   GLN  32          1HB       GLN  32  -6.312  -8.824   4.087
  256   1HG   GLN  32          2HG       GLN  32  -7.853  -9.432   5.828
  257   2HG   GLN  32          1HG       GLN  32  -7.742  -7.681   5.707
  258   1HE2  GLN  32          1HE2      GLN  32  -9.534  -8.972   3.141
  259   2HE2  GLN  32          2HE2      GLN  32 -11.109  -8.690   3.783
  260    H    PHE  33           H        PHE  33  -5.147  -6.946   2.626
  261    HA   PHE  33           HA       PHE  33  -4.602  -5.134   4.648
  262   1HB   PHE  33          2HB       PHE  33  -2.978  -6.297   3.079
  263   2HB   PHE  33          1HB       PHE  33  -3.387  -5.081   1.878
  264    HD1  PHE  33           1HD      PHE  33  -2.163  -5.380   5.375
  265    HD2  PHE  33           2HD      PHE  33  -2.108  -3.173   1.727
  266    HE1  PHE  33           1HE      PHE  33  -0.426  -3.899   6.291
  267    HE2  PHE  33           2HE      PHE  33  -0.370  -1.698   2.647
  268    HZ   PHE  33           HZ       PHE  33   0.470  -2.066   4.933
  269    H    PHE  34           H        PHE  34  -5.113  -4.317   1.247
  270    HA   PHE  34           HA       PHE  34  -5.555  -1.546   1.720
  271   1HB   PHE  34          2HB       PHE  34  -6.234  -3.219  -0.702
  272   2HB   PHE  34          1HB       PHE  34  -6.201  -1.453  -0.650
  273    HD1  PHE  34           1HD      PHE  34  -3.876  -0.775   0.808
  274    HD2  PHE  34           2HD      PHE  34  -4.432  -3.977  -1.931
  275    HE1  PHE  34           1HE      PHE  34  -1.458  -0.817   0.378
  276    HE2  PHE  34           2HE      PHE  34  -2.014  -4.019  -2.378
  277    HZ   PHE  34           HZ       PHE  34  -0.532  -2.438  -1.209
  278    H    ASN  35           H        ASN  35  -7.693  -4.296   1.279
  279    HA   ASN  35           HA       ASN  35 -10.151  -3.061   1.053
  280   1HB   ASN  35          2HB       ASN  35  -9.800  -5.499   0.943
  281   2HB   ASN  35          1HB       ASN  35  -9.454  -5.526   2.669
  282   1HD2  ASN  35          1HD2      ASN  35 -11.627  -6.488   0.668
  283   2HD2  ASN  35          2HD2      ASN  35 -13.091  -6.187   1.536
  284    H    ASP  36           H        ASP  36  -8.178  -3.652   3.868
  285    HA   ASP  36           HA       ASP  36 -10.109  -2.363   5.638
  286   1HB   ASP  36          2HB       ASP  36  -7.525  -3.811   6.229
  287   2HB   ASP  36          1HB       ASP  36  -8.546  -3.071   7.459
  288    H    ASN  37           H        ASN  37  -7.113  -1.617   4.034
  289    HA   ASN  37           HA       ASN  37  -6.467   0.563   5.825
  290   1HB   ASN  37          2HB       ASN  37  -5.341  -0.161   3.108
  291   2HB   ASN  37          1HB       ASN  37  -4.738   1.143   4.120
  292   1HD2  ASN  37          1HD2      ASN  37  -3.669  -1.530   3.090
  293   2HD2  ASN  37          2HD2      ASN  37  -2.982  -2.250   4.503
  294    H    GLY  38           H        GLY  38  -7.723   0.168   2.566
  295   1HA   GLY  38          2HA       GLY  38  -8.129   2.202   1.193
  296   2HA   GLY  38          1HA       GLY  38  -9.598   1.485   1.816
  297    H    VAL  39           H        VAL  39 -10.975   2.837   2.674
  298    HA   VAL  39           HA       VAL  39 -10.037   5.511   3.426
  299    HB   VAL  39           HB       VAL  39 -12.839   4.598   2.852
  300   1HG1  VAL  39          1HG1      VAL  39 -12.994   7.147   2.321
  301   2HG1  VAL  39          2HG1      VAL  39 -11.582   7.256   3.373
  302   3HG1  VAL  39          3HG1      VAL  39 -13.092   6.586   3.990
  303   1HG2  VAL  39          1HG2      VAL  39 -10.864   5.934   1.007
  304   2HG2  VAL  39          2HG2      VAL  39 -12.549   5.572   0.632
  305   3HG2  VAL  39          3HG2      VAL  39 -11.404   4.258   0.906
  306    H    ASP  40           H        ASP  40 -10.836   2.745   5.181
  307    HA   ASP  40           HA       ASP  40 -11.858   4.439   7.355
  308   1HB   ASP  40          2HB       ASP  40 -12.661   1.597   6.715
  309   2HB   ASP  40          1HB       ASP  40 -13.163   2.490   8.148
  310    H    GLY  41           H        GLY  41  -9.122   3.174   6.509
  311   1HA   GLY  41          2HA       GLY  41  -8.523   1.391   8.685
  312   2HA   GLY  41          1HA       GLY  41  -7.376   2.052   7.533
  313    H    GLU  42           H        GLU  42  -6.652   1.774  10.131
  314    HA   GLU  42           HA       GLU  42  -6.923   4.393  11.408
  315   1HB   GLU  42          2HB       GLU  42  -5.556   1.881  12.402
  316   2HB   GLU  42          1HB       GLU  42  -5.786   3.357  13.328
  317   1HG   GLU  42          2HG       GLU  42  -7.440   1.873  14.069
  318   2HG   GLU  42          1HG       GLU  42  -8.266   3.020  13.017
  319    H    TRP  43           H        TRP  43  -5.610   5.811  10.370
  320    HA   TRP  43           HA       TRP  43  -2.880   4.994   9.715
  321   1HB   TRP  43          2HB       TRP  43  -4.412   7.484   8.964
  322   2HB   TRP  43          1HB       TRP  43  -2.803   7.062   8.393
  323    HD1  TRP  43           HD       TRP  43  -5.647   4.467   8.525
  324    HE1  TRP  43           1HE      TRP  43  -6.203   3.770   6.109
  325    HE3  TRP  43           3HE      TRP  43  -2.704   7.805   6.025
  326    HZ2  TRP  43           2HZ      TRP  43  -5.488   4.536   3.497
  327    HZ3  TRP  43           3HZ      TRP  43  -2.696   7.759   3.568
  328    HH2  TRP  43           HH       TRP  43  -4.059   6.158   2.329
  329    H    THR  44           H        THR  44  -1.239   5.506  10.997
  330    HA   THR  44           HA       THR  44  -1.553   7.714  12.904
  331    HB   THR  44           HB       THR  44   0.426   6.711  14.041
  332    HG1  THR  44           1HG      THR  44   0.092   4.584  12.205
  333   1HG2  THR  44          1HG2      THR  44  -0.740   5.162  15.199
  334   2HG2  THR  44          2HG2      THR  44  -1.390   4.400  13.748
  335   3HG2  THR  44          3HG2      THR  44  -2.083   5.911  14.337
  336    H    TYR  45           H        TYR  45  -0.287   9.512  12.763
  337    HA   TYR  45           HA       TYR  45   1.591   9.611  10.502
  338   1HB   TYR  45          2HB       TYR  45  -0.368  11.142  10.433
  339   2HB   TYR  45          1HB       TYR  45   0.206  11.899  11.914
  340    HD1  TYR  45           1HD      TYR  45   2.590  10.834   9.341
  341    HD2  TYR  45           2HD      TYR  45   0.294  14.082  10.854
  342    HE1  TYR  45           1HE      TYR  45   3.935  12.400   8.004
  343    HE2  TYR  45           2HE      TYR  45   1.632  15.656   9.521
  344    HH   TYR  45           HH       TYR  45   3.378  15.904   8.154
  345    H    ASP  46           H        ASP  46   3.682  10.233  10.767
  346    HA   ASP  46           HA       ASP  46   4.538  10.959  13.490
  347   1HB   ASP  46          2HB       ASP  46   5.198   8.646  12.962
  348   2HB   ASP  46          1HB       ASP  46   6.027   9.213  11.514
  349    H    ASP  47           H        ASP  47   4.363  13.164  12.807
  350    HA   ASP  47           HA       ASP  47   5.463  14.405  10.638
  351   1HB   ASP  47          2HB       ASP  47   5.565  15.483  13.463
  352   2HB   ASP  47          1HB       ASP  47   5.607  16.428  11.979
  353    H    ALA  48           H        ALA  48   7.138  13.283  13.514
  354    HA   ALA  48           HA       ALA  48   9.571  14.535  13.280
  355   1HB   ALA  48          1HB       ALA  48  10.470  12.858  14.657
  356   2HB   ALA  48          2HB       ALA  48   9.335  11.647  14.061
  357   3HB   ALA  48          3HB       ALA  48   8.765  12.957  15.095
  358    H    THR  49           H        THR  49   8.351  11.848  11.374
  359    HA   THR  49           HA       THR  49  10.864  11.916   9.834
  360    HB   THR  49           HB       THR  49  10.503   9.533   9.307
  361    HG1  THR  49           1HG      THR  49   8.185   9.628   9.710
  362   1HG2  THR  49          1HG2      THR  49  11.930  10.019  11.197
  363   2HG2  THR  49          2HG2      THR  49  10.974   8.568  11.501
  364   3HG2  THR  49          3HG2      THR  49  10.525  10.095  12.262
  365    H    LYS  50           H        LYS  50   7.934  13.086   9.591
  366    HA   LYS  50           HA       LYS  50   6.448  13.532   7.895
  367   1HB   LYS  50          2HB       LYS  50   9.008  13.129   6.344
  368   2HB   LYS  50          1HB       LYS  50   7.531  13.762   5.630
  369   1HG   LYS  50          2HG       LYS  50   8.575  15.101   8.060
  370   2HG   LYS  50          1HG       LYS  50   9.442  15.338   6.543
  371   1HD   LYS  50          2HD       LYS  50   7.753  17.081   6.927
  372   2HD   LYS  50          1HD       LYS  50   7.422  16.137   5.476
  373   1HE   LYS  50          2HE       LYS  50   5.385  16.559   6.741
  374   2HE   LYS  50          1HE       LYS  50   5.759  14.838   6.688
  375   1HZ   LYS  50          1HZ       LYS  50   5.135  15.325   8.891
  376   2HZ   LYS  50          2HZ       LYS  50   6.113  16.702   8.963
  377   3HZ   LYS  50          3HZ       LYS  50   6.820  15.166   8.929
  378    H    THR  51           H        THR  51   6.507  10.801   8.760
  379    HA   THR  51           HA       THR  51   5.813   9.433   6.243
  380    HB   THR  51           HB       THR  51   7.058   8.281   8.742
  381    HG1  THR  51           1HG      THR  51   8.467   9.390   7.283
  382   1HG2  THR  51          1HG2      THR  51   7.161   6.469   6.579
  383   2HG2  THR  51          2HG2      THR  51   5.480   6.945   6.814
  384   3HG2  THR  51          3HG2      THR  51   6.399   6.263   8.155
  385    H    PHE  52           H        PHE  52   3.954   8.194   6.187
  386    HA   PHE  52           HA       PHE  52   2.193   8.481   8.536
  387   1HB   PHE  52          2HB       PHE  52   1.422   8.110   5.643
  388   2HB   PHE  52          1HB       PHE  52   0.306   8.241   6.994
  389    HD1  PHE  52           1HD      PHE  52  -0.053  10.378   8.107
  390    HD2  PHE  52           2HD      PHE  52   2.533  10.039   4.745
  391    HE1  PHE  52           1HE      PHE  52  -0.116  12.820   7.816
  392    HE2  PHE  52           2HE      PHE  52   2.476  12.481   4.451
  393    HZ   PHE  52           HZ       PHE  52   1.150  13.874   5.987
  394    H    THR  53           H        THR  53   2.673   6.660   9.594
  395    HA   THR  53           HA       THR  53   2.790   4.074   8.373
  396    HB   THR  53           HB       THR  53   2.531   3.297  10.847
  397    HG1  THR  53           1HG      THR  53   2.252   4.828  12.211
  398   1HG2  THR  53          1HG2      THR  53   4.650   2.934  10.213
  399   2HG2  THR  53          2HG2      THR  53   4.955   4.322  11.264
  400   3HG2  THR  53          3HG2      THR  53   4.837   4.548   9.518
  401    H    VAL  54           H        VAL  54   1.253   2.704   7.889
  402    HA   VAL  54           HA       VAL  54  -1.473   3.235   8.872
  403    HB   VAL  54           HB       VAL  54  -0.638   1.866   6.299
  404   1HG1  VAL  54          1HG1      VAL  54  -3.220   2.114   7.714
  405   2HG1  VAL  54          2HG1      VAL  54  -2.650   0.875   6.596
  406   3HG1  VAL  54          3HG1      VAL  54  -3.249   2.412   5.975
  407   1HG2  VAL  54          1HG2      VAL  54  -1.952   3.937   5.397
  408   2HG2  VAL  54          2HG2      VAL  54  -0.257   4.090   5.855
  409   3HG2  VAL  54          3HG2      VAL  54  -1.520   4.640   6.956
  410    H    THR  55           H        THR  55  -1.980   1.869  10.451
  411    HA   THR  55           HA       THR  55  -0.912  -0.860  10.365
  412    HB   THR  55           HB       THR  55  -2.198   0.571  12.692
  413    HG1  THR  55           1HG      THR  55  -0.311   1.378  13.092
  414   1HG2  THR  55          1HG2      THR  55  -0.669  -2.009  12.505
  415   2HG2  THR  55          2HG2      THR  55  -2.331  -1.774  13.051
  416   3HG2  THR  55          3HG2      THR  55  -0.991  -1.162  14.019
  417    H    GLU  56           H        GLU  56  -2.192  -2.430   9.666
  418    HA   GLU  56           HA       GLU  56  -5.005  -1.982   9.304
  419   1HB   GLU  56          2HB       GLU  56  -5.052  -4.179   8.305
  420   2HB   GLU  56          1HB       GLU  56  -3.639  -3.316   7.721
  421   1HG   GLU  56          2HG       GLU  56  -2.645  -5.287   8.162
  422   2HG   GLU  56          1HG       GLU  56  -2.518  -4.589   9.774
  423   1H    MET   1          1HT       MET   1   5.122  18.407  -2.155
  424   2H    MET   1          2HT       MET   1   5.769  19.832  -1.518
  425   3H    MET   1          3HT       MET   1   4.705  18.899  -0.591
  426    HA   MET   1           HA       MET   1   7.522  18.405  -1.256
  427   1HB   MET   1          2HB       MET   1   6.809  19.492   0.869
  428   2HB   MET   1          1HB       MET   1   5.886  18.051   1.267
  429   1HG   MET   1          2HG       MET   1   7.872  16.738   1.426
  430   2HG   MET   1          1HG       MET   1   8.857  18.064   0.809
  431   1HE   MET   1          1HE       MET   1   5.926  18.594   3.551
  432   2HE   MET   1          2HE       MET   1   6.815  17.954   4.933
  433   3HE   MET   1          3HE       MET   1   6.452  16.911   3.557
  434    H    GLN   2           H        GLN   2   8.321  16.238  -0.424
  435    HA   GLN   2           HA       GLN   2   6.574  14.138  -1.481
  436   1HB   GLN   2          2HB       GLN   2   8.804  14.306  -2.487
  437   2HB   GLN   2          1HB       GLN   2   9.543  14.116  -0.903
  438   1HG   GLN   2          2HG       GLN   2   8.606  11.870  -0.730
  439   2HG   GLN   2          1HG       GLN   2   7.856  12.060  -2.311
  440   1HE2  GLN   2          1HE2      GLN   2  10.740  13.639  -2.508
  441   2HE2  GLN   2          2HE2      GLN   2  11.722  12.362  -3.123
  442    H    TYR   3           H        TYR   3   5.870  12.461  -0.240
  443    HA   TYR   3           HA       TYR   3   6.798  12.390   2.554
  444   1HB   TYR   3          2HB       TYR   3   3.952  12.049   1.590
  445   2HB   TYR   3          1HB       TYR   3   4.496  11.874   3.255
  446    HD1  TYR   3           1HD      TYR   3   4.425  13.713   4.672
  447    HD2  TYR   3           2HD      TYR   3   4.438  14.351   0.467
  448    HE1  TYR   3           1HE      TYR   3   4.073  16.119   5.043
  449    HE2  TYR   3           2HE      TYR   3   4.087  16.760   0.826
  450    HH   TYR   3           HH       TYR   3   4.281  18.430   2.457
  451    H    LYS   4           H        LYS   4   6.999  10.398   3.505
  452    HA   LYS   4           HA       LYS   4   6.777   8.101   1.677
  453   1HB   LYS   4          2HB       LYS   4   9.062   8.636   2.465
  454   2HB   LYS   4          1HB       LYS   4   8.522   8.427   4.126
  455   1HG   LYS   4          2HG       LYS   4   8.020   6.082   3.672
  456   2HG   LYS   4          1HG       LYS   4   8.555   6.291   2.004
  457   1HD   LYS   4          2HD       LYS   4  10.795   6.904   2.819
  458   2HD   LYS   4          1HD       LYS   4  10.250   6.640   4.478
  459   1HE   LYS   4          2HE       LYS   4  11.473   4.705   3.654
  460   2HE   LYS   4          1HE       LYS   4   9.783   4.297   3.946
  461   1HZ   LYS   4          1HZ       LYS   4  10.957   4.931   1.293
  462   2HZ   LYS   4          2HZ       LYS   4   9.351   4.490   1.588
  463   3HZ   LYS   4          3HZ       LYS   4  10.596   3.377   1.856
  464    H    VAL   5           H        VAL   5   4.963   6.997   2.059
  465    HA   VAL   5           HA       VAL   5   3.901   6.871   4.773
  466    HB   VAL   5           HB       VAL   5   2.677   5.895   2.188
  467   1HG1  VAL   5          1HG1      VAL   5   1.136   6.421   4.687
  468   2HG1  VAL   5          2HG1      VAL   5   1.984   4.888   4.498
  469   3HG1  VAL   5          3HG1      VAL   5   0.750   5.362   3.331
  470   1HG2  VAL   5          1HG2      VAL   5   1.146   7.978   3.014
  471   2HG2  VAL   5          2HG2      VAL   5   2.435   8.096   1.816
  472   3HG2  VAL   5          3HG2      VAL   5   2.754   8.517   3.499
  473    H    ILE   6           H        ILE   6   3.767   5.055   5.965
  474    HA   ILE   6           HA       ILE   6   5.041   2.645   4.854
  475    HB   ILE   6           HB       ILE   6   4.838   3.574   7.722
  476   1HG1  ILE   6          2HG1      ILE   6   7.234   3.090   5.940
  477   2HG1  ILE   6          1HG1      ILE   6   6.560   4.669   6.317
  478   1HG2  ILE   6          1HG2      ILE   6   6.270   1.548   8.187
  479   2HG2  ILE   6          2HG2      ILE   6   5.827   0.971   6.581
  480   3HG2  ILE   6          3HG2      ILE   6   4.581   1.220   7.803
  481   1HD1  ILE   6          1HD1      ILE   6   7.102   4.352   8.666
  482   2HD1  ILE   6          2HD1      ILE   6   8.536   4.181   7.654
  483   3HD1  ILE   6          3HD1      ILE   6   7.743   2.748   8.306
  484    H    LEU   7           H        LEU   7   3.836   0.909   4.576
  485    HA   LEU   7           HA       LEU   7   1.138   0.887   5.729
  486   1HB   LEU   7          2HB       LEU   7   2.105  -0.958   3.564
  487   2HB   LEU   7          1HB       LEU   7   0.466  -0.451   3.923
  488    HG   LEU   7           HG       LEU   7   2.627   1.206   2.640
  489   1HD1  LEU   7          1HD1      LEU   7  -0.063   0.348   1.594
  490   2HD1  LEU   7          2HD1      LEU   7   1.455  -0.472   1.230
  491   3HD1  LEU   7          3HD1      LEU   7   1.210   1.197   0.714
  492   1HD2  LEU   7          1HD2      LEU   7   1.248   2.496   4.263
  493   2HD2  LEU   7          2HD2      LEU   7  -0.181   2.053   3.332
  494   3HD2  LEU   7          3HD2      LEU   7   1.084   3.035   2.592
  495    H    ASN   8           H        ASN   8   1.892   0.205   7.789
  496    HA   ASN   8           HA       ASN   8   3.173  -2.394   8.005
  497   1HB   ASN   8          2HB       ASN   8   3.831  -0.406   9.400
  498   2HB   ASN   8          1HB       ASN   8   2.270  -0.530  10.206
  499   1HD2  ASN   8          1HD2      ASN   8   5.350  -1.111  10.670
  500   2HD2  ASN   8          2HD2      ASN   8   5.289  -2.532  11.652
  501    H    GLY   9           H        GLY   9   1.870  -4.122   7.815
  502   1HA   GLY   9          2HA       GLY   9  -0.725  -4.027   9.224
  503   2HA   GLY   9          1HA       GLY   9  -0.454  -4.950   7.754
  504    H    LYS  10           H        LYS  10  -1.415  -6.636   9.230
  505    HA   LYS  10           HA       LYS  10   0.341  -7.684  11.258
  506   1HB   LYS  10          2HB       LYS  10  -2.237  -8.725  10.077
  507   2HB   LYS  10          1HB       LYS  10  -1.349  -9.551  11.349
  508   1HG   LYS  10          2HG       LYS  10  -1.628  -7.598  12.803
  509   2HG   LYS  10          1HG       LYS  10  -2.541  -6.792  11.525
  510   1HD   LYS  10          2HD       LYS  10  -4.255  -8.491  11.621
  511   2HD   LYS  10          1HD       LYS  10  -3.314  -9.419  12.791
  512   1HE   LYS  10          2HE       LYS  10  -5.097  -8.180  13.894
  513   2HE   LYS  10          1HE       LYS  10  -3.515  -7.597  14.404
  514   1HZ   LYS  10          1HZ       LYS  10  -4.172  -5.577  13.826
  515   2HZ   LYS  10          2HZ       LYS  10  -5.625  -6.164  13.187
  516   3HZ   LYS  10          3HZ       LYS  10  -4.248  -6.072  12.210
  517    H    THR  11           H        THR  11  -0.889  -8.848   8.125
  518    HA   THR  11           HA       THR  11   1.313 -10.771   7.999
  519    HB   THR  11           HB       THR  11  -0.101 -11.682   6.072
  520    HG1  THR  11           1HG      THR  11  -2.126 -10.130   7.283
  521   1HG2  THR  11          1HG2      THR  11  -0.690 -11.861   8.934
  522   2HG2  THR  11          2HG2      THR  11  -0.445 -13.134   7.738
  523   3HG2  THR  11          3HG2      THR  11  -2.011 -12.334   7.867
  524    H    LEU  12           H        LEU  12   0.708  -7.700   7.047
  525    HA   LEU  12           HA       LEU  12   2.447  -7.993   4.714
  526   1HB   LEU  12          2HB       LEU  12   0.167  -7.841   3.879
  527   2HB   LEU  12          1HB       LEU  12  -0.092  -6.371   4.797
  528    HG   LEU  12           HG       LEU  12   1.424  -5.149   3.412
  529   1HD1  LEU  12          1HD1      LEU  12   2.162  -6.820   1.342
  530   2HD1  LEU  12          2HD1      LEU  12   2.392  -7.802   2.786
  531   3HD1  LEU  12          3HD1      LEU  12   3.201  -6.248   2.649
  532   1HD2  LEU  12          1HD2      LEU  12   0.168  -6.533   1.192
  533   2HD2  LEU  12          2HD2      LEU  12  -0.067  -4.887   1.780
  534   3HD2  LEU  12          3HD2      LEU  12  -0.952  -6.223   2.518
  535    H    LYS  13           H        LYS  13   3.965  -6.465   4.471
  536    HA   LYS  13           HA       LYS  13   3.823  -3.993   6.026
  537   1HB   LYS  13          2HB       LYS  13   6.298  -5.727   6.083
  538   2HB   LYS  13          1HB       LYS  13   6.014  -4.243   6.977
  539   1HG   LYS  13          2HG       LYS  13   5.722  -5.847   8.594
  540   2HG   LYS  13          1HG       LYS  13   4.066  -5.568   8.055
  541   1HD   LYS  13          2HD       LYS  13   4.084  -7.546   6.731
  542   2HD   LYS  13          1HD       LYS  13   5.818  -7.756   6.958
  543   1HE   LYS  13          2HE       LYS  13   4.484  -9.289   8.351
  544   2HE   LYS  13          1HE       LYS  13   5.493  -8.206   9.308
  545   1HZ   LYS  13          1HZ       LYS  13   2.938  -8.608   9.821
  546   2HZ   LYS  13          2HZ       LYS  13   2.779  -7.310   8.748
  547   3HZ   LYS  13          3HZ       LYS  13   3.710  -7.138  10.151
  548    H    GLY  14           H        GLY  14   4.978  -2.274   5.082
  549   1HA   GLY  14          2HA       GLY  14   6.871  -2.660   2.998
  550   2HA   GLY  14          1HA       GLY  14   5.290  -2.310   2.325
  551    H    GLU  15           H        GLU  15   6.875  -0.555   1.521
  552    HA   GLU  15           HA       GLU  15   6.370   1.822   3.150
  553   1HB   GLU  15          2HB       GLU  15   9.052   1.167   1.909
  554   2HB   GLU  15          1HB       GLU  15   8.642   2.669   2.726
  555   1HG   GLU  15          2HG       GLU  15   8.322   1.472   4.813
  556   2HG   GLU  15          1HG       GLU  15   8.670  -0.055   4.005
  557    H    THR  16           H        THR  16   5.734   3.547   1.980
  558    HA   THR  16           HA       THR  16   6.123   3.502  -0.921
  559    HB   THR  16           HB       THR  16   3.975   2.648  -0.882
  560    HG1  THR  16           1HG      THR  16   3.452   5.404  -0.716
  561   1HG2  THR  16          1HG2      THR  16   2.164   3.577   0.608
  562   2HG2  THR  16          2HG2      THR  16   3.455   4.346   1.527
  563   3HG2  THR  16          3HG2      THR  16   3.399   2.591   1.388
  564    H    THR  17           H        THR  17   5.479   5.648  -1.932
  565    HA   THR  17           HA       THR  17   5.753   7.902  -0.092
  566    HB   THR  17           HB       THR  17   7.537   8.894  -1.526
  567    HG1  THR  17           1HG      THR  17   8.643   7.474  -2.917
  568   1HG2  THR  17          1HG2      THR  17   9.375   7.314  -0.820
  569   2HG2  THR  17          2HG2      THR  17   8.105   6.307  -0.125
  570   3HG2  THR  17          3HG2      THR  17   8.347   7.953   0.463
  571    H    THR  18           H        THR  18   4.260   9.344  -0.547
  572    HA   THR  18           HA       THR  18   3.274   9.617  -3.323
  573    HB   THR  18           HB       THR  18   1.594   8.973  -1.594
  574    HG1  THR  18           1HG      THR  18   1.036  10.246  -3.447
  575   1HG2  THR  18          1HG2      THR  18   2.377  11.595  -0.375
  576   2HG2  THR  18          2HG2      THR  18   2.226  10.016   0.395
  577   3HG2  THR  18          3HG2      THR  18   0.783  10.882  -0.129
  578    H    GLU  19           H        GLU  19   3.110  11.684  -4.240
  579    HA   GLU  19           HA       GLU  19   4.715  13.753  -2.889
  580   1HB   GLU  19          2HB       GLU  19   5.603  13.018  -5.042
  581   2HB   GLU  19          1HB       GLU  19   4.069  13.374  -5.820
  582   1HG   GLU  19          2HG       GLU  19   5.686  15.108  -6.285
  583   2HG   GLU  19          1HG       GLU  19   4.359  15.745  -5.315
  584    H    ALA  20           H        ALA  20   3.577  15.363  -1.978
  585    HA   ALA  20           HA       ALA  20   1.330  16.504  -3.432
  586   1HB   ALA  20          1HB       ALA  20   0.928  15.768  -0.553
  587   2HB   ALA  20          2HB       ALA  20   0.507  14.667  -1.865
  588   3HB   ALA  20          3HB       ALA  20  -0.273  16.244  -1.752
  589    H    VAL  21           H        VAL  21   0.789  18.591  -2.829
  590    HA   VAL  21           HA       VAL  21   2.815  20.331  -2.200
  591    HB   VAL  21           HB       VAL  21  -0.091  20.858  -1.587
  592   1HG1  VAL  21          1HG1      VAL  21   1.619  22.515  -0.801
  593   2HG1  VAL  21          2HG1      VAL  21   0.417  23.157  -1.920
  594   3HG1  VAL  21          3HG1      VAL  21   2.042  22.781  -2.493
  595   1HG2  VAL  21          1HG2      VAL  21   0.033  21.849  -3.984
  596   2HG2  VAL  21          2HG2      VAL  21  -0.210  20.114  -3.771
  597   3HG2  VAL  21          3HG2      VAL  21   1.388  20.736  -4.182
  598    H    ASP  22           H        ASP  22   0.794  18.564   0.007
  599    HA   ASP  22           HA       ASP  22   2.469  19.410   2.212
  600   1HB   ASP  22          2HB       ASP  22   0.673  20.211   3.639
  601   2HB   ASP  22          1HB       ASP  22   0.736  21.166   2.163
  602    H    ALA  23           H        ALA  23   1.584  18.341   4.341
  603    HA   ALA  23           HA       ALA  23   1.693  15.577   3.954
  604   1HB   ALA  23          1HB       ALA  23   1.305  17.383   6.238
  605   2HB   ALA  23          2HB       ALA  23   2.365  15.984   6.062
  606   3HB   ALA  23          3HB       ALA  23   0.659  15.755   6.448
  607    H    ALA  24           H        ALA  24  -1.071  17.690   4.583
  608    HA   ALA  24           HA       ALA  24  -2.989  15.631   4.815
  609   1HB   ALA  24          1HB       ALA  24  -3.767  18.262   3.646
  610   2HB   ALA  24          2HB       ALA  24  -3.136  18.227   5.292
  611   3HB   ALA  24          3HB       ALA  24  -4.573  17.293   4.879
  612    H    THR  25           H        THR  25  -2.181  17.716   2.024
  613    HA   THR  25           HA       THR  25  -3.794  16.521   0.135
  614    HB   THR  25           HB       THR  25  -2.083  17.279  -1.519
  615    HG1  THR  25           1HG      THR  25  -0.599  17.603   0.826
  616   1HG2  THR  25          1HG2      THR  25  -3.563  18.993  -1.022
  617   2HG2  THR  25          2HG2      THR  25  -1.977  19.710  -0.735
  618   3HG2  THR  25          3HG2      THR  25  -2.958  19.162   0.626
  619    H    ALA  26           H        ALA  26  -0.528  15.649   1.192
  620    HA   ALA  26           HA       ALA  26  -0.159  13.444  -0.513
  621   1HB   ALA  26          1HB       ALA  26   1.573  12.743   1.041
  622   2HB   ALA  26          2HB       ALA  26   0.943  13.838   2.272
  623   3HB   ALA  26          3HB       ALA  26   1.655  14.489   0.796
  624    H    GLU  27           H        GLU  27  -1.266  13.584   2.886
  625    HA   GLU  27           HA       GLU  27  -1.874  10.923   3.244
  626   1HB   GLU  27          2HB       GLU  27  -1.890  12.679   5.009
  627   2HB   GLU  27          1HB       GLU  27  -3.409  13.271   4.356
  628   1HG   GLU  27          2HG       GLU  27  -3.046  10.463   5.346
  629   2HG   GLU  27          1HG       GLU  27  -3.561  11.792   6.384
  630    H    LYS  28           H        LYS  28  -3.922  13.515   1.951
  631    HA   LYS  28           HA       LYS  28  -6.233  11.961   1.550
  632   1HB   LYS  28          2HB       LYS  28  -5.276  14.430   0.086
  633   2HB   LYS  28          1HB       LYS  28  -6.889  13.745  -0.059
  634   1HG   LYS  28          2HG       LYS  28  -5.653  14.870   2.445
  635   2HG   LYS  28          1HG       LYS  28  -6.899  15.630   1.455
  636   1HD   LYS  28          2HD       LYS  28  -8.420  13.781   1.948
  637   2HD   LYS  28          1HD       LYS  28  -7.172  13.016   2.934
  638   1HE   LYS  28          2HE       LYS  28  -7.177  14.943   4.438
  639   2HE   LYS  28          1HE       LYS  28  -8.415  15.716   3.450
  640   1HZ   LYS  28          1HZ       LYS  28  -9.146  13.070   4.278
  641   2HZ   LYS  28          2HZ       LYS  28 -10.007  14.520   4.413
  642   3HZ   LYS  28          3HZ       LYS  28  -8.866  14.103   5.590
  643    H    VAL  29           H        VAL  29  -3.495  12.728  -0.563
  644    HA   VAL  29           HA       VAL  29  -4.427  11.455  -2.875
  645    HB   VAL  29           HB       VAL  29  -1.572  11.787  -1.928
  646   1HG1  VAL  29          1HG1      VAL  29  -2.736  10.823  -4.506
  647   2HG1  VAL  29          2HG1      VAL  29  -1.376  10.185  -3.582
  648   3HG1  VAL  29          3HG1      VAL  29  -1.197  11.683  -4.495
  649   1HG2  VAL  29          1HG2      VAL  29  -3.377  13.743  -2.587
  650   2HG2  VAL  29          2HG2      VAL  29  -2.540  13.465  -4.114
  651   3HG2  VAL  29          3HG2      VAL  29  -1.623  13.898  -2.671
  652    H    VAL  30           H        VAL  30  -2.701  10.225  -0.064
  653    HA   VAL  30           HA       VAL  30  -2.236   7.614  -1.055
  654    HB   VAL  30           HB       VAL  30  -2.669   8.409   1.832
  655   1HG1  VAL  30          1HG1      VAL  30  -1.651   6.420   2.440
  656   2HG1  VAL  30          2HG1      VAL  30  -0.878   6.218   0.867
  657   3HG1  VAL  30          3HG1      VAL  30  -2.610   5.935   1.040
  658   1HG2  VAL  30          1HG2      VAL  30   0.081   8.116   0.873
  659   2HG2  VAL  30          2HG2      VAL  30  -0.626   9.329   1.939
  660   3HG2  VAL  30          3HG2      VAL  30  -0.781   9.494   0.190
  661    H    LYS  31           H        LYS  31  -4.849   9.033   0.933
  662    HA   LYS  31           HA       LYS  31  -6.417   6.832   1.393
  663   1HB   LYS  31          2HB       LYS  31  -7.356   9.599   0.616
  664   2HB   LYS  31          1HB       LYS  31  -8.385   8.356   1.311
  665   1HG   LYS  31          2HG       LYS  31  -6.039   9.691   2.626
  666   2HG   LYS  31          1HG       LYS  31  -7.744   9.924   3.006
  667   1HD   LYS  31          2HD       LYS  31  -6.221   7.340   3.297
  668   2HD   LYS  31          1HD       LYS  31  -6.635   8.434   4.614
  669   1HE   LYS  31          2HE       LYS  31  -9.016   8.099   4.127
  670   2HE   LYS  31          1HE       LYS  31  -8.587   6.983   2.832
  671   1HZ   LYS  31          1HZ       LYS  31  -9.192   6.062   5.148
  672   2HZ   LYS  31          2HZ       LYS  31  -7.616   6.502   5.569
  673   3HZ   LYS  31          3HZ       LYS  31  -7.877   5.393   4.320
  674    H    GLN  32           H        GLN  32  -6.451   8.926  -1.448
  675    HA   GLN  32           HA       GLN  32  -8.400   7.547  -2.915
  676   1HB   GLN  32          2HB       GLN  32  -7.441   9.841  -3.413
  677   2HB   GLN  32          1HB       GLN  32  -6.037   9.024  -4.085
  678   1HG   GLN  32          2HG       GLN  32  -7.538   9.672  -5.847
  679   2HG   GLN  32          1HG       GLN  32  -7.471   7.918  -5.726
  680   1HE2  GLN  32          1HE2      GLN  32  -9.267   9.251  -3.186
  681   2HE2  GLN  32          2HE2      GLN  32 -10.840   9.010  -3.850
  682    H    PHE  33           H        PHE  33  -4.941   7.121  -2.611
  683    HA   PHE  33           HA       PHE  33  -4.411   5.294  -4.624
  684   1HB   PHE  33          2HB       PHE  33  -2.782   6.418  -3.034
  685   2HB   PHE  33          1HB       PHE  33  -3.237   5.214  -1.837
  686    HD1  PHE  33           1HD      PHE  33  -1.955   5.481  -5.317
  687    HD2  PHE  33           2HD      PHE  33  -2.005   3.275  -1.668
  688    HE1  PHE  33           1HE      PHE  33  -0.240   3.958  -6.206
  689    HE2  PHE  33           2HE      PHE  33  -0.291   1.759  -2.563
  690    HZ   PHE  33           HZ       PHE  33   0.592   2.106  -4.836
  691    H    PHE  34           H        PHE  34  -4.989   4.491  -1.230
  692    HA   PHE  34           HA       PHE  34  -5.492   1.731  -1.708
  693   1HB   PHE  34          2HB       PHE  34  -6.163   3.422   0.704
  694   2HB   PHE  34          1HB       PHE  34  -6.171   1.656   0.653
  695    HD1  PHE  34           1HD      PHE  34  -3.843   0.921  -0.773
  696    HD2  PHE  34           2HD      PHE  34  -4.361   4.135   1.959
  697    HE1  PHE  34           1HE      PHE  34  -1.431   0.907  -0.309
  698    HE2  PHE  34           2HE      PHE  34  -1.948   4.121   2.439
  699    HZ   PHE  34           HZ       PHE  34  -0.489   2.504   1.292
  700    H    ASN  35           H        ASN  35  -7.565   4.534  -1.299
  701    HA   ASN  35           HA       ASN  35 -10.058   3.358  -1.109
  702   1HB   ASN  35          2HB       ASN  35  -9.649   5.789  -0.993
  703   2HB   ASN  35          1HB       ASN  35  -9.280   5.806  -2.713
  704   1HD2  ASN  35          1HD2      ASN  35 -11.454   6.826  -0.749
  705   2HD2  ASN  35          2HD2      ASN  35 -12.913   6.559  -1.633
  706    H    ASP  36           H        ASP  36  -8.030   3.902  -3.895
  707    HA   ASP  36           HA       ASP  36  -9.968   2.662  -5.692
  708   1HB   ASP  36          2HB       ASP  36  -7.342   4.047  -6.247
  709   2HB   ASP  36          1HB       ASP  36  -8.364   3.331  -7.489
  710    H    ASN  37           H        ASN  37  -7.016   1.841  -4.043
  711    HA   ASN  37           HA       ASN  37  -6.396  -0.354  -5.826
  712   1HB   ASN  37          2HB       ASN  37  -5.293   0.344  -3.093
  713   2HB   ASN  37          1HB       ASN  37  -4.707  -0.976  -4.097
  714   1HD2  ASN  37          1HD2      ASN  37  -3.586   1.672  -3.054
  715   2HD2  ASN  37          2HD2      ASN  37  -2.862   2.373  -4.459
  716    H    GLY  38           H        GLY  38  -7.688   0.073  -2.584
  717   1HA   GLY  38          2HA       GLY  38  -8.160  -1.949  -1.217
  718   2HA   GLY  38          1HA       GLY  38  -9.605  -1.198  -1.859
  719    H    VAL  39           H        VAL  39 -11.001  -2.514  -2.739
  720    HA   VAL  39           HA       VAL  39 -10.116  -5.210  -3.479
  721    HB   VAL  39           HB       VAL  39 -12.905  -4.232  -2.948
  722   1HG1  VAL  39          1HG1      VAL  39 -13.127  -6.778  -2.423
  723   2HG1  VAL  39          2HG1      VAL  39 -11.702  -6.918  -3.454
  724   3HG1  VAL  39          3HG1      VAL  39 -13.186  -6.212  -4.093
  725   1HG2  VAL  39          1HG2      VAL  39 -10.994  -5.616  -1.072
  726   2HG2  VAL  39          2HG2      VAL  39 -12.675  -5.211  -0.727
  727   3HG2  VAL  39          3HG2      VAL  39 -11.493  -3.927  -0.980
  728    H    ASP  40           H        ASP  40 -10.828  -2.424  -5.247
  729    HA   ASP  40           HA       ASP  40 -11.854  -4.099  -7.433
  730   1HB   ASP  40          2HB       ASP  40 -12.601  -1.236  -6.815
  731   2HB   ASP  40          1HB       ASP  40 -13.104  -2.124  -8.249
  732    H    GLY  41           H        GLY  41  -9.104  -2.898  -6.548
  733   1HA   GLY  41          2HA       GLY  41  -8.429  -1.130  -8.712
  734   2HA   GLY  41          1HA       GLY  41  -7.317  -1.820  -7.544
  735    H    GLU  42           H        GLU  42  -6.549  -1.561 -10.135
  736    HA   GLU  42           HA       GLU  42  -6.868  -4.175 -11.413
  737   1HB   GLU  42          2HB       GLU  42  -5.424  -1.697 -12.386
  738   2HB   GLU  42          1HB       GLU  42  -5.677  -3.167 -13.317
  739   1HG   GLU  42          2HG       GLU  42  -7.281  -1.638 -14.081
  740   2HG   GLU  42          1HG       GLU  42  -8.153  -2.767 -13.046
  741    H    TRP  43           H        TRP  43  -5.603  -5.627 -10.362
  742    HA   TRP  43           HA       TRP  43  -2.865  -4.872  -9.669
  743   1HB   TRP  43          2HB       TRP  43  -4.463  -7.327  -8.935
  744   2HB   TRP  43          1HB       TRP  43  -2.853  -6.939  -8.342
  745    HD1  TRP  43           HD       TRP  43  -5.632  -4.277  -8.515
  746    HE1  TRP  43           1HE      TRP  43  -6.205  -3.567  -6.108
  747    HE3  TRP  43           3HE      TRP  43  -2.808  -7.686  -5.971
  748    HZ2  TRP  43           2HZ      TRP  43  -5.548  -4.349  -3.486
  749    HZ3  TRP  43           3HZ      TRP  43  -2.834  -7.638  -3.516
  750    HH2  TRP  43           HH       TRP  43  -4.177  -6.003  -2.296
  751    H    THR  44           H        THR  44  -1.220  -5.421 -10.928
  752    HA   THR  44           HA       THR  44  -1.555  -7.625 -12.838
  753    HB   THR  44           HB       THR  44   0.462  -6.672 -13.946
  754    HG1  THR  44           1HG      THR  44   0.156  -4.534 -12.115
  755   1HG2  THR  44          1HG2      THR  44  -0.648  -5.093 -15.122
  756   2HG2  THR  44          2HG2      THR  44  -1.300  -4.315 -13.679
  757   3HG2  THR  44          3HG2      THR  44  -2.022  -5.808 -14.279
  758    H    TYR  45           H        TYR  45  -0.337  -9.453 -12.678
  759    HA   TYR  45           HA       TYR  45   1.506  -9.595 -10.391
  760   1HB   TYR  45          2HB       TYR  45  -0.491 -11.079 -10.351
  761   2HB   TYR  45          1HB       TYR  45   0.085 -11.849 -11.821
  762    HD1  TYR  45           1HD      TYR  45   2.458 -10.844  -9.214
  763    HD2  TYR  45           2HD      TYR  45   0.106 -14.033 -10.761
  764    HE1  TYR  45           1HE      TYR  45   3.746 -12.440  -7.862
  765    HE2  TYR  45           2HE      TYR  45   1.384 -15.639  -9.410
  766    HH   TYR  45           HH       TYR  45   3.105 -15.930  -8.019
  767    H    ASP  46           H        ASP  46   3.585 -10.268 -10.626
  768    HA   ASP  46           HA       ASP  46   4.463 -11.015 -13.337
  769   1HB   ASP  46          2HB       ASP  46   5.170  -8.719 -12.798
  770   2HB   ASP  46          1HB       ASP  46   5.963  -9.306 -11.340
  771    H    ASP  47           H        ASP  47   4.223 -13.215 -12.656
  772    HA   ASP  47           HA       ASP  47   5.261 -14.482 -10.473
  773   1HB   ASP  47          2HB       ASP  47   5.377 -15.563 -13.296
  774   2HB   ASP  47          1HB       ASP  47   5.376 -16.510 -11.812
  775    H    ALA  48           H        ALA  48   7.004 -13.401 -13.325
  776    HA   ALA  48           HA       ALA  48   9.403 -14.713 -13.057
  777   1HB   ALA  48          1HB       ALA  48  10.361 -13.059 -14.420
  778   2HB   ALA  48          2HB       ALA  48   9.247 -11.821 -13.840
  779   3HB   ALA  48          3HB       ALA  48   8.660 -13.117 -14.882
  780    H    THR  49           H        THR  49   8.221 -11.996 -11.167
  781    HA   THR  49           HA       THR  49  10.709 -12.126  -9.591
  782    HB   THR  49           HB       THR  49  10.399  -9.735  -9.069
  783    HG1  THR  49           1HG      THR  49   8.085  -9.772  -9.506
  784   1HG2  THR  49          1HG2      THR  49  11.840 -10.255 -10.940
  785   2HG2  THR  49          2HG2      THR  49  10.925  -8.782 -11.256
  786   3HG2  THR  49          3HG2      THR  49  10.449 -10.296 -12.024
  787    H    LYS  50           H        LYS  50   7.749 -13.224  -9.390
  788    HA   LYS  50           HA       LYS  50   6.228 -13.633  -7.715
  789   1HB   LYS  50          2HB       LYS  50   8.774 -13.292  -6.129
  790   2HB   LYS  50          1HB       LYS  50   7.273 -13.888  -5.436
  791   1HG   LYS  50          2HG       LYS  50   8.318 -15.255  -7.851
  792   2HG   LYS  50          1HG       LYS  50   9.158 -15.510  -6.321
  793   1HD   LYS  50          2HD       LYS  50   7.432 -17.213  -6.730
  794   2HD   LYS  50          1HD       LYS  50   7.104 -16.262  -5.285
  795   1HE   LYS  50          2HE       LYS  50   5.076 -16.633  -6.577
  796   2HE   LYS  50          1HE       LYS  50   5.491 -14.923  -6.518
  797   1HZ   LYS  50          1HZ       LYS  50   4.887 -15.394  -8.730
  798   2HZ   LYS  50          2HZ       LYS  50   5.831 -16.795  -8.789
  799   3HZ   LYS  50          3HZ       LYS  50   6.575 -15.276  -8.744
  800    H    THR  51           H        THR  51   6.366 -10.904  -8.579
  801    HA   THR  51           HA       THR  51   5.670  -9.520  -6.072
  802    HB   THR  51           HB       THR  51   6.978  -8.397  -8.553
  803    HG1  THR  51           1HG      THR  51   8.338  -9.542  -7.075
  804   1HG2  THR  51          1HG2      THR  51   7.093  -6.589  -6.388
  805   2HG2  THR  51          2HG2      THR  51   5.403  -7.025  -6.646
  806   3HG2  THR  51          3HG2      THR  51   6.359  -6.366  -7.976
  807    H    PHE  52           H        PHE  52   3.842  -8.236  -6.043
  808    HA   PHE  52           HA       PHE  52   2.106  -8.481  -8.416
  809   1HB   PHE  52          2HB       PHE  52   1.306  -8.090  -5.535
  810   2HB   PHE  52          1HB       PHE  52   0.205  -8.195  -6.901
  811    HD1  PHE  52           1HD      PHE  52  -0.190 -10.320  -8.020
  812    HD2  PHE  52           2HD      PHE  52   2.356 -10.045  -4.622
  813    HE1  PHE  52           1HE      PHE  52  -0.317 -12.761  -7.730
  814    HE2  PHE  52           2HE      PHE  52   2.235 -12.485  -4.328
  815    HZ   PHE  52           HZ       PHE  52   0.898 -13.845  -5.883
  816    H    THR  53           H        THR  53   2.647  -6.673  -9.466
  817    HA   THR  53           HA       THR  53   2.808  -4.090  -8.243
  818    HB   THR  53           HB       THR  53   2.603  -3.306 -10.722
  819    HG1  THR  53           1HG      THR  53   2.305  -4.830 -12.089
  820   1HG2  THR  53          1HG2      THR  53   4.721  -2.996 -10.057
  821   2HG2  THR  53          2HG2      THR  53   5.007  -4.390 -11.103
  822   3HG2  THR  53          3HG2      THR  53   4.858  -4.613  -9.360
  823    H    VAL  54           H        VAL  54   1.298  -2.682  -7.783
  824    HA   VAL  54           HA       VAL  54  -1.426  -3.146  -8.803
  825    HB   VAL  54           HB       VAL  54  -0.594  -1.798  -6.218
  826   1HG1  VAL  54          1HG1      VAL  54  -3.161  -1.985  -7.669
  827   2HG1  VAL  54          2HG1      VAL  54  -2.577  -0.758  -6.543
  828   3HG1  VAL  54          3HG1      VAL  54  -3.221  -2.282  -5.932
  829   1HG2  VAL  54          1HG2      VAL  54  -1.972  -3.838  -5.336
  830   2HG2  VAL  54          2HG2      VAL  54  -0.272  -4.033  -5.769
  831   3HG2  VAL  54          3HG2      VAL  54  -1.534  -4.552  -6.888
  832    H    THR  55           H        THR  55  -1.878  -1.769 -10.388
  833    HA   THR  55           HA       THR  55  -0.745   0.932 -10.288
  834    HB   THR  55           HB       THR  55  -2.031  -0.467 -12.631
  835    HG1  THR  55           1HG      THR  55  -0.158  -1.319 -13.004
  836   1HG2  THR  55          1HG2      THR  55  -0.442   2.074 -12.425
  837   2HG2  THR  55          2HG2      THR  55  -2.101   1.880 -12.993
  838   3HG2  THR  55          3HG2      THR  55  -0.763   1.234 -13.942
  839    H    GLU  56           H        GLU  56  -1.996   2.534  -9.606
  840    HA   GLU  56           HA       GLU  56  -4.822   2.154  -9.284
  841   1HB   GLU  56          2HB       GLU  56  -4.832   4.353  -8.286
  842   2HB   GLU  56          1HB       GLU  56  -3.447   3.455  -7.683
  843   1HG   GLU  56          2HG       GLU  56  -2.400   5.401  -8.109
  844   2HG   GLU  56          1HG       GLU  56  -2.268   4.700  -9.719
  Start of MODEL   27
    1   1H    MET   1          1HT       MET   1   5.007 -18.680   1.595
    2   2H    MET   1          2HT       MET   1   5.973 -18.604   2.983
    3   3H    MET   1          3HT       MET   1   6.218 -19.836   1.850
    4    HA   MET   1           HA       MET   1   7.918 -18.128   1.669
    5   1HB   MET   1          2HB       MET   1   5.957 -18.315  -0.626
    6   2HB   MET   1          1HB       MET   1   7.602 -17.710  -0.773
    7   1HG   MET   1          2HG       MET   1   8.464 -19.885  -0.081
    8   2HG   MET   1          1HG       MET   1   6.815 -20.491   0.062
    9   1HE   MET   1          1HE       MET   1   8.728 -19.180  -3.926
   10   2HE   MET   1          2HE       MET   1   9.556 -19.112  -2.370
   11   3HE   MET   1          3HE       MET   1   8.196 -18.037  -2.693
   12    H    GLN   2           H        GLN   2   8.375 -15.979   0.685
   13    HA   GLN   2           HA       GLN   2   6.390 -14.014   1.597
   14   1HB   GLN   2          2HB       GLN   2   8.564 -13.883   2.728
   15   2HB   GLN   2          1HB       GLN   2   9.372 -13.710   1.176
   16   1HG   GLN   2          2HG       GLN   2   8.214 -11.592   0.806
   17   2HG   GLN   2          1HG       GLN   2   7.403 -11.766   2.363
   18   1HE2  GLN   2          1HE2      GLN   2   8.267 -10.585   3.893
   19   2HE2  GLN   2          2HE2      GLN   2   9.936 -10.170   4.054
   20    H    TYR   3           H        TYR   3   5.738 -12.358   0.242
   21    HA   TYR   3           HA       TYR   3   6.678 -12.541  -2.543
   22   1HB   TYR   3          2HB       TYR   3   3.858 -12.071  -1.564
   23   2HB   TYR   3          1HB       TYR   3   4.367 -11.924  -3.244
   24    HD1  TYR   3           1HD      TYR   3   4.321 -13.791  -4.638
   25    HD2  TYR   3           2HD      TYR   3   4.253 -14.354  -0.422
   26    HE1  TYR   3           1HE      TYR   3   3.929 -16.194  -4.972
   27    HE2  TYR   3           2HE      TYR   3   3.862 -16.761  -0.744
   28    HH   TYR   3           HH       TYR   3   4.495 -18.430  -3.077
   29    H    LYS   4           H        LYS   4   6.828 -10.642  -3.724
   30    HA   LYS   4           HA       LYS   4   7.051  -8.234  -2.079
   31   1HB   LYS   4          2HB       LYS   4   9.000  -8.889  -3.433
   32   2HB   LYS   4          1HB       LYS   4   8.024  -8.793  -4.885
   33   1HG   LYS   4          2HG       LYS   4   9.404  -6.824  -4.670
   34   2HG   LYS   4          1HG       LYS   4   7.700  -6.399  -4.520
   35   1HD   LYS   4          2HD       LYS   4   8.805  -5.172  -2.842
   36   2HD   LYS   4          1HD       LYS   4   8.042  -6.524  -2.006
   37   1HE   LYS   4          2HE       LYS   4  10.926  -6.473  -2.887
   38   2HE   LYS   4          1HE       LYS   4  10.378  -6.040  -1.271
   39   1HZ   LYS   4          1HZ       LYS   4  10.743  -8.192  -0.852
   40   2HZ   LYS   4          2HZ       LYS   4  10.685  -8.646  -2.478
   41   3HZ   LYS   4          3HZ       LYS   4   9.250  -8.449  -1.604
   42    H    VAL   5           H        VAL   5   5.225  -7.068  -1.981
   43    HA   VAL   5           HA       VAL   5   3.507  -6.919  -4.343
   44    HB   VAL   5           HB       VAL   5   2.990  -5.985  -1.514
   45   1HG1  VAL   5          1HG1      VAL   5   1.245  -6.009  -3.969
   46   2HG1  VAL   5          2HG1      VAL   5   1.708  -4.622  -2.984
   47   3HG1  VAL   5          3HG1      VAL   5   0.613  -5.840  -2.331
   48   1HG2  VAL   5          1HG2      VAL   5   2.511  -8.110  -1.077
   49   2HG2  VAL   5          2HG2      VAL   5   2.799  -8.568  -2.756
   50   3HG2  VAL   5          3HG2      VAL   5   1.201  -8.013  -2.255
   51    H    ILE   6           H        ILE   6   3.798  -5.299  -5.674
   52    HA   ILE   6           HA       ILE   6   5.079  -2.842  -4.720
   53    HB   ILE   6           HB       ILE   6   4.686  -3.882  -7.528
   54   1HG1  ILE   6          2HG1      ILE   6   7.158  -3.644  -5.797
   55   2HG1  ILE   6          1HG1      ILE   6   6.344  -5.142  -6.237
   56   1HG2  ILE   6          1HG2      ILE   6   6.008  -1.375  -6.520
   57   2HG2  ILE   6          2HG2      ILE   6   4.650  -1.512  -7.640
   58   3HG2  ILE   6          3HG2      ILE   6   6.261  -2.035  -8.136
   59   1HD1  ILE   6          1HD1      ILE   6   8.344  -4.789  -7.567
   60   2HD1  ILE   6          2HD1      ILE   6   7.702  -3.250  -8.142
   61   3HD1  ILE   6          3HD1      ILE   6   6.898  -4.760  -8.577
   62    H    LEU   7           H        LEU   7   3.954  -1.019  -4.495
   63    HA   LEU   7           HA       LEU   7   1.271  -0.884  -5.688
   64   1HB   LEU   7          2HB       LEU   7   2.354   0.753  -3.394
   65   2HB   LEU   7          1HB       LEU   7   0.688   0.650  -3.925
   66    HG   LEU   7           HG       LEU   7   2.264  -1.586  -2.667
   67   1HD1  LEU   7          1HD1      LEU   7   1.352   0.516  -1.343
   68   2HD1  LEU   7          2HD1      LEU   7   1.250  -1.115  -0.683
   69   3HD1  LEU   7          3HD1      LEU   7  -0.161  -0.382  -1.447
   70   1HD2  LEU   7          1HD2      LEU   7  -0.687  -1.616  -3.130
   71   2HD2  LEU   7          2HD2      LEU   7   0.434  -2.964  -2.927
   72   3HD2  LEU   7          3HD2      LEU   7   0.406  -2.062  -4.440
   73    H    ASN   8           H        ASN   8   1.811  -0.082  -7.691
   74    HA   ASN   8           HA       ASN   8   3.304   2.438  -7.809
   75   1HB   ASN   8          2HB       ASN   8   2.484   0.550 -10.019
   76   2HB   ASN   8          1HB       ASN   8   3.377   2.047 -10.260
   77   1HD2  ASN   8          1HD2      ASN   8   3.780  -1.094 -10.277
   78   2HD2  ASN   8          2HD2      ASN   8   5.388  -1.234  -9.663
   79    H    GLY   9           H        GLY   9   2.096   4.203  -7.603
   80   1HA   GLY   9          2HA       GLY   9  -0.477   4.290  -9.058
   81   2HA   GLY   9          1HA       GLY   9  -0.177   5.153  -7.557
   82    H    LYS  10           H        LYS  10  -1.005   6.934  -9.020
   83    HA   LYS  10           HA       LYS  10   0.946   7.936 -10.912
   84   1HB   LYS  10          2HB       LYS  10  -1.758   8.920 -10.010
   85   2HB   LYS  10          1HB       LYS  10  -0.721   9.873 -11.062
   86   1HG   LYS  10          2HG       LYS  10  -2.414   8.625 -12.308
   87   2HG   LYS  10          1HG       LYS  10  -0.777   8.138 -12.747
   88   1HD   LYS  10          2HD       LYS  10  -0.968   6.169 -11.325
   89   2HD   LYS  10          1HD       LYS  10  -2.590   6.666 -10.835
   90   1HE   LYS  10          2HE       LYS  10  -1.726   5.998 -13.646
   91   2HE   LYS  10          1HE       LYS  10  -2.640   4.935 -12.576
   92   1HZ   LYS  10          1HZ       LYS  10  -4.160   6.006 -14.037
   93   2HZ   LYS  10          2HZ       LYS  10  -3.523   7.536 -13.700
   94   3HZ   LYS  10          3HZ       LYS  10  -4.374   6.694 -12.504
   95    H    THR  11           H        THR  11  -0.594   9.076  -7.929
   96    HA   THR  11           HA       THR  11   1.544  11.019  -7.530
   97    HB   THR  11           HB       THR  11  -0.040  11.716  -5.615
   98    HG1  THR  11           1HG      THR  11  -2.270  11.054  -6.237
   99   1HG2  THR  11          1HG2      THR  11  -1.078  13.235  -6.939
  100   2HG2  THR  11          2HG2      THR  11  -1.501  12.044  -8.167
  101   3HG2  THR  11          3HG2      THR  11   0.143  12.675  -8.082
  102    H    LEU  12           H        LEU  12   0.830   7.878  -6.703
  103    HA   LEU  12           HA       LEU  12   2.583   8.047  -4.368
  104   1HB   LEU  12          2HB       LEU  12   0.295   7.870  -3.532
  105   2HB   LEU  12          1HB       LEU  12   0.034   6.437  -4.510
  106    HG   LEU  12           HG       LEU  12   1.531   5.154  -3.182
  107   1HD1  LEU  12          1HD1      LEU  12   2.371   6.708  -1.078
  108   2HD1  LEU  12          2HD1      LEU  12   2.555   7.772  -2.469
  109   3HD1  LEU  12          3HD1      LEU  12   3.353   6.208  -2.454
  110   1HD2  LEU  12          1HD2      LEU  12  -0.806   6.192  -2.210
  111   2HD2  LEU  12          2HD2      LEU  12   0.333   6.541  -0.910
  112   3HD2  LEU  12          3HD2      LEU  12   0.115   4.882  -1.472
  113    H    LYS  13           H        LYS  13   4.104   6.518  -4.239
  114    HA   LYS  13           HA       LYS  13   3.906   4.096  -5.864
  115   1HB   LYS  13          2HB       LYS  13   6.257   5.994  -6.058
  116   2HB   LYS  13          1HB       LYS  13   6.116   4.437  -6.864
  117   1HG   LYS  13          2HG       LYS  13   4.232   5.266  -8.165
  118   2HG   LYS  13          1HG       LYS  13   4.348   6.825  -7.346
  119   1HD   LYS  13          2HD       LYS  13   6.619   7.109  -8.241
  120   2HD   LYS  13          1HD       LYS  13   6.469   5.565  -9.085
  121   1HE   LYS  13          2HE       LYS  13   6.036   7.432 -10.593
  122   2HE   LYS  13          1HE       LYS  13   4.591   6.445 -10.373
  123   1HZ   LYS  13          1HZ       LYS  13   3.500   8.118  -9.382
  124   2HZ   LYS  13          2HZ       LYS  13   4.637   9.106 -10.153
  125   3HZ   LYS  13          3HZ       LYS  13   4.857   8.667  -8.534
  126    H    GLY  14           H        GLY  14   5.120   2.363  -5.036
  127   1HA   GLY  14          2HA       GLY  14   7.172   2.627  -3.128
  128   2HA   GLY  14          1HA       GLY  14   5.650   2.421  -2.282
  129    H    GLU  15           H        GLU  15   6.901   0.530  -1.485
  130    HA   GLU  15           HA       GLU  15   6.153  -1.804  -3.056
  131   1HB   GLU  15          2HB       GLU  15   8.951  -1.376  -1.993
  132   2HB   GLU  15          1HB       GLU  15   8.354  -2.873  -2.696
  133   1HG   GLU  15          2HG       GLU  15   7.988  -1.726  -4.823
  134   2HG   GLU  15          1HG       GLU  15   8.597  -0.231  -4.117
  135    H    THR  16           H        THR  16   5.634  -3.572  -1.847
  136    HA   THR  16           HA       THR  16   6.086  -3.507   1.028
  137    HB   THR  16           HB       THR  16   3.981  -2.556   1.113
  138    HG1  THR  16           1HG      THR  16   3.324  -5.280   0.944
  139   1HG2  THR  16          1HG2      THR  16   2.057  -3.307  -0.293
  140   2HG2  THR  16          2HG2      THR  16   3.213  -4.210  -1.267
  141   3HG2  THR  16          3HG2      THR  16   3.336  -2.457  -1.157
  142    H    THR  17           H        THR  17   5.306  -5.650   2.055
  143    HA   THR  17           HA       THR  17   5.511  -7.880   0.169
  144    HB   THR  17           HB       THR  17   7.259  -8.956   1.543
  145    HG1  THR  17           1HG      THR  17   7.231  -6.468   2.893
  146   1HG2  THR  17          1HG2      THR  17   8.103  -6.229   0.605
  147   2HG2  THR  17          2HG2      THR  17   7.928  -7.649  -0.422
  148   3HG2  THR  17          3HG2      THR  17   9.144  -7.631   0.854
  149    H    THR  18           H        THR  18   4.032  -9.336   0.581
  150    HA   THR  18           HA       THR  18   2.968  -9.638   3.324
  151    HB   THR  18           HB       THR  18   1.316  -8.959   1.597
  152    HG1  THR  18           1HG      THR  18   0.749 -10.361   3.370
  153   1HG2  THR  18          1HG2      THR  18   1.647  -9.794  -0.453
  154   2HG2  THR  18          2HG2      THR  18   0.674 -11.133   0.153
  155   3HG2  THR  18          3HG2      THR  18   2.433 -11.254   0.147
  156    H    GLU  19           H        GLU  19   2.790 -11.726   4.192
  157    HA   GLU  19           HA       GLU  19   4.393 -13.772   2.804
  158   1HB   GLU  19          2HB       GLU  19   5.281 -13.081   4.982
  159   2HB   GLU  19          1HB       GLU  19   3.750 -13.481   5.748
  160   1HG   GLU  19          2HG       GLU  19   4.064 -15.827   5.153
  161   2HG   GLU  19          1HG       GLU  19   5.599 -15.426   4.384
  162    H    ALA  20           H        ALA  20   3.229 -15.342   1.853
  163    HA   ALA  20           HA       ALA  20   0.938 -16.449   3.280
  164   1HB   ALA  20          1HB       ALA  20  -0.649 -15.985   1.727
  165   2HB   ALA  20          2HB       ALA  20   0.502 -15.968   0.389
  166   3HB   ALA  20          3HB       ALA  20   0.387 -14.580   1.471
  167    H    VAL  21           H        VAL  21   0.404 -18.537   2.722
  168    HA   VAL  21           HA       VAL  21   2.421 -20.307   2.135
  169    HB   VAL  21           HB       VAL  21  -0.487 -20.821   1.517
  170   1HG1  VAL  21          1HG1      VAL  21   0.038 -22.975   1.283
  171   2HG1  VAL  21          2HG1      VAL  21   1.085 -22.962   2.702
  172   3HG1  VAL  21          3HG1      VAL  21   1.710 -22.434   1.140
  173   1HG2  VAL  21          1HG2      VAL  21   0.986 -20.732   4.125
  174   2HG2  VAL  21          2HG2      VAL  21  -0.445 -21.741   3.916
  175   3HG2  VAL  21          3HG2      VAL  21  -0.557 -19.995   3.693
  176    H    ASP  22           H        ASP  22   0.436 -18.542  -0.103
  177    HA   ASP  22           HA       ASP  22   2.116 -19.413  -2.288
  178   1HB   ASP  22          2HB       ASP  22   0.311 -20.230  -3.717
  179   2HB   ASP  22          1HB       ASP  22   0.426 -21.194  -2.248
  180    H    ALA  23           H        ALA  23   1.130 -18.425  -4.448
  181    HA   ALA  23           HA       ALA  23   1.244 -15.643  -4.137
  182   1HB   ALA  23          1HB       ALA  23   0.570 -17.444  -6.421
  183   2HB   ALA  23          2HB       ALA  23   1.951 -16.367  -6.213
  184   3HB   ALA  23          3HB       ALA  23   0.361 -15.699  -6.577
  185    H    ALA  24           H        ALA  24  -1.505 -17.801  -4.666
  186    HA   ALA  24           HA       ALA  24  -3.465 -15.796  -4.936
  187   1HB   ALA  24          1HB       ALA  24  -5.048 -17.491  -4.788
  188   2HB   ALA  24          2HB       ALA  24  -4.076 -18.440  -3.663
  189   3HB   ALA  24          3HB       ALA  24  -3.622 -18.354  -5.365
  190    H    THR  25           H        THR  25  -2.551 -17.733  -2.076
  191    HA   THR  25           HA       THR  25  -4.158 -16.507  -0.198
  192    HB   THR  25           HB       THR  25  -2.387 -17.152   1.443
  193    HG1  THR  25           1HG      THR  25  -0.946 -17.514  -0.922
  194   1HG2  THR  25          1HG2      THR  25  -3.537 -19.019  -0.501
  195   2HG2  THR  25          2HG2      THR  25  -3.595 -19.030   1.261
  196   3HG2  THR  25          3HG2      THR  25  -2.163 -19.625   0.424
  197    H    ALA  26           H        ALA  26  -0.949 -15.584  -1.370
  198    HA   ALA  26           HA       ALA  26  -0.578 -13.320   0.241
  199   1HB   ALA  26          1HB       ALA  26   0.674 -12.641  -2.092
  200   2HB   ALA  26          2HB       ALA  26   0.598 -14.398  -2.219
  201   3HB   ALA  26          3HB       ALA  26   1.376 -13.648  -0.826
  202    H    GLU  27           H        GLU  27  -1.927 -13.624  -3.056
  203    HA   GLU  27           HA       GLU  27  -2.588 -11.010  -3.543
  204   1HB   GLU  27          2HB       GLU  27  -2.850 -12.715  -5.232
  205   2HB   GLU  27          1HB       GLU  27  -4.098 -13.512  -4.287
  206   1HG   GLU  27          2HG       GLU  27  -5.040 -12.268  -6.148
  207   2HG   GLU  27          1HG       GLU  27  -5.577 -11.618  -4.598
  208    H    LYS  28           H        LYS  28  -4.611 -13.465  -1.931
  209    HA   LYS  28           HA       LYS  28  -6.749 -11.709  -1.368
  210   1HB   LYS  28          2HB       LYS  28  -5.893 -14.379  -0.299
  211   2HB   LYS  28          1HB       LYS  28  -7.233 -13.509   0.443
  212   1HG   LYS  28          2HG       LYS  28  -7.818 -15.223  -1.329
  213   2HG   LYS  28          1HG       LYS  28  -8.533 -13.620  -1.505
  214   1HD   LYS  28          2HD       LYS  28  -6.826 -13.024  -3.142
  215   2HD   LYS  28          1HD       LYS  28  -6.074 -14.611  -2.949
  216   1HE   LYS  28          2HE       LYS  28  -7.461 -14.545  -4.952
  217   2HE   LYS  28          1HE       LYS  28  -8.113 -15.680  -3.771
  218   1HZ   LYS  28          1HZ       LYS  28  -9.708 -13.979  -3.094
  219   2HZ   LYS  28          2HZ       LYS  28  -9.866 -14.352  -4.736
  220   3HZ   LYS  28          3HZ       LYS  28  -9.097 -12.921  -4.265
  221    H    VAL  29           H        VAL  29  -4.027 -12.834   0.647
  222    HA   VAL  29           HA       VAL  29  -4.683 -11.430   2.959
  223    HB   VAL  29           HB       VAL  29  -1.906 -11.984   1.892
  224   1HG1  VAL  29          1HG1      VAL  29  -2.103 -12.033   4.742
  225   2HG1  VAL  29          2HG1      VAL  29  -2.723 -10.498   4.138
  226   3HG1  VAL  29          3HG1      VAL  29  -1.092 -11.020   3.714
  227   1HG2  VAL  29          1HG2      VAL  29  -2.065 -14.114   2.585
  228   2HG2  VAL  29          2HG2      VAL  29  -3.804 -13.846   2.472
  229   3HG2  VAL  29          3HG2      VAL  29  -2.986 -13.679   4.026
  230    H    VAL  30           H        VAL  30  -2.919 -10.419   0.084
  231    HA   VAL  30           HA       VAL  30  -2.284  -7.807   1.016
  232    HB   VAL  30           HB       VAL  30  -2.612  -8.795  -1.830
  233   1HG1  VAL  30          1HG1      VAL  30  -1.430  -6.871  -2.540
  234   2HG1  VAL  30          2HG1      VAL  30  -1.022  -6.421  -0.885
  235   3HG1  VAL  30          3HG1      VAL  30  -2.688  -6.294  -1.448
  236   1HG2  VAL  30          1HG2      VAL  30   0.064  -8.350  -0.672
  237   2HG2  VAL  30          2HG2      VAL  30  -0.498  -9.591  -1.793
  238   3HG2  VAL  30          3HG2      VAL  30  -0.825  -9.748  -0.066
  239    H    LYS  31           H        LYS  31  -4.862  -9.142  -1.068
  240    HA   LYS  31           HA       LYS  31  -6.321  -6.906  -1.642
  241   1HB   LYS  31          2HB       LYS  31  -7.276  -9.675  -0.938
  242   2HB   LYS  31          1HB       LYS  31  -8.370  -8.412  -1.477
  243   1HG   LYS  31          2HG       LYS  31  -6.045  -9.489  -3.044
  244   2HG   LYS  31          1HG       LYS  31  -7.738  -9.916  -3.280
  245   1HD   LYS  31          2HD       LYS  31  -6.953  -7.053  -3.350
  246   2HD   LYS  31          1HD       LYS  31  -6.582  -8.075  -4.746
  247   1HE   LYS  31          2HE       LYS  31  -8.717  -6.988  -5.068
  248   2HE   LYS  31          1HE       LYS  31  -8.958  -8.719  -4.862
  249   1HZ   LYS  31          1HZ       LYS  31  -9.859  -8.435  -2.774
  250   2HZ   LYS  31          2HZ       LYS  31 -10.468  -7.089  -3.596
  251   3HZ   LYS  31          3HZ       LYS  31  -9.156  -6.913  -2.544
  252    H    GLN  32           H        GLN  32  -6.568  -8.911   1.243
  253    HA   GLN  32           HA       GLN  32  -8.577  -7.405   2.491
  254   1HB   GLN  32          2HB       GLN  32  -7.674  -9.737   3.135
  255   2HB   GLN  32          1HB       GLN  32  -6.466  -8.855   4.064
  256   1HG   GLN  32          2HG       GLN  32  -8.251  -9.434   5.529
  257   2HG   GLN  32          1HG       GLN  32  -8.315  -7.693   5.250
  258   1HE2  GLN  32          1HE2      GLN  32  -9.871  -6.905   3.693
  259   2HE2  GLN  32          2HE2      GLN  32 -11.342  -7.773   3.437
  260    H    PHE  33           H        PHE  33  -5.107  -7.039   2.410
  261    HA   PHE  33           HA       PHE  33  -4.662  -5.246   4.465
  262   1HB   PHE  33          2HB       PHE  33  -2.973  -6.311   2.875
  263   2HB   PHE  33          1HB       PHE  33  -3.379  -5.038   1.733
  264    HD1  PHE  33           1HD      PHE  33  -2.494  -5.323   5.341
  265    HD2  PHE  33           2HD      PHE  33  -1.916  -3.270   1.647
  266    HE1  PHE  33           1HE      PHE  33  -0.851  -3.841   6.416
  267    HE2  PHE  33           2HE      PHE  33  -0.267  -1.798   2.727
  268    HZ   PHE  33           HZ       PHE  33   0.266  -2.087   5.114
  269    H    PHE  34           H        PHE  34  -4.898  -4.219   1.101
  270    HA   PHE  34           HA       PHE  34  -5.519  -1.538   1.667
  271   1HB   PHE  34          2HB       PHE  34  -6.091  -3.083  -0.862
  272   2HB   PHE  34          1HB       PHE  34  -5.987  -1.326  -0.711
  273    HD1  PHE  34           1HD      PHE  34  -3.729  -0.695   0.743
  274    HD2  PHE  34           2HD      PHE  34  -4.253  -3.987  -1.881
  275    HE1  PHE  34           1HE      PHE  34  -1.295  -0.822   0.427
  276    HE2  PHE  34           2HE      PHE  34  -1.821  -4.119  -2.219
  277    HZ   PHE  34           HZ       PHE  34  -0.344  -2.535  -1.051
  278    H    ASN  35           H        ASN  35  -7.577  -4.321   1.061
  279    HA   ASN  35           HA       ASN  35 -10.050  -3.124   0.726
  280   1HB   ASN  35          2HB       ASN  35  -9.661  -5.548   0.584
  281   2HB   ASN  35          1HB       ASN  35  -9.364  -5.612   2.318
  282   1HD2  ASN  35          1HD2      ASN  35 -11.478  -6.510   0.192
  283   2HD2  ASN  35          2HD2      ASN  35 -12.964  -6.280   1.043
  284    H    ASP  36           H        ASP  36  -8.202  -3.738   3.620
  285    HA   ASP  36           HA       ASP  36 -10.230  -2.520   5.334
  286   1HB   ASP  36          2HB       ASP  36  -7.645  -3.933   6.011
  287   2HB   ASP  36          1HB       ASP  36  -8.750  -3.254   7.204
  288    H    ASN  37           H        ASN  37  -7.161  -1.711   3.905
  289    HA   ASN  37           HA       ASN  37  -6.611   0.434   5.762
  290   1HB   ASN  37          2HB       ASN  37  -5.377  -0.197   3.071
  291   2HB   ASN  37          1HB       ASN  37  -4.798   1.040   4.180
  292   1HD2  ASN  37          1HD2      ASN  37  -3.763  -1.616   3.048
  293   2HD2  ASN  37          2HD2      ASN  37  -3.132  -2.408   4.448
  294    H    GLY  38           H        GLY  38  -7.806   0.080   2.496
  295   1HA   GLY  38          2HA       GLY  38  -8.132   2.116   1.103
  296   2HA   GLY  38          1HA       GLY  38  -9.627   1.432   1.695
  297    H    VAL  39           H        VAL  39 -10.995   2.790   2.548
  298    HA   VAL  39           HA       VAL  39 -10.243   5.520   2.933
  299    HB   VAL  39           HB       VAL  39 -12.906   4.170   3.246
  300   1HG1  VAL  39          1HG1      VAL  39 -12.253   7.114   3.118
  301   2HG1  VAL  39          2HG1      VAL  39 -12.822   6.244   4.542
  302   3HG1  VAL  39          3HG1      VAL  39 -13.871   6.414   3.135
  303   1HG2  VAL  39          1HG2      VAL  39 -11.363   4.936   0.964
  304   2HG2  VAL  39          2HG2      VAL  39 -12.834   5.907   1.036
  305   3HG2  VAL  39          3HG2      VAL  39 -12.939   4.146   1.030
  306    H    ASP  40           H        ASP  40 -11.832   3.210   5.211
  307    HA   ASP  40           HA       ASP  40 -11.371   5.127   7.328
  308   1HB   ASP  40          2HB       ASP  40 -12.728   2.430   7.360
  309   2HB   ASP  40          1HB       ASP  40 -12.668   3.549   8.719
  310    H    GLY  41           H        GLY  41  -9.058   3.626   6.114
  311   1HA   GLY  41          2HA       GLY  41  -8.150   1.701   7.975
  312   2HA   GLY  41          1HA       GLY  41  -7.140   2.590   6.847
  313    H    GLU  42           H        GLU  42  -6.789   1.830   9.728
  314    HA   GLU  42           HA       GLU  42  -6.809   4.336  11.167
  315   1HB   GLU  42          2HB       GLU  42  -5.587   1.666  11.896
  316   2HB   GLU  42          1HB       GLU  42  -5.737   3.044  12.977
  317   1HG   GLU  42          2HG       GLU  42  -8.017   1.523  11.735
  318   2HG   GLU  42          1HG       GLU  42  -7.455   1.375  13.398
  319    H    TRP  43           H        TRP  43  -5.456   5.745  10.085
  320    HA   TRP  43           HA       TRP  43  -2.654   4.920   9.744
  321   1HB   TRP  43          2HB       TRP  43  -4.000   7.368   8.604
  322   2HB   TRP  43          1HB       TRP  43  -2.418   6.734   8.182
  323    HD1  TRP  43           HD       TRP  43  -4.932   3.966   8.315
  324    HE1  TRP  43           1HE      TRP  43  -5.669   3.350   5.923
  325    HE3  TRP  43           3HE      TRP  43  -2.914   7.923   5.798
  326    HZ2  TRP  43           2HZ      TRP  43  -5.428   4.402   3.333
  327    HZ3  TRP  43           3HZ      TRP  43  -3.205   8.040   3.360
  328    HH2  TRP  43           HH       TRP  43  -4.437   6.314   2.151
  329    H    THR  44           H        THR  44  -1.042   5.872  10.849
  330    HA   THR  44           HA       THR  44  -1.714   8.178  12.553
  331    HB   THR  44           HB       THR  44   0.182   7.417  14.001
  332    HG1  THR  44           1HG      THR  44   0.036   4.985  12.572
  333   1HG2  THR  44          1HG2      THR  44  -2.178   6.775  14.491
  334   2HG2  THR  44          2HG2      THR  44  -0.956   5.677  15.131
  335   3HG2  THR  44          3HG2      THR  44  -1.860   5.241  13.681
  336    H    TYR  45           H        TYR  45  -0.283   9.940  12.565
  337    HA   TYR  45           HA       TYR  45   1.694   9.893  10.381
  338   1HB   TYR  45          2HB       TYR  45  -0.231  11.416  10.051
  339   2HB   TYR  45          1HB       TYR  45   0.217  12.271  11.522
  340    HD1  TYR  45           1HD      TYR  45   2.566  10.998   8.952
  341    HD2  TYR  45           2HD      TYR  45   0.657  14.412  10.626
  342    HE1  TYR  45           1HE      TYR  45   4.042  12.461   7.640
  343    HE2  TYR  45           2HE      TYR  45   2.130  15.883   9.318
  344    HH   TYR  45           HH       TYR  45   4.694  15.429   8.231
  345    H    ASP  46           H        ASP  46   3.728  10.702  10.672
  346    HA   ASP  46           HA       ASP  46   4.467  11.496  13.412
  347   1HB   ASP  46          2HB       ASP  46   5.268   9.224  12.938
  348   2HB   ASP  46          1HB       ASP  46   6.081   9.804  11.488
  349    H    ASP  47           H        ASP  47   4.277  13.693  12.806
  350    HA   ASP  47           HA       ASP  47   5.281  15.008  10.636
  351   1HB   ASP  47          2HB       ASP  47   5.377  16.001  13.491
  352   2HB   ASP  47          1HB       ASP  47   5.450  17.005  12.049
  353    H    ALA  48           H        ALA  48   7.091  13.948  13.474
  354    HA   ALA  48           HA       ALA  48   9.461  15.281  13.163
  355   1HB   ALA  48          1HB       ALA  48   8.705  13.535  14.925
  356   2HB   ALA  48          2HB       ALA  48  10.421  13.723  14.568
  357   3HB   ALA  48          3HB       ALA  48   9.516  12.381  13.867
  358    H    THR  49           H        THR  49   8.287  12.578  11.258
  359    HA   THR  49           HA       THR  49  10.681  12.849   9.564
  360    HB   THR  49           HB       THR  49  10.554  10.423   9.093
  361    HG1  THR  49           1HG      THR  49   8.328  10.175   9.667
  362   1HG2  THR  49          1HG2      THR  49  11.340   9.575  11.248
  363   2HG2  THR  49          2HG2      THR  49  10.801  11.067  12.020
  364   3HG2  THR  49          3HG2      THR  49  12.092  11.111  10.820
  365    H    LYS  50           H        LYS  50   7.641  13.675   9.559
  366    HA   LYS  50           HA       LYS  50   5.943  13.871   8.027
  367   1HB   LYS  50          2HB       LYS  50   8.319  13.798   6.164
  368   2HB   LYS  50          1HB       LYS  50   6.699  14.305   5.704
  369   1HG   LYS  50          2HG       LYS  50   7.212  15.861   7.902
  370   2HG   LYS  50          1HG       LYS  50   8.788  15.761   7.112
  371   1HD   LYS  50          2HD       LYS  50   7.784  16.502   5.010
  372   2HD   LYS  50          1HD       LYS  50   6.203  16.571   5.793
  373   1HE   LYS  50          2HE       LYS  50   7.048  18.281   7.332
  374   2HE   LYS  50          1HE       LYS  50   8.619  18.217   6.534
  375   1HZ   LYS  50          1HZ       LYS  50   6.961  18.664   4.469
  376   2HZ   LYS  50          2HZ       LYS  50   7.787  19.877   5.311
  377   3HZ   LYS  50          3HZ       LYS  50   6.182  19.522   5.703
  378    H    THR  51           H        THR  51   6.509  11.194   8.866
  379    HA   THR  51           HA       THR  51   5.830   9.689   6.427
  380    HB   THR  51           HB       THR  51   7.189   8.703   8.943
  381    HG1  THR  51           1HG      THR  51   8.970   8.448   7.522
  382   1HG2  THR  51          1HG2      THR  51   5.706   7.158   7.264
  383   2HG2  THR  51          2HG2      THR  51   7.060   6.594   8.242
  384   3HG2  THR  51          3HG2      THR  51   7.316   7.036   6.554
  385    H    PHE  52           H        PHE  52   4.101   8.326   6.436
  386    HA   PHE  52           HA       PHE  52   2.351   8.433   8.807
  387   1HB   PHE  52          2HB       PHE  52   1.532   7.928   5.938
  388   2HB   PHE  52          1HB       PHE  52   0.464   8.179   7.313
  389    HD1  PHE  52           1HD      PHE  52  -0.525  10.234   7.487
  390    HD2  PHE  52           2HD      PHE  52   3.281   9.939   5.603
  391    HE1  PHE  52           1HE      PHE  52  -0.591  12.642   6.983
  392    HE2  PHE  52           2HE      PHE  52   3.222  12.346   5.103
  393    HZ   PHE  52           HZ       PHE  52   1.286  13.701   5.793
  394    H    THR  53           H        THR  53   1.408   6.501   9.536
  395    HA   THR  53           HA       THR  53   2.397   4.061   8.232
  396    HB   THR  53           HB       THR  53   2.214   3.084  10.637
  397    HG1  THR  53           1HG      THR  53   1.435   5.397  11.247
  398   1HG2  THR  53          1HG2      THR  53   4.535   4.111  11.186
  399   2HG2  THR  53          2HG2      THR  53   4.417   4.762   9.552
  400   3HG2  THR  53          3HG2      THR  53   4.347   3.018   9.815
  401    H    VAL  54           H        VAL  54   0.946   2.613   7.660
  402    HA   VAL  54           HA       VAL  54  -1.816   2.941   8.626
  403    HB   VAL  54           HB       VAL  54  -0.854   1.622   6.069
  404   1HG1  VAL  54          1HG1      VAL  54  -3.665   2.343   6.237
  405   2HG1  VAL  54          2HG1      VAL  54  -3.204   1.155   7.454
  406   3HG1  VAL  54          3HG1      VAL  54  -2.916   0.825   5.746
  407   1HG2  VAL  54          1HG2      VAL  54  -1.698   4.370   6.742
  408   2HG2  VAL  54          2HG2      VAL  54  -2.371   3.686   5.261
  409   3HG2  VAL  54          3HG2      VAL  54  -0.622   3.787   5.471
  410    H    THR  55           H        THR  55  -2.313   1.530  10.174
  411    HA   THR  55           HA       THR  55  -1.040  -1.109  10.137
  412    HB   THR  55           HB       THR  55  -2.499   0.255  12.399
  413    HG1  THR  55           1HG      THR  55  -0.503   1.255  11.824
  414   1HG2  THR  55          1HG2      THR  55  -1.234  -1.421  13.780
  415   2HG2  THR  55          2HG2      THR  55  -0.907  -2.286  12.278
  416   3HG2  THR  55          3HG2      THR  55  -2.569  -2.062  12.825
  417    H    GLU  56           H        GLU  56  -2.161  -2.768   9.385
  418    HA   GLU  56           HA       GLU  56  -4.819  -2.705   8.603
  419   1HB   GLU  56          2HB       GLU  56  -2.998  -4.392   7.999
  420   2HB   GLU  56          1HB       GLU  56  -3.396  -5.207   9.502
  421   1HG   GLU  56          2HG       GLU  56  -5.308  -4.718   7.228
  422   2HG   GLU  56          1HG       GLU  56  -4.464  -6.230   7.546
  423   1H    MET   1          1HT       MET   1   5.482  18.605  -1.432
  424   2H    MET   1          2HT       MET   1   6.464  18.505  -2.806
  425   3H    MET   1          3HT       MET   1   6.724  19.732  -1.669
  426    HA   MET   1           HA       MET   1   8.380  17.983  -1.466
  427   1HB   MET   1          2HB       MET   1   6.391  18.217   0.801
  428   2HB   MET   1          1HB       MET   1   8.016  17.573   0.973
  429   1HG   MET   1          2HG       MET   1   8.942  19.726   0.293
  430   2HG   MET   1          1HG       MET   1   7.311  20.372   0.127
  431   1HE   MET   1          1HE       MET   1   9.135  19.015   4.140
  432   2HE   MET   1          2HE       MET   1   9.984  18.927   2.597
  433   3HE   MET   1          3HE       MET   1   8.594  17.886   2.900
  434    H    GLN   2           H        GLN   2   8.771  15.823  -0.475
  435    HA   GLN   2           HA       GLN   2   6.750  13.908  -1.415
  436   1HB   GLN   2          2HB       GLN   2   8.937  13.723  -2.515
  437   2HB   GLN   2          1HB       GLN   2   9.718  13.531  -0.952
  438   1HG   GLN   2          2HG       GLN   2   8.504  11.442  -0.599
  439   2HG   GLN   2          1HG       GLN   2   7.721  11.635  -2.166
  440   1HE2  GLN   2          1HE2      GLN   2   8.576  10.432  -3.685
  441   2HE2  GLN   2          2HE2      GLN   2  10.237   9.978  -3.821
  442    H    TYR   3           H        TYR   3   6.038  12.268  -0.068
  443    HA   TYR   3           HA       TYR   3   6.944  12.429   2.730
  444   1HB   TYR   3          2HB       TYR   3   4.128  12.026   1.709
  445   2HB   TYR   3          1HB       TYR   3   4.609  11.868   3.397
  446    HD1  TYR   3           1HD      TYR   3   4.589  13.735   4.790
  447    HD2  TYR   3           2HD      TYR   3   4.593  14.299   0.573
  448    HE1  TYR   3           1HE      TYR   3   4.250  16.148   5.118
  449    HE2  TYR   3           2HE      TYR   3   4.258  16.714   0.891
  450    HH   TYR   3           HH       TYR   3   4.898  18.368   3.234
  451    H    LYS   4           H        LYS   4   7.031  10.527   3.910
  452    HA   LYS   4           HA       LYS   4   7.218   8.114   2.268
  453   1HB   LYS   4          2HB       LYS   4   9.165   8.722   3.651
  454   2HB   LYS   4          1HB       LYS   4   8.166   8.649   5.089
  455   1HG   LYS   4          2HG       LYS   4   9.500   6.648   4.894
  456   2HG   LYS   4          1HG       LYS   4   7.788   6.265   4.719
  457   1HD   LYS   4          2HD       LYS   4   8.887   5.010   3.056
  458   2HD   LYS   4          1HD       LYS   4   8.169   6.379   2.210
  459   1HE   LYS   4          2HE       LYS   4  11.038   6.260   3.132
  460   2HE   LYS   4          1HE       LYS   4  10.503   5.838   1.507
  461   1HZ   LYS   4          1HZ       LYS   4  10.926   7.982   1.093
  462   2HZ   LYS   4          2HZ       LYS   4  10.856   8.437   2.720
  463   3HZ   LYS   4          3HZ       LYS   4   9.429   8.274   1.825
  464    H    VAL   5           H        VAL   5   5.367   6.994   2.145
  465    HA   VAL   5           HA       VAL   5   3.612   6.886   4.483
  466    HB   VAL   5           HB       VAL   5   3.113   5.964   1.645
  467   1HG1  VAL   5          1HG1      VAL   5   1.335   6.030   4.076
  468   2HG1  VAL   5          2HG1      VAL   5   1.778   4.633   3.097
  469   3HG1  VAL   5          3HG1      VAL   5   0.721   5.878   2.430
  470   1HG2  VAL   5          1HG2      VAL   5   2.691   8.100   1.204
  471   2HG2  VAL   5          2HG2      VAL   5   2.967   8.550   2.886
  472   3HG2  VAL   5          3HG2      VAL   5   1.364   8.035   2.363
  473    H    ILE   6           H        ILE   6   3.844   5.258   5.818
  474    HA   ILE   6           HA       ILE   6   5.079   2.771   4.882
  475    HB   ILE   6           HB       ILE   6   4.673   3.820   7.684
  476   1HG1  ILE   6          2HG1      ILE   6   7.161   3.524   5.987
  477   2HG1  ILE   6          1HG1      ILE   6   6.377   5.040   6.416
  478   1HG2  ILE   6          1HG2      ILE   6   5.948   1.283   6.694
  479   2HG2  ILE   6          2HG2      ILE   6   4.577   1.453   7.794
  480   3HG2  ILE   6          3HG2      ILE   6   6.192   1.934   8.315
  481   1HD1  ILE   6          1HD1      ILE   6   8.349   4.639   7.775
  482   2HD1  ILE   6          2HD1      ILE   6   7.662   3.117   8.341
  483   3HD1  ILE   6          3HD1      ILE   6   6.890   4.644   8.764
  484    H    LEU   7           H        LEU   7   3.914   0.976   4.640
  485    HA   LEU   7           HA       LEU   7   1.212   0.907   5.795
  486   1HB   LEU   7          2HB       LEU   7   2.287  -0.756   3.516
  487   2HB   LEU   7          1HB       LEU   7   0.618  -0.615   4.024
  488    HG   LEU   7           HG       LEU   7   2.263   1.584   2.788
  489   1HD1  LEU   7          1HD1      LEU   7   1.320  -0.496   1.452
  490   2HD1  LEU   7          2HD1      LEU   7   1.268   1.136   0.789
  491   3HD1  LEU   7          3HD1      LEU   7  -0.172   0.439   1.535
  492   1HD2  LEU   7          1HD2      LEU   7  -0.691   1.685   3.211
  493   2HD2  LEU   7          2HD2      LEU   7   0.465   3.006   3.024
  494   3HD2  LEU   7          3HD2      LEU   7   0.393   2.105   4.535
  495    H    ASN   8           H        ASN   8   1.703   0.092   7.805
  496    HA   ASN   8           HA       ASN   8   3.133  -2.464   7.944
  497   1HB   ASN   8          2HB       ASN   8   2.328  -0.557  10.143
  498   2HB   ASN   8          1HB       ASN   8   3.181  -2.074  10.397
  499   1HD2  ASN   8          1HD2      ASN   8   3.660   1.056  10.420
  500   2HD2  ASN   8          2HD2      ASN   8   5.279   1.157   9.828
  501    H    GLY   9           H        GLY   9   1.885  -4.199   7.720
  502   1HA   GLY   9          2HA       GLY   9  -0.708  -4.223   9.138
  503   2HA   GLY   9          1HA       GLY   9  -0.407  -5.094   7.642
  504    H    LYS  10           H        LYS  10  -1.301  -6.853   9.093
  505    HA   LYS  10           HA       LYS  10   0.598  -7.903  11.012
  506   1HB   LYS  10          2HB       LYS  10  -2.115  -8.820  10.073
  507   2HB   LYS  10          1HB       LYS  10  -1.117  -9.799  11.139
  508   1HG   LYS  10          2HG       LYS  10  -2.798  -8.509  12.362
  509   2HG   LYS  10          1HG       LYS  10  -1.154  -8.062  12.823
  510   1HD   LYS  10          2HD       LYS  10  -1.277  -6.088  11.399
  511   2HD   LYS  10          1HD       LYS  10  -2.904  -6.548  10.885
  512   1HE   LYS  10          2HE       LYS  10  -2.064  -5.900  13.709
  513   2HE   LYS  10          1HE       LYS  10  -2.936  -4.814  12.627
  514   1HZ   LYS  10          1HZ       LYS  10  -4.504  -5.848  14.063
  515   2HZ   LYS  10          2HZ       LYS  10  -3.898  -7.392  13.736
  516   3HZ   LYS  10          3HZ       LYS  10  -4.711  -6.531  12.529
  517    H    THR  11           H        THR  11  -0.927  -9.005   8.008
  518    HA   THR  11           HA       THR  11   1.169 -10.999   7.638
  519    HB   THR  11           HB       THR  11  -0.404 -11.658   5.702
  520    HG1  THR  11           1HG      THR  11  -2.626 -10.941   6.292
  521   1HG2  THR  11          1HG2      THR  11  -1.498 -13.152   7.010
  522   2HG2  THR  11          2HG2      THR  11  -1.908 -11.949   8.233
  523   3HG2  THR  11          3HG2      THR  11  -0.279 -12.622   8.171
  524    H    LEU  12           H        LEU  12   0.544  -7.843   6.803
  525    HA   LEU  12           HA       LEU  12   2.325  -8.054   4.491
  526   1HB   LEU  12          2HB       LEU  12   0.054  -7.822   3.625
  527   2HB   LEU  12          1HB       LEU  12  -0.186  -6.383   4.598
  528    HG   LEU  12           HG       LEU  12   1.360  -5.137   3.291
  529   1HD1  LEU  12          1HD1      LEU  12   2.193  -6.711   1.200
  530   2HD1  LEU  12          2HD1      LEU  12   2.330  -7.779   2.593
  531   3HD1  LEU  12          3HD1      LEU  12   3.167  -6.233   2.591
  532   1HD2  LEU  12          1HD2      LEU  12  -0.988  -6.117   2.287
  533   2HD2  LEU  12          2HD2      LEU  12   0.161  -6.495   1.004
  534   3HD2  LEU  12          3HD2      LEU  12  -0.024  -4.831   1.563
  535    H    LYS  13           H        LYS  13   3.885  -6.561   4.386
  536    HA   LYS  13           HA       LYS  13   3.723  -4.135   6.009
  537   1HB   LYS  13          2HB       LYS  13   6.024  -6.090   6.236
  538   2HB   LYS  13          1HB       LYS  13   5.910  -4.530   7.038
  539   1HG   LYS  13          2HG       LYS  13   3.987  -5.313   8.313
  540   2HG   LYS  13          1HG       LYS  13   4.077  -6.875   7.496
  541   1HD   LYS  13          2HD       LYS  13   6.328  -7.213   8.422
  542   2HD   LYS  13          1HD       LYS  13   6.204  -5.666   9.263
  543   1HE   LYS  13          2HE       LYS  13   5.704  -7.522  10.764
  544   2HE   LYS  13          1HE       LYS  13   4.286  -6.501  10.526
  545   1HZ   LYS  13          1HZ       LYS  13   3.168  -8.147   9.519
  546   2HZ   LYS  13          2HZ       LYS  13   4.270  -9.162  10.304
  547   3HZ   LYS  13          3HZ       LYS  13   4.524  -8.729   8.690
  548    H    GLY  14           H        GLY  14   4.990  -2.433   5.198
  549   1HA   GLY  14          2HA       GLY  14   7.061  -2.746   3.319
  550   2HA   GLY  14          1HA       GLY  14   5.556  -2.504   2.451
  551    H    GLU  15           H        GLU  15   6.864  -0.644   1.671
  552    HA   GLU  15           HA       GLU  15   6.152   1.707   3.233
  553   1HB   GLU  15          2HB       GLU  15   8.955   1.212   2.209
  554   2HB   GLU  15          1HB       GLU  15   8.382   2.722   2.904
  555   1HG   GLU  15          2HG       GLU  15   7.958   1.584   5.026
  556   2HG   GLU  15          1HG       GLU  15   8.541   0.074   4.329
  557    H    THR  16           H        THR  16   5.692   3.487   2.018
  558    HA   THR  16           HA       THR  16   6.183   3.410  -0.851
  559    HB   THR  16           HB       THR  16   4.057   2.512  -0.966
  560    HG1  THR  16           1HG      THR  16   3.463   5.250  -0.806
  561   1HG2  THR  16          1HG2      THR  16   2.132   3.308   0.413
  562   2HG2  THR  16          2HG2      THR  16   3.296   4.184   1.402
  563   3HG2  THR  16          3HG2      THR  16   3.379   2.427   1.294
  564    H    THR  17           H        THR  17   5.469   5.571  -1.890
  565    HA   THR  17           HA       THR  17   5.703   7.797  -0.001
  566    HB   THR  17           HB       THR  17   7.495   8.830  -1.350
  567    HG1  THR  17           1HG      THR  17   7.426   6.343  -2.700
  568   1HG2  THR  17          1HG2      THR  17   8.261   6.083  -0.399
  569   2HG2  THR  17          2HG2      THR  17   8.105   7.507   0.625
  570   3HG2  THR  17          3HG2      THR  17   9.336   7.459  -0.634
  571    H    THR  18           H        THR  18   4.266   9.288  -0.432
  572    HA   THR  18           HA       THR  18   3.247   9.616  -3.191
  573    HB   THR  18           HB       THR  18   1.555   8.978  -1.488
  574    HG1  THR  18           1HG      THR  18   1.048  10.392  -3.267
  575   1HG2  THR  18          1HG2      THR  18   1.878   9.804   0.569
  576   2HG2  THR  18          2HG2      THR  18   0.947  11.167  -0.053
  577   3HG2  THR  18          3HG2      THR  18   2.708  11.243  -0.021
  578    H    GLU  19           H        GLU  19   3.133  11.708  -4.062
  579    HA   GLU  19           HA       GLU  19   4.765  13.714  -2.650
  580   1HB   GLU  19          2HB       GLU  19   5.667  13.000  -4.815
  581   2HB   GLU  19          1HB       GLU  19   4.157  13.437  -5.603
  582   1HG   GLU  19          2HG       GLU  19   4.519  15.775  -5.003
  583   2HG   GLU  19          1HG       GLU  19   6.033  15.336  -4.212
  584    H    ALA  20           H        ALA  20   3.626  15.312  -1.714
  585    HA   ALA  20           HA       ALA  20   1.385  16.473  -3.174
  586   1HB   ALA  20          1HB       ALA  20  -0.237  16.047  -1.643
  587   2HB   ALA  20          2HB       ALA  20   0.894  16.004  -0.291
  588   3HB   ALA  20          3HB       ALA  20   0.761  14.618  -1.375
  589    H    VAL  21           H        VAL  21   0.894  18.574  -2.624
  590    HA   VAL  21           HA       VAL  21   2.944  20.295  -2.008
  591    HB   VAL  21           HB       VAL  21   0.041  20.878  -1.430
  592   1HG1  VAL  21          1HG1      VAL  21   0.613  23.020  -1.188
  593   2HG1  VAL  21          2HG1      VAL  21   1.681  22.981  -2.593
  594   3HG1  VAL  21          3HG1      VAL  21   2.270  22.439  -1.022
  595   1HG2  VAL  21          1HG2      VAL  21   1.548  20.754  -4.018
  596   2HG2  VAL  21          2HG2      VAL  21   0.139  21.798  -3.828
  597   3HG2  VAL  21          3HG2      VAL  21  -0.018  20.054  -3.608
  598    H    ASP  22           H        ASP  22   0.885  18.579   0.202
  599    HA   ASP  22           HA       ASP  22   2.554  19.409   2.411
  600   1HB   ASP  22          2HB       ASP  22   0.750  20.270   3.815
  601   2HB   ASP  22          1HB       ASP  22   0.909  21.231   2.348
  602    H    ALA  23           H        ALA  23   1.515  18.446   4.556
  603    HA   ALA  23           HA       ALA  23   1.565  15.660   4.245
  604   1HB   ALA  23          1HB       ALA  23   0.903  17.478   6.521
  605   2HB   ALA  23          2HB       ALA  23   2.260  16.369   6.332
  606   3HB   ALA  23          3HB       ALA  23   0.649  15.739   6.675
  607    H    ALA  24           H        ALA  24  -1.139  17.885   4.737
  608    HA   ALA  24           HA       ALA  24  -3.150  15.930   4.979
  609   1HB   ALA  24          1HB       ALA  24  -4.689  17.662   4.808
  610   2HB   ALA  24          2HB       ALA  24  -3.678  18.588   3.698
  611   3HB   ALA  24          3HB       ALA  24  -3.251  18.491   5.406
  612    H    THR  25           H        THR  25  -2.149  17.842   2.132
  613    HA   THR  25           HA       THR  25  -3.758  16.655   0.232
  614    HB   THR  25           HB       THR  25  -1.949  17.257  -1.384
  615    HG1  THR  25           1HG      THR  25  -0.533  17.584   1.000
  616   1HG2  THR  25          1HG2      THR  25  -3.080  19.153   0.544
  617   2HG2  THR  25          2HG2      THR  25  -3.114  19.164  -1.220
  618   3HG2  THR  25          3HG2      THR  25  -1.679  19.724  -0.361
  619    H    ALA  26           H        ALA  26  -0.590  15.655   1.449
  620    HA   ALA  26           HA       ALA  26  -0.251  13.383  -0.158
  621   1HB   ALA  26          1HB       ALA  26   0.951  12.674   2.193
  622   2HB   ALA  26          2HB       ALA  26   0.916  14.432   2.320
  623   3HB   ALA  26          3HB       ALA  26   1.695  13.663   0.936
  624    H    GLU  27           H        GLU  27  -1.639  13.719   3.121
  625    HA   GLU  27           HA       GLU  27  -2.369  11.122   3.597
  626   1HB   GLU  27          2HB       GLU  27  -2.614  12.833   5.282
  627   2HB   GLU  27          1HB       GLU  27  -3.828  13.660   4.321
  628   1HG   GLU  27          2HG       GLU  27  -4.827  12.439   6.167
  629   2HG   GLU  27          1HG       GLU  27  -5.357  11.804   4.610
  630    H    LYS  28           H        LYS  28  -4.309  13.625   1.957
  631    HA   LYS  28           HA       LYS  28  -6.482  11.922   1.364
  632   1HB   LYS  28          2HB       LYS  28  -5.546  14.570   0.307
  633   2HB   LYS  28          1HB       LYS  28  -6.895  13.734  -0.454
  634   1HG   LYS  28          2HG       LYS  28  -7.464  15.461   1.310
  635   2HG   LYS  28          1HG       LYS  28  -8.221  13.876   1.476
  636   1HD   LYS  28          2HD       LYS  28  -6.551  13.239   3.137
  637   2HD   LYS  28          1HD       LYS  28  -5.759  14.807   2.955
  638   1HE   LYS  28          2HE       LYS  28  -7.174  14.776   4.937
  639   2HE   LYS  28          1HE       LYS  28  -7.783  15.926   3.749
  640   1HZ   LYS  28          1HZ       LYS  28  -9.409  14.264   3.048
  641   2HZ   LYS  28          2HZ       LYS  28  -9.581  14.641   4.688
  642   3HZ   LYS  28          3HZ       LYS  28  -8.839  13.192   4.228
  643    H    VAL  29           H        VAL  29  -3.704  12.980  -0.614
  644    HA   VAL  29           HA       VAL  29  -4.362  11.592  -2.933
  645    HB   VAL  29           HB       VAL  29  -1.587  12.079  -1.826
  646   1HG1  VAL  29          1HG1      VAL  29  -1.744  12.133  -4.680
  647   2HG1  VAL  29          2HG1      VAL  29  -2.408  10.613  -4.084
  648   3HG1  VAL  29          3HG1      VAL  29  -0.772  11.095  -3.637
  649   1HG2  VAL  29          1HG2      VAL  29  -1.684  14.212  -2.523
  650   2HG2  VAL  29          2HG2      VAL  29  -3.431  13.987  -2.433
  651   3HG2  VAL  29          3HG2      VAL  29  -2.596  13.801  -3.975
  652    H    VAL  30           H        VAL  30  -2.664  10.541  -0.035
  653    HA   VAL  30           HA       VAL  30  -2.080   7.912  -0.958
  654    HB   VAL  30           HB       VAL  30  -2.423   8.909   1.884
  655   1HG1  VAL  30          1HG1      VAL  30  -1.298   6.956   2.611
  656   2HG1  VAL  30          2HG1      VAL  30  -0.879   6.498   0.961
  657   3HG1  VAL  30          3HG1      VAL  30  -2.555   6.411   1.501
  658   1HG2  VAL  30          1HG2      VAL  30   0.257   8.399   0.764
  659   2HG2  VAL  30          2HG2      VAL  30  -0.290   9.654   1.877
  660   3HG2  VAL  30          3HG2      VAL  30  -0.588   9.818   0.147
  661    H    LYS  31           H        LYS  31  -4.653   9.310   1.090
  662    HA   LYS  31           HA       LYS  31  -6.173   7.110   1.644
  663   1HB   LYS  31          2HB       LYS  31  -7.051   9.902   0.926
  664   2HB   LYS  31          1HB       LYS  31  -8.183   8.666   1.450
  665   1HG   LYS  31          2HG       LYS  31  -5.854   9.687   3.049
  666   2HG   LYS  31          1HG       LYS  31  -7.540  10.155   3.261
  667   1HD   LYS  31          2HD       LYS  31  -6.826   7.274   3.343
  668   2HD   LYS  31          1HD       LYS  31  -6.449   8.285   4.744
  669   1HE   LYS  31          2HE       LYS  31  -8.616   7.250   5.035
  670   2HE   LYS  31          1HE       LYS  31  -8.812   8.988   4.825
  671   1HZ   LYS  31          1HZ       LYS  31  -9.690   8.725   2.725
  672   2HZ   LYS  31          2HZ       LYS  31 -10.343   7.394   3.539
  673   3HZ   LYS  31          3HZ       LYS  31  -9.020   7.187   2.505
  674    H    GLN  32           H        GLN  32  -6.331   9.120  -1.246
  675    HA   GLN  32           HA       GLN  32  -8.359   7.663  -2.522
  676   1HB   GLN  32          2HB       GLN  32  -7.390   9.973  -3.152
  677   2HB   GLN  32          1HB       GLN  32  -6.189   9.061  -4.063
  678   1HG   GLN  32          2HG       GLN  32  -7.941   9.683  -5.554
  679   2HG   GLN  32          1HG       GLN  32  -8.051   7.944  -5.275
  680   1HE2  GLN  32          1HE2      GLN  32  -9.648   7.195  -3.741
  681   2HE2  GLN  32          2HE2      GLN  32 -11.100   8.098  -3.506
  682    H    PHE  33           H        PHE  33  -4.900   7.212  -2.392
  683    HA   PHE  33           HA       PHE  33  -4.469   5.408  -4.440
  684   1HB   PHE  33          2HB       PHE  33  -2.778   6.434  -2.825
  685   2HB   PHE  33          1HB       PHE  33  -3.230   5.172  -1.690
  686    HD1  PHE  33           1HD      PHE  33  -2.289   5.433  -5.285
  687    HD2  PHE  33           2HD      PHE  33  -1.812   3.367  -1.583
  688    HE1  PHE  33           1HE      PHE  33  -0.667   3.912  -6.337
  689    HE2  PHE  33           2HE      PHE  33  -0.185   1.855  -2.640
  690    HZ   PHE  33           HZ       PHE  33   0.388   2.131  -5.021
  691    H    PHE  34           H        PHE  34  -4.780   4.388  -1.080
  692    HA   PHE  34           HA       PHE  34  -5.456   1.724  -1.655
  693   1HB   PHE  34          2HB       PHE  34  -6.025   3.283   0.866
  694   2HB   PHE  34          1HB       PHE  34  -5.962   1.524   0.716
  695    HD1  PHE  34           1HD      PHE  34  -3.700   0.838  -0.706
  696    HD2  PHE  34           2HD      PHE  34  -4.181   4.143   1.912
  697    HE1  PHE  34           1HE      PHE  34  -1.269   0.904  -0.357
  698    HE2  PHE  34           2HE      PHE  34  -1.751   4.216   2.282
  699    HZ   PHE  34           HZ       PHE  34  -0.298   2.595   1.136
  700    H    ASN  35           H        ASN  35  -7.454   4.558  -1.077
  701    HA   ASN  35           HA       ASN  35  -9.960   3.421  -0.779
  702   1HB   ASN  35          2HB       ASN  35  -9.514   5.834  -0.629
  703   2HB   ASN  35          1HB       ASN  35  -9.191   5.889  -2.359
  704   1HD2  ASN  35          1HD2      ASN  35 -11.312   6.840  -0.264
  705   2HD2  ASN  35          2HD2      ASN  35 -12.791   6.646  -1.136
  706    H    ASP  36           H        ASP  36  -8.056   3.988  -3.645
  707    HA   ASP  36           HA       ASP  36 -10.089   2.818  -5.389
  708   1HB   ASP  36          2HB       ASP  36  -7.462   4.170  -6.029
  709   2HB   ASP  36          1HB       ASP  36  -8.565   3.518  -7.237
  710    H    ASN  37           H        ASN  37  -7.062   1.937  -3.915
  711    HA   ASN  37           HA       ASN  37  -6.537  -0.223  -5.765
  712   1HB   ASN  37          2HB       ASN  37  -5.327   0.379  -3.057
  713   2HB   ASN  37          1HB       ASN  37  -4.763  -0.871  -4.158
  714   1HD2  ASN  37          1HD2      ASN  37  -3.679   1.760  -3.011
  715   2HD2  ASN  37          2HD2      ASN  37  -3.010   2.536  -4.401
  716    H    GLY  38           H        GLY  38  -7.769   0.161  -2.516
  717   1HA   GLY  38          2HA       GLY  38  -8.164  -1.866  -1.128
  718   2HA   GLY  38          1HA       GLY  38  -9.634  -1.147  -1.743
  719    H    VAL  39           H        VAL  39 -11.021  -2.470  -2.614
  720    HA   VAL  39           HA       VAL  39 -10.330  -5.217  -2.988
  721    HB   VAL  39           HB       VAL  39 -12.956  -3.802  -3.339
  722   1HG1  VAL  39          1HG1      VAL  39 -12.377  -6.762  -3.202
  723   2HG1  VAL  39          2HG1      VAL  39 -12.904  -5.880  -4.635
  724   3HG1  VAL  39          3HG1      VAL  39 -13.978  -6.023  -3.243
  725   1HG2  VAL  39          1HG2      VAL  39 -11.465  -4.606  -1.037
  726   2HG2  VAL  39          2HG2      VAL  39 -12.958  -5.540  -1.128
  727   3HG2  VAL  39          3HG2      VAL  39 -13.019  -3.778  -1.125
  728    H    ASP  40           H        ASP  40 -11.832  -2.870  -5.290
  729    HA   ASP  40           HA       ASP  40 -11.387  -4.797  -7.399
  730   1HB   ASP  40          2HB       ASP  40 -12.678  -2.068  -7.450
  731   2HB   ASP  40          1HB       ASP  40 -12.627  -3.188  -8.807
  732    H    GLY  41           H        GLY  41  -9.057  -3.354  -6.153
  733   1HA   GLY  41          2HA       GLY  41  -8.075  -1.451  -8.000
  734   2HA   GLY  41          1HA       GLY  41  -7.103  -2.364  -6.858
  735    H    GLU  42           H        GLU  42  -6.694  -1.613  -9.734
  736    HA   GLU  42           HA       GLU  42  -6.754  -4.118 -11.173
  737   1HB   GLU  42          2HB       GLU  42  -5.457  -1.480 -11.884
  738   2HB   GLU  42          1HB       GLU  42  -5.624  -2.854 -12.967
  739   1HG   GLU  42          2HG       GLU  42  -7.885  -1.278 -11.758
  740   2HG   GLU  42          1HG       GLU  42  -7.296  -1.144 -13.414
  741    H    TRP  43           H        TRP  43  -5.451  -5.561 -10.075
  742    HA   TRP  43           HA       TRP  43  -2.634  -4.803  -9.692
  743   1HB   TRP  43          2HB       TRP  43  -4.055  -7.218  -8.571
  744   2HB   TRP  43          1HB       TRP  43  -2.466  -6.622  -8.127
  745    HD1  TRP  43           HD       TRP  43  -4.909  -3.794  -8.295
  746    HE1  TRP  43           1HE      TRP  43  -5.664  -3.160  -5.914
  747    HE3  TRP  43           3HE      TRP  43  -3.023  -7.798  -5.750
  748    HZ2  TRP  43           2HZ      TRP  43  -5.485  -4.217  -3.320
  749    HZ3  TRP  43           3HZ      TRP  43  -3.352  -7.908  -3.318
  750    HH2  TRP  43           HH       TRP  43  -4.558  -6.152  -2.126
  751    H    THR  44           H        THR  44  -1.031  -5.793 -10.773
  752    HA   THR  44           HA       THR  44  -1.735  -8.084 -12.488
  753    HB   THR  44           HB       THR  44   0.200  -7.369 -13.908
  754    HG1  THR  44           1HG      THR  44   0.093  -4.934 -12.481
  755   1HG2  THR  44          1HG2      THR  44  -2.137  -6.670 -14.432
  756   2HG2  THR  44          2HG2      THR  44  -0.878  -5.603 -15.055
  757   3HG2  THR  44          3HG2      THR  44  -1.793  -5.143 -13.618
  758    H    TYR  45           H        TYR  45  -0.347  -9.881 -12.480
  759    HA   TYR  45           HA       TYR  45   1.601  -9.880 -10.268
  760   1HB   TYR  45          2HB       TYR  45  -0.365 -11.356  -9.966
  761   2HB   TYR  45          1HB       TYR  45   0.082 -12.223 -11.430
  762    HD1  TYR  45           1HD      TYR  45   2.425 -11.006  -8.827
  763    HD2  TYR  45           2HD      TYR  45   0.457 -14.373 -10.528
  764    HE1  TYR  45           1HE      TYR  45   3.846 -12.504  -7.494
  765    HE2  TYR  45           2HE      TYR  45   1.875 -15.879  -9.200
  766    HH   TYR  45           HH       TYR  45   4.433 -15.487  -8.077
  767    H    ASP  46           H        ASP  46   3.618 -10.738 -10.532
  768    HA   ASP  46           HA       ASP  46   4.376 -11.551 -13.260
  769   1HB   ASP  46          2HB       ASP  46   5.224  -9.299 -12.774
  770   2HB   ASP  46          1HB       ASP  46   6.002  -9.898 -11.313
  771    H    ASP  47           H        ASP  47   4.123 -13.743 -12.656
  772    HA   ASP  47           HA       ASP  47   5.065 -15.081 -10.473
  773   1HB   ASP  47          2HB       ASP  47   5.176 -16.076 -13.327
  774   2HB   ASP  47          1HB       ASP  47   5.205 -17.083 -11.884
  775    H    ALA  48           H        ALA  48   6.939 -14.065 -13.285
  776    HA   ALA  48           HA       ALA  48   9.272 -15.457 -12.941
  777   1HB   ALA  48          1HB       ALA  48   8.584 -13.693 -14.713
  778   2HB   ALA  48          2HB       ALA  48  10.290 -13.922 -14.331
  779   3HB   ALA  48          3HB       ALA  48   9.409 -12.558 -13.644
  780    H    THR  49           H        THR  49   8.138 -12.726 -11.054
  781    HA   THR  49           HA       THR  49  10.499 -13.052  -9.324
  782    HB   THR  49           HB       THR  49  10.424 -10.625  -8.856
  783    HG1  THR  49           1HG      THR  49   8.215 -10.323  -9.460
  784   1HG2  THR  49          1HG2      THR  49  11.261  -9.798 -11.000
  785   2HG2  THR  49          2HG2      THR  49  10.698 -11.276 -11.778
  786   3HG2  THR  49          3HG2      THR  49  11.971 -11.351 -10.560
  787    H    LYS  50           H        LYS  50   7.441 -13.806  -9.363
  788    HA   LYS  50           HA       LYS  50   5.718 -13.961  -7.856
  789   1HB   LYS  50          2HB       LYS  50   8.068 -13.945  -5.958
  790   2HB   LYS  50          1HB       LYS  50   6.430 -14.413  -5.522
  791   1HG   LYS  50          2HG       LYS  50   6.936 -15.979  -7.714
  792   2HG   LYS  50          1HG       LYS  50   8.501 -15.919  -6.899
  793   1HD   LYS  50          2HD       LYS  50   7.451 -16.635  -4.813
  794   2HD   LYS  50          1HD       LYS  50   5.879 -16.665  -5.618
  795   1HE   LYS  50          2HE       LYS  50   6.705 -18.396  -7.146
  796   2HE   LYS  50          1HE       LYS  50   8.265 -18.369  -6.325
  797   1HZ   LYS  50          1HZ       LYS  50   6.569 -18.776  -4.285
  798   2HZ   LYS  50          2HZ       LYS  50   7.377 -20.009  -5.113
  799   3HZ   LYS  50          3HZ       LYS  50   5.785 -19.615  -5.528
  800    H    THR  51           H        THR  51   6.360 -11.298  -8.685
  801    HA   THR  51           HA       THR  51   5.683  -9.775  -6.256
  802    HB   THR  51           HB       THR  51   7.101  -8.824  -8.753
  803    HG1  THR  51           1HG      THR  51   8.867  -8.611  -7.307
  804   1HG2  THR  51          1HG2      THR  51   5.632  -7.243  -7.094
  805   2HG2  THR  51          2HG2      THR  51   7.014  -6.712  -8.053
  806   3HG2  THR  51          3HG2      THR  51   7.235  -7.160  -6.362
  807    H    PHE  52           H        PHE  52   3.988  -8.372  -6.288
  808    HA   PHE  52           HA       PHE  52   2.270  -8.437  -8.685
  809   1HB   PHE  52          2HB       PHE  52   1.422  -7.911  -5.828
  810   2HB   PHE  52          1HB       PHE  52   0.368  -8.135  -7.217
  811    HD1  PHE  52           1HD      PHE  52  -0.667 -10.167  -7.406
  812    HD2  PHE  52           2HD      PHE  52   3.117  -9.965  -5.468
  813    HE1  PHE  52           1HE      PHE  52  -0.798 -12.573  -6.904
  814    HE2  PHE  52           2HE      PHE  52   2.993 -12.369  -4.969
  815    HZ   PHE  52           HZ       PHE  52   1.034 -13.677  -5.686
  816    H    THR  53           H        THR  53   1.385  -6.482  -9.427
  817    HA   THR  53           HA       THR  53   2.414  -4.066  -8.108
  818    HB   THR  53           HB       THR  53   2.288  -3.086 -10.517
  819    HG1  THR  53           1HG      THR  53   1.464  -5.379 -11.136
  820   1HG2  THR  53          1HG2      THR  53   4.591  -4.168 -11.032
  821   2HG2  THR  53          2HG2      THR  53   4.435  -4.817  -9.399
  822   3HG2  THR  53          3HG2      THR  53   4.410  -3.072  -9.663
  823    H    VAL  54           H        VAL  54   0.991  -2.583  -7.556
  824    HA   VAL  54           HA       VAL  54  -1.765  -2.845  -8.562
  825    HB   VAL  54           HB       VAL  54  -0.808  -1.549  -5.992
  826   1HG1  VAL  54          1HG1      VAL  54  -3.634  -2.202  -6.199
  827   2HG1  VAL  54          2HG1      VAL  54  -3.127  -1.025  -7.409
  828   3HG1  VAL  54          3HG1      VAL  54  -2.853  -0.702  -5.698
  829   1HG2  VAL  54          1HG2      VAL  54  -1.708  -4.275  -6.677
  830   2HG2  VAL  54          2HG2      VAL  54  -2.385  -3.576  -5.206
  831   3HG2  VAL  54          3HG2      VAL  54  -0.637  -3.719  -5.391
  832    H    THR  55           H        THR  55  -2.204  -1.422 -10.116
  833    HA   THR  55           HA       THR  55  -0.869   1.186 -10.062
  834    HB   THR  55           HB       THR  55  -2.328  -0.143 -12.343
  835    HG1  THR  55           1HG      THR  55  -0.366  -1.192 -11.741
  836   1HG2  THR  55          1HG2      THR  55  -1.003   1.501 -13.707
  837   2HG2  THR  55          2HG2      THR  55  -0.677   2.358 -12.200
  838   3HG2  THR  55          3HG2      THR  55  -2.337   2.175 -12.770
  839    H    GLU  56           H        GLU  56  -1.959   2.871  -9.324
  840    HA   GLU  56           HA       GLU  56  -4.630   2.873  -8.580
  841   1HB   GLU  56          2HB       GLU  56  -2.777   4.514  -7.950
  842   2HB   GLU  56          1HB       GLU  56  -3.134   5.340  -9.459
  843   1HG   GLU  56          2HG       GLU  56  -5.090   4.896  -7.213
  844   2HG   GLU  56          1HG       GLU  56  -4.205   6.388  -7.517
  Start of MODEL   28
    1   1H    MET   1          1HT       MET   1   5.565 -18.702   2.794
    2   2H    MET   1          2HT       MET   1   5.229 -19.560   1.374
    3   3H    MET   1          3HT       MET   1   4.500 -18.059   1.646
    4    HA   MET   1           HA       MET   1   7.428 -18.268   1.557
    5   1HB   MET   1          2HB       MET   1   6.609 -19.410  -0.451
    6   2HB   MET   1          1HB       MET   1   5.568 -18.044  -0.823
    7   1HG   MET   1          2HG       MET   1   7.523 -16.628  -1.142
    8   2HG   MET   1          1HG       MET   1   8.576 -17.984  -0.745
    9   1HE   MET   1          1HE       MET   1   9.428 -16.665  -2.748
   10   2HE   MET   1          2HE       MET   1   8.661 -16.605  -4.335
   11   3HE   MET   1          3HE       MET   1   9.756 -17.929  -3.934
   12    H    GLN   2           H        GLN   2   8.310 -16.223   0.662
   13    HA   GLN   2           HA       GLN   2   6.779 -13.952   1.682
   14   1HB   GLN   2          2HB       GLN   2   9.045 -14.253   2.554
   15   2HB   GLN   2          1HB       GLN   2   9.697 -14.225   0.924
   16   1HG   GLN   2          2HG       GLN   2   8.217 -11.904   2.122
   17   2HG   GLN   2          1HG       GLN   2   9.957 -12.122   2.285
   18   1HE2  GLN   2          1HE2      GLN   2   7.724 -10.507   0.615
   19   2HE2  GLN   2          2HE2      GLN   2   8.549 -10.277  -0.882
   20    H    TYR   3           H        TYR   3   5.897 -12.466   0.361
   21    HA   TYR   3           HA       TYR   3   6.755 -12.446  -2.457
   22   1HB   TYR   3          2HB       TYR   3   3.933 -12.176  -1.401
   23   2HB   TYR   3          1HB       TYR   3   4.405 -11.972  -3.085
   24    HD1  TYR   3           1HD      TYR   3   4.668 -13.839  -4.509
   25    HD2  TYR   3           2HD      TYR   3   4.208 -14.430  -0.321
   26    HE1  TYR   3           1HE      TYR   3   4.383 -16.252  -4.888
   27    HE2  TYR   3           2HE      TYR   3   3.921 -16.845  -0.688
   28    HH   TYR   3           HH       TYR   3   3.526 -18.191  -3.854
   29    H    LYS   4           H        LYS   4   6.921 -10.473  -3.457
   30    HA   LYS   4           HA       LYS   4   6.710  -8.156  -1.658
   31   1HB   LYS   4          2HB       LYS   4   8.952  -8.574  -2.520
   32   2HB   LYS   4          1HB       LYS   4   8.353  -8.520  -4.171
   33   1HG   LYS   4          2HG       LYS   4   7.707  -6.168  -3.831
   34   2HG   LYS   4          1HG       LYS   4   8.396  -6.237  -2.210
   35   1HD   LYS   4          2HD       LYS   4   9.952  -6.776  -4.737
   36   2HD   LYS   4          1HD       LYS   4   9.893  -5.212  -3.925
   37   1HE   LYS   4          2HE       LYS   4  11.889  -6.273  -3.216
   38   2HE   LYS   4          1HE       LYS   4  10.761  -6.365  -1.866
   39   1HZ   LYS   4          1HZ       LYS   4  10.796  -8.575  -1.923
   40   2HZ   LYS   4          2HZ       LYS   4  12.141  -8.447  -2.941
   41   3HZ   LYS   4          3HZ       LYS   4  10.597  -8.639  -3.602
   42    H    VAL   5           H        VAL   5   4.932  -7.004  -1.926
   43    HA   VAL   5           HA       VAL   5   3.648  -6.916  -4.549
   44    HB   VAL   5           HB       VAL   5   2.648  -5.912  -1.879
   45   1HG1  VAL   5          1HG1      VAL   5   1.317  -6.063  -4.578
   46   2HG1  VAL   5          2HG1      VAL   5   1.632  -4.619  -3.617
   47   3HG1  VAL   5          3HG1      VAL   5   0.449  -5.804  -3.066
   48   1HG2  VAL   5          1HG2      VAL   5   0.982  -7.913  -2.556
   49   2HG2  VAL   5          2HG2      VAL   5   2.412  -8.130  -1.546
   50   3HG2  VAL   5          3HG2      VAL   5   2.484  -8.506  -3.268
   51    H    ILE   6           H        ILE   6   3.597  -5.162  -5.794
   52    HA   ILE   6           HA       ILE   6   4.974  -2.753  -4.831
   53    HB   ILE   6           HB       ILE   6   4.596  -3.844  -7.618
   54   1HG1  ILE   6          2HG1      ILE   6   7.072  -3.373  -5.946
   55   2HG1  ILE   6          1HG1      ILE   6   6.335  -4.939  -6.275
   56   1HG2  ILE   6          1HG2      ILE   6   4.647  -1.716  -8.288
   57   2HG2  ILE   6          2HG2      ILE   6   6.362  -1.783  -7.876
   58   3HG2  ILE   6          3HG2      ILE   6   5.203  -1.132  -6.718
   59   1HD1  ILE   6          1HD1      ILE   6   6.706  -4.246  -8.768
   60   2HD1  ILE   6          2HD1      ILE   6   8.029  -4.908  -7.807
   61   3HD1  ILE   6          3HD1      ILE   6   7.913  -3.167  -8.066
   62    H    LEU   7           H        LEU   7   3.814  -0.961  -4.534
   63    HA   LEU   7           HA       LEU   7   1.126  -0.831  -5.711
   64   1HB   LEU   7          2HB       LEU   7   2.146   0.890  -3.461
   65   2HB   LEU   7          1HB       LEU   7   0.485   0.546  -3.902
   66    HG   LEU   7           HG       LEU   7   2.418  -1.403  -2.665
   67   1HD1  LEU   7          1HD1      LEU   7   1.261  -1.147  -0.672
   68   2HD1  LEU   7          2HD1      LEU   7  -0.131  -0.401  -1.458
   69   3HD1  LEU   7          3HD1      LEU   7   1.373   0.503  -1.281
   70   1HD2  LEU   7          1HD2      LEU   7  -0.510  -1.860  -3.120
   71   2HD2  LEU   7          2HD2      LEU   7   0.759  -3.035  -2.768
   72   3HD2  LEU   7          3HD2      LEU   7   0.681  -2.271  -4.354
   73    H    ASN   8           H        ASN   8   1.854  -0.102  -7.724
   74    HA   ASN   8           HA       ASN   8   3.229   2.471  -7.858
   75   1HB   ASN   8          2HB       ASN   8   2.491   0.457  -9.977
   76   2HB   ASN   8          1HB       ASN   8   3.188   2.026 -10.355
   77   1HD2  ASN   8          1HD2      ASN   8   4.549   1.266  -7.500
   78   2HD2  ASN   8          2HD2      ASN   8   5.963   0.450  -8.052
   79    H    GLY   9           H        GLY   9   1.992   4.223  -7.657
   80   1HA   GLY   9          2HA       GLY   9  -0.577   4.259  -9.123
   81   2HA   GLY   9          1HA       GLY   9  -0.303   5.132  -7.624
   82    H    LYS  10           H        LYS  10  -1.145   6.912  -9.020
   83    HA   LYS  10           HA       LYS  10   0.676   7.952 -11.003
   84   1HB   LYS  10          2HB       LYS  10  -1.760   9.271  -9.789
   85   2HB   LYS  10          1HB       LYS  10  -0.936   9.754 -11.263
   86   1HG   LYS  10          2HG       LYS  10  -2.108   7.017 -11.039
   87   2HG   LYS  10          1HG       LYS  10  -3.143   8.401 -11.390
   88   1HD   LYS  10          2HD       LYS  10  -2.448   7.320 -13.450
   89   2HD   LYS  10          1HD       LYS  10  -1.746   8.933 -13.340
   90   1HE   LYS  10          2HE       LYS  10   0.381   8.037 -12.725
   91   2HE   LYS  10          1HE       LYS  10  -0.289   6.413 -12.560
   92   1HZ   LYS  10          1HZ       LYS  10   0.979   6.957 -14.676
   93   2HZ   LYS  10          2HZ       LYS  10  -0.368   7.874 -15.130
   94   3HZ   LYS  10          3HZ       LYS  10  -0.530   6.212 -14.857
   95    H    THR  11           H        THR  11  -0.598   9.093  -7.888
   96    HA   THR  11           HA       THR  11   1.668  10.922  -7.639
   97    HB   THR  11           HB       THR  11   0.230  11.790  -5.699
   98    HG1  THR  11           1HG      THR  11  -1.807  10.383  -7.054
   99   1HG2  THR  11          1HG2      THR  11  -1.559  12.703  -7.413
  100   2HG2  THR  11          2HG2      THR  11  -0.395  12.069  -8.578
  101   3HG2  THR  11          3HG2      THR  11   0.107  13.283  -7.401
  102    H    LEU  12           H        LEU  12   0.906   7.843  -6.761
  103    HA   LEU  12           HA       LEU  12   2.659   8.014  -4.427
  104   1HB   LEU  12          2HB       LEU  12   0.391   7.922  -3.566
  105   2HB   LEU  12          1HB       LEU  12   0.056   6.496  -4.532
  106    HG   LEU  12           HG       LEU  12   1.563   5.176  -3.219
  107   1HD1  LEU  12          1HD1      LEU  12   3.361   6.187  -2.397
  108   2HD1  LEU  12          2HD1      LEU  12   2.330   6.757  -1.081
  109   3HD1  LEU  12          3HD1      LEU  12   2.603   7.770  -2.496
  110   1HD2  LEU  12          1HD2      LEU  12   0.072   4.873  -1.592
  111   2HD2  LEU  12          2HD2      LEU  12  -0.792   6.250  -2.276
  112   3HD2  LEU  12          3HD2      LEU  12   0.333   6.491  -0.941
  113    H    LYS  13           H        LYS  13   4.119   6.443  -4.238
  114    HA   LYS  13           HA       LYS  13   3.871   3.992  -5.800
  115   1HB   LYS  13          2HB       LYS  13   6.251   5.846  -6.049
  116   2HB   LYS  13          1HB       LYS  13   6.124   4.244  -6.764
  117   1HG   LYS  13          2HG       LYS  13   4.260   4.996  -8.144
  118   2HG   LYS  13          1HG       LYS  13   4.365   6.601  -7.415
  119   1HD   LYS  13          2HD       LYS  13   6.638   6.846  -8.297
  120   2HD   LYS  13          1HD       LYS  13   6.525   5.243  -9.027
  121   1HE   LYS  13          2HE       LYS  13   4.654   6.004 -10.407
  122   2HE   LYS  13          1HE       LYS  13   4.762   7.603  -9.674
  123   1HZ   LYS  13          1HZ       LYS  13   6.443   6.377 -11.699
  124   2HZ   LYS  13          2HZ       LYS  13   7.256   7.289 -10.532
  125   3HZ   LYS  13          3HZ       LYS  13   6.039   8.003 -11.464
  126    H    GLY  14           H        GLY  14   5.056   2.250  -4.927
  127   1HA   GLY  14          2HA       GLY  14   7.049   2.577  -2.937
  128   2HA   GLY  14          1HA       GLY  14   5.492   2.296  -2.177
  129    H    GLU  15           H        GLU  15   7.043   0.489  -1.430
  130    HA   GLU  15           HA       GLU  15   6.403  -1.874  -3.040
  131   1HB   GLU  15          2HB       GLU  15   9.103  -1.313  -1.792
  132   2HB   GLU  15          1HB       GLU  15   8.626  -2.846  -2.505
  133   1HG   GLU  15          2HG       GLU  15   9.958  -1.700  -4.092
  134   2HG   GLU  15          1HG       GLU  15   8.293  -1.650  -4.669
  135    H    THR  16           H        THR  16   5.666  -3.556  -1.879
  136    HA   THR  16           HA       THR  16   6.017  -3.518   1.026
  137    HB   THR  16           HB       THR  16   3.890  -2.618   0.970
  138    HG1  THR  16           1HG      THR  16   3.307  -5.357   0.780
  139   1HG2  THR  16          1HG2      THR  16   3.342  -4.294  -1.450
  140   2HG2  THR  16          2HG2      THR  16   3.361  -2.538  -1.319
  141   3HG2  THR  16          3HG2      THR  16   2.076  -3.466  -0.548
  142    H    THR  17           H        THR  17   5.297  -5.651   2.034
  143    HA   THR  17           HA       THR  17   5.584  -7.909   0.197
  144    HB   THR  17           HB       THR  17   7.324  -8.922   1.654
  145    HG1  THR  17           1HG      THR  17   8.363  -7.596   3.143
  146   1HG2  THR  17          1HG2      THR  17   8.167  -7.903  -0.302
  147   2HG2  THR  17          2HG2      THR  17   9.193  -7.376   1.031
  148   3HG2  THR  17          3HG2      THR  17   7.973  -6.286   0.375
  149    H    THR  18           H        THR  18   4.141  -9.406   0.622
  150    HA   THR  18           HA       THR  18   3.054  -9.669   3.362
  151    HB   THR  18           HB       THR  18   1.404  -9.004   1.615
  152    HG1  THR  18           1HG      THR  18   0.802 -10.325   3.415
  153   1HG2  THR  18          1HG2      THR  18   2.028  -9.962  -0.396
  154   2HG2  THR  18          2HG2      THR  18   0.655 -10.947   0.110
  155   3HG2  THR  18          3HG2      THR  18   2.298 -11.549   0.327
  156    H    GLU  19           H        GLU  19   2.889 -11.756   4.245
  157    HA   GLU  19           HA       GLU  19   4.487 -13.802   2.850
  158   1HB   GLU  19          2HB       GLU  19   5.406 -13.089   5.008
  159   2HB   GLU  19          1HB       GLU  19   3.888 -13.494   5.800
  160   1HG   GLU  19          2HG       GLU  19   4.207 -15.843   5.213
  161   2HG   GLU  19          1HG       GLU  19   5.726 -15.435   4.417
  162    H    ALA  20           H        ALA  20   3.331 -15.396   1.942
  163    HA   ALA  20           HA       ALA  20   1.070 -16.507   3.406
  164   1HB   ALA  20          1HB       ALA  20   0.430 -14.637   1.663
  165   2HB   ALA  20          2HB       ALA  20  -0.552 -16.090   1.858
  166   3HB   ALA  20          3HB       ALA  20   0.596 -15.971   0.523
  167    H    VAL  21           H        VAL  21   0.469 -18.575   2.771
  168    HA   VAL  21           HA       VAL  21   2.461 -20.374   2.208
  169    HB   VAL  21           HB       VAL  21  -0.438 -20.807   1.491
  170   1HG1  VAL  21          1HG1      VAL  21   1.620 -22.800   2.424
  171   2HG1  VAL  21          2HG1      VAL  21   1.218 -22.516   0.730
  172   3HG1  VAL  21          3HG1      VAL  21  -0.012 -23.129   1.837
  173   1HG2  VAL  21          1HG2      VAL  21  -0.451 -21.806   3.873
  174   2HG2  VAL  21          2HG2      VAL  21  -0.568 -20.055   3.682
  175   3HG2  VAL  21          3HG2      VAL  21   0.970 -20.793   4.133
  176    H    ASP  22           H        ASP  22   0.625 -18.502  -0.065
  177    HA   ASP  22           HA       ASP  22   2.358 -19.375  -2.199
  178   1HB   ASP  22          2HB       ASP  22   0.627 -20.164  -3.712
  179   2HB   ASP  22          1HB       ASP  22   0.622 -21.128  -2.238
  180    H    ALA  23           H        ALA  23   1.593 -18.294  -4.354
  181    HA   ALA  23           HA       ALA  23   1.681 -15.530  -3.946
  182   1HB   ALA  23          1HB       ALA  23   1.410 -17.318  -6.265
  183   2HB   ALA  23          2HB       ALA  23   2.475 -15.935  -6.013
  184   3HB   ALA  23          3HB       ALA  23   0.797 -15.680  -6.494
  185    H    ALA  24           H        ALA  24  -1.053 -17.642  -4.700
  186    HA   ALA  24           HA       ALA  24  -2.951 -15.575  -5.039
  187   1HB   ALA  24          1HB       ALA  24  -4.627 -17.270  -4.876
  188   2HB   ALA  24          2HB       ALA  24  -3.528 -18.360  -4.029
  189   3HB   ALA  24          3HB       ALA  24  -3.253 -17.973  -5.728
  190    H    THR  25           H        THR  25  -2.256 -17.656  -2.209
  191    HA   THR  25           HA       THR  25  -3.977 -16.505  -0.398
  192    HB   THR  25           HB       THR  25  -2.330 -17.227   1.328
  193    HG1  THR  25           1HG      THR  25  -0.722 -17.482  -0.939
  194   1HG2  THR  25          1HG2      THR  25  -2.081 -19.646   0.489
  195   2HG2  THR  25          2HG2      THR  25  -3.067 -19.101  -0.866
  196   3HG2  THR  25          3HG2      THR  25  -3.696 -19.000   0.778
  197    H    ALA  26           H        ALA  26  -0.695 -15.541  -1.305
  198    HA   ALA  26           HA       ALA  26  -0.462 -13.343   0.427
  199   1HB   ALA  26          1HB       ALA  26   0.813 -13.939  -2.235
  200   2HB   ALA  26          2HB       ALA  26   1.507 -14.149  -0.629
  201   3HB   ALA  26          3HB       ALA  26   1.228 -12.528  -1.263
  202    H    GLU  27           H        GLU  27  -1.530 -13.536  -2.981
  203    HA   GLU  27           HA       GLU  27  -2.085 -10.854  -3.369
  204   1HB   GLU  27          2HB       GLU  27  -2.077 -12.712  -5.092
  205   2HB   GLU  27          1HB       GLU  27  -3.702 -13.104  -4.548
  206   1HG   GLU  27          2HG       GLU  27  -2.902 -10.396  -5.576
  207   2HG   GLU  27          1HG       GLU  27  -3.571 -11.672  -6.592
  208    H    LYS  28           H        LYS  28  -4.183 -13.421  -2.090
  209    HA   LYS  28           HA       LYS  28  -6.453 -11.746  -1.753
  210   1HB   LYS  28          2HB       LYS  28  -5.670 -14.449  -0.718
  211   2HB   LYS  28          1HB       LYS  28  -7.097 -13.642  -0.082
  212   1HG   LYS  28          2HG       LYS  28  -7.369 -15.294  -2.037
  213   2HG   LYS  28          1HG       LYS  28  -8.222 -13.750  -2.105
  214   1HD   LYS  28          2HD       LYS  28  -6.471 -12.834  -3.531
  215   2HD   LYS  28          1HD       LYS  28  -5.590 -14.362  -3.448
  216   1HE   LYS  28          2HE       LYS  28  -8.343 -13.968  -4.617
  217   2HE   LYS  28          1HE       LYS  28  -6.853 -14.176  -5.534
  218   1HZ   LYS  28          1HZ       LYS  28  -8.498 -16.149  -4.230
  219   2HZ   LYS  28          2HZ       LYS  28  -6.847 -16.330  -3.913
  220   3HZ   LYS  28          3HZ       LYS  28  -7.405 -16.327  -5.509
  221    H    VAL  29           H        VAL  29  -3.929 -12.878   0.492
  222    HA   VAL  29           HA       VAL  29  -4.874 -11.621   2.789
  223    HB   VAL  29           HB       VAL  29  -1.999 -12.075   1.957
  224   1HG1  VAL  29          1HG1      VAL  29  -2.215 -10.410   3.753
  225   2HG1  VAL  29          2HG1      VAL  29  -1.443 -11.895   4.310
  226   3HG1  VAL  29          3HG1      VAL  29  -3.133 -11.576   4.705
  227   1HG2  VAL  29          1HG2      VAL  29  -3.898 -13.973   2.371
  228   2HG2  VAL  29          2HG2      VAL  29  -3.228 -13.795   3.994
  229   3HG2  VAL  29          3HG2      VAL  29  -2.171 -14.209   2.644
  230    H    VAL  30           H        VAL  30  -2.866 -10.422   0.159
  231    HA   VAL  30           HA       VAL  30  -2.360  -7.853   1.236
  232    HB   VAL  30           HB       VAL  30  -2.521  -8.700  -1.668
  233   1HG1  VAL  30          1HG1      VAL  30  -2.470  -6.135  -0.718
  234   2HG1  VAL  30          2HG1      VAL  30  -1.880  -6.645  -2.299
  235   3HG1  VAL  30          3HG1      VAL  30  -0.757  -6.480  -0.949
  236   1HG2  VAL  30          1HG2      VAL  30  -0.739  -9.546   0.256
  237   2HG2  VAL  30          2HG2      VAL  30   0.116  -8.222  -0.536
  238   3HG2  VAL  30          3HG2      VAL  30  -0.478  -9.583  -1.488
  239    H    LYS  31           H        LYS  31  -4.904  -9.129  -0.935
  240    HA   LYS  31           HA       LYS  31  -6.275  -6.826  -1.500
  241   1HB   LYS  31          2HB       LYS  31  -7.235  -9.625  -1.049
  242   2HB   LYS  31          1HB       LYS  31  -8.385  -8.333  -1.361
  243   1HG   LYS  31          2HG       LYS  31  -7.044  -7.817  -3.437
  244   2HG   LYS  31          1HG       LYS  31  -6.198  -9.338  -3.148
  245   1HD   LYS  31          2HD       LYS  31  -8.205 -10.594  -3.385
  246   2HD   LYS  31          1HD       LYS  31  -9.194  -9.133  -3.364
  247   1HE   LYS  31          2HE       LYS  31  -8.171  -8.424  -5.481
  248   2HE   LYS  31          1HE       LYS  31  -7.212  -9.902  -5.504
  249   1HZ   LYS  31          1HZ       LYS  31  -9.861 -10.665  -5.169
  250   2HZ   LYS  31          2HZ       LYS  31  -8.885 -10.890  -6.532
  251   3HZ   LYS  31          3HZ       LYS  31  -9.851  -9.507  -6.403
  252    H    GLN  32           H        GLN  32  -6.594  -8.875   1.350
  253    HA   GLN  32           HA       GLN  32  -8.608  -7.414   2.657
  254   1HB   GLN  32          2HB       GLN  32  -7.894  -9.678   3.356
  255   2HB   GLN  32          1HB       GLN  32  -6.359  -9.017   3.900
  256   1HG   GLN  32          2HG       GLN  32  -7.781  -9.362   5.791
  257   2HG   GLN  32          1HG       GLN  32  -7.560  -7.635   5.540
  258   1HE2  GLN  32          1HE2      GLN  32  -9.650  -8.920   3.219
  259   2HE2  GLN  32          2HE2      GLN  32 -11.141  -8.493   3.972
  260    H    PHE  33           H        PHE  33  -5.136  -7.033   2.534
  261    HA   PHE  33           HA       PHE  33  -4.667  -5.207   4.553
  262   1HB   PHE  33          2HB       PHE  33  -2.996  -6.326   2.986
  263   2HB   PHE  33          1HB       PHE  33  -3.402  -5.089   1.805
  264    HD1  PHE  33           1HD      PHE  33  -2.273  -5.427   5.333
  265    HD2  PHE  33           2HD      PHE  33  -2.116  -3.184   1.709
  266    HE1  PHE  33           1HE      PHE  33  -0.582  -3.937   6.320
  267    HE2  PHE  33           2HE      PHE  33  -0.424  -1.701   2.702
  268    HZ   PHE  33           HZ       PHE  33   0.341  -2.083   5.014
  269    H    PHE  34           H        PHE  34  -4.992  -4.293   1.159
  270    HA   PHE  34           HA       PHE  34  -5.571  -1.576   1.674
  271   1HB   PHE  34          2HB       PHE  34  -6.140  -3.178  -0.820
  272   2HB   PHE  34          1HB       PHE  34  -6.073  -1.416  -0.708
  273    HD1  PHE  34           1HD      PHE  34  -3.820  -0.714   0.733
  274    HD2  PHE  34           2HD      PHE  34  -4.286  -4.057  -1.843
  275    HE1  PHE  34           1HE      PHE  34  -1.386  -0.802   0.418
  276    HE2  PHE  34           2HE      PHE  34  -1.854  -4.148  -2.179
  277    HZ   PHE  34           HZ       PHE  34  -0.405  -2.518  -1.033
  278    H    ASN  35           H        ASN  35  -7.639  -4.367   1.129
  279    HA   ASN  35           HA       ASN  35 -10.105  -3.163   0.784
  280   1HB   ASN  35          2HB       ASN  35  -9.750  -5.587   0.676
  281   2HB   ASN  35          1HB       ASN  35  -9.428  -5.630   2.406
  282   1HD2  ASN  35          1HD2      ASN  35 -11.615  -6.449   0.270
  283   2HD2  ASN  35          2HD2      ASN  35 -13.075  -6.218   1.164
  284    H    ASP  36           H        ASP  36  -8.267  -3.733   3.694
  285    HA   ASP  36           HA       ASP  36 -10.305  -2.472   5.367
  286   1HB   ASP  36          2HB       ASP  36  -7.722  -3.840   6.137
  287   2HB   ASP  36          1HB       ASP  36  -8.906  -3.198   7.271
  288    H    ASN  37           H        ASN  37  -7.235  -1.705   3.933
  289    HA   ASN  37           HA       ASN  37  -6.677   0.476   5.748
  290   1HB   ASN  37          2HB       ASN  37  -5.457  -0.206   3.059
  291   2HB   ASN  37          1HB       ASN  37  -4.878   1.061   4.133
  292   1HD2  ASN  37          1HD2      ASN  37  -3.836  -1.626   3.059
  293   2HD2  ASN  37          2HD2      ASN  37  -3.190  -2.380   4.474
  294    H    GLY  38           H        GLY  38  -7.837   0.053   2.475
  295   1HA   GLY  38          2HA       GLY  38  -8.242   2.013   1.030
  296   2HA   GLY  38          1HA       GLY  38  -9.719   1.349   1.686
  297    H    VAL  39           H        VAL  39 -11.080   2.765   2.421
  298    HA   VAL  39           HA       VAL  39 -10.311   5.498   2.715
  299    HB   VAL  39           HB       VAL  39 -13.006   4.234   3.124
  300   1HG1  VAL  39          1HG1      VAL  39 -12.037   7.039   3.157
  301   2HG1  VAL  39          2HG1      VAL  39 -13.342   6.280   4.070
  302   3HG1  VAL  39          3HG1      VAL  39 -13.586   6.716   2.377
  303   1HG2  VAL  39          1HG2      VAL  39 -13.121   5.559   0.756
  304   2HG2  VAL  39          2HG2      VAL  39 -12.806   3.832   0.924
  305   3HG2  VAL  39          3HG2      VAL  39 -11.463   4.960   0.736
  306    H    ASP  40           H        ASP  40 -11.963   3.299   5.047
  307    HA   ASP  40           HA       ASP  40 -11.510   5.282   7.106
  308   1HB   ASP  40          2HB       ASP  40 -12.961   2.635   7.182
  309   2HB   ASP  40          1HB       ASP  40 -12.890   3.787   8.513
  310    H    GLY  41           H        GLY  41  -9.190   3.720   6.033
  311   1HA   GLY  41          2HA       GLY  41  -8.403   1.820   7.989
  312   2HA   GLY  41          1HA       GLY  41  -7.331   2.639   6.861
  313    H    GLU  42           H        GLU  42  -6.900   2.001   9.692
  314    HA   GLU  42           HA       GLU  42  -7.024   4.521  11.107
  315   1HB   GLU  42          2HB       GLU  42  -5.819   1.839  11.789
  316   2HB   GLU  42          1HB       GLU  42  -5.669   3.240  12.837
  317   1HG   GLU  42          2HG       GLU  42  -7.454   1.814  13.600
  318   2HG   GLU  42          1HG       GLU  42  -8.103   3.350  13.035
  319    H    TRP  43           H        TRP  43  -5.764   5.996  10.001
  320    HA   TRP  43           HA       TRP  43  -2.972   5.291   9.472
  321   1HB   TRP  43          2HB       TRP  43  -4.550   7.713   8.601
  322   2HB   TRP  43          1HB       TRP  43  -2.913   7.316   8.100
  323    HD1  TRP  43           HD       TRP  43  -5.467   4.496   8.173
  324    HE1  TRP  43           1HE      TRP  43  -6.024   3.815   5.760
  325    HE3  TRP  43           3HE      TRP  43  -3.050   8.248   5.717
  326    HZ2  TRP  43           2HZ      TRP  43  -5.490   4.744   3.151
  327    HZ3  TRP  43           3HZ      TRP  43  -3.114   8.282   3.263
  328    HH2  TRP  43           HH       TRP  43  -4.307   6.566   2.004
  329    H    THR  44           H        THR  44  -1.412   5.923  10.790
  330    HA   THR  44           HA       THR  44  -1.891   8.214  12.573
  331    HB   THR  44           HB       THR  44  -0.039   7.277  13.949
  332    HG1  THR  44           1HG      THR  44  -0.227   5.024  12.244
  333   1HG2  THR  44          1HG2      THR  44  -2.569   6.507  14.076
  334   2HG2  THR  44          2HG2      THR  44  -1.313   5.804  15.095
  335   3HG2  THR  44          3HG2      THR  44  -1.846   4.958  13.642
  336    H    TYR  45           H        TYR  45  -0.475   9.953  12.516
  337    HA   TYR  45           HA       TYR  45   1.527   9.851  10.358
  338   1HB   TYR  45          2HB       TYR  45  -0.312  11.425   9.959
  339   2HB   TYR  45          1HB       TYR  45   0.054  12.243  11.473
  340    HD1  TYR  45           1HD      TYR  45   2.491  11.000   8.962
  341    HD2  TYR  45           2HD      TYR  45   0.621  14.397  10.717
  342    HE1  TYR  45           1HE      TYR  45   4.066  12.471   7.778
  343    HE2  TYR  45           2HE      TYR  45   2.191  15.877   9.536
  344    HH   TYR  45           HH       TYR  45   4.364  15.809   8.505
  345    H    ASP  46           H        ASP  46   3.581  10.548  10.672
  346    HA   ASP  46           HA       ASP  46   4.313  11.393  13.396
  347   1HB   ASP  46          2HB       ASP  46   5.021   9.070  13.011
  348   2HB   ASP  46          1HB       ASP  46   5.883   9.568  11.558
  349    H    ASP  47           H        ASP  47   4.149  13.572  12.606
  350    HA   ASP  47           HA       ASP  47   5.351  14.683  10.407
  351   1HB   ASP  47          2HB       ASP  47   5.132  15.902  13.167
  352   2HB   ASP  47          1HB       ASP  47   5.436  16.798  11.682
  353    H    ALA  48           H        ALA  48   6.851  13.796  13.458
  354    HA   ALA  48           HA       ALA  48   9.277  15.083  13.291
  355   1HB   ALA  48          1HB       ALA  48   8.938  12.254  14.260
  356   2HB   ALA  48          2HB       ALA  48   8.454  13.676  15.185
  357   3HB   ALA  48          3HB       ALA  48  10.150  13.429  14.768
  358    H    THR  49           H        THR  49   8.197  12.266  11.500
  359    HA   THR  49           HA       THR  49  10.785  12.263  10.090
  360    HB   THR  49           HB       THR  49  10.447   9.853   9.673
  361    HG1  THR  49           1HG      THR  49   8.142  10.284  11.251
  362   1HG2  THR  49          1HG2      THR  49  10.581   9.059  12.087
  363   2HG2  THR  49          2HG2      THR  49  10.477  10.764  12.524
  364   3HG2  THR  49          3HG2      THR  49  11.814  10.189  11.529
  365    H    LYS  50           H        LYS  50   7.887  13.420   9.646
  366    HA   LYS  50           HA       LYS  50   6.455  13.760   7.876
  367   1HB   LYS  50          2HB       LYS  50   9.129  13.423   6.525
  368   2HB   LYS  50          1HB       LYS  50   7.679  13.848   5.629
  369   1HG   LYS  50          2HG       LYS  50   8.556  15.465   7.990
  370   2HG   LYS  50          1HG       LYS  50   9.255  15.723   6.391
  371   1HD   LYS  50          2HD       LYS  50   7.073  16.195   5.466
  372   2HD   LYS  50          1HD       LYS  50   6.300  15.798   7.002
  373   1HE   LYS  50          2HE       LYS  50   6.483  18.225   6.635
  374   2HE   LYS  50          1HE       LYS  50   7.362  17.691   8.067
  375   1HZ   LYS  50          1HZ       LYS  50   9.007  18.901   7.184
  376   2HZ   LYS  50          2HZ       LYS  50   8.349  18.883   5.628
  377   3HZ   LYS  50          3HZ       LYS  50   9.261  17.569   6.174
  378    H    THR  51           H        THR  51   6.536  11.064   8.840
  379    HA   THR  51           HA       THR  51   5.853   9.632   6.364
  380    HB   THR  51           HB       THR  51   7.283   8.536   8.791
  381    HG1  THR  51           1HG      THR  51   8.939   8.155   7.257
  382   1HG2  THR  51          1HG2      THR  51   6.734   6.478   8.220
  383   2HG2  THR  51          2HG2      THR  51   7.310   6.750   6.575
  384   3HG2  THR  51          3HG2      THR  51   5.641   7.129   6.999
  385    H    PHE  52           H        PHE  52   4.033   8.407   6.390
  386    HA   PHE  52           HA       PHE  52   2.375   8.550   8.821
  387   1HB   PHE  52          2HB       PHE  52   1.470   8.087   5.968
  388   2HB   PHE  52          1HB       PHE  52   0.437   8.342   7.368
  389    HD1  PHE  52           1HD      PHE  52  -0.502  10.415   7.585
  390    HD2  PHE  52           2HD      PHE  52   3.263  10.062   5.630
  391    HE1  PHE  52           1HE      PHE  52  -0.519  12.832   7.117
  392    HE2  PHE  52           2HE      PHE  52   3.254  12.475   5.168
  393    HZ   PHE  52           HZ       PHE  52   1.362  13.864   5.911
  394    H    THR  53           H        THR  53   1.330   6.638   9.541
  395    HA   THR  53           HA       THR  53   2.271   4.185   8.225
  396    HB   THR  53           HB       THR  53   2.065   3.193  10.626
  397    HG1  THR  53           1HG      THR  53   2.565   5.918  11.205
  398   1HG2  THR  53          1HG2      THR  53   4.310   4.770   9.492
  399   2HG2  THR  53          2HG2      THR  53   4.188   3.041   9.828
  400   3HG2  THR  53          3HG2      THR  53   4.425   4.185  11.152
  401    H    VAL  54           H        VAL  54   0.823   2.794   7.624
  402    HA   VAL  54           HA       VAL  54  -1.938   3.078   8.607
  403    HB   VAL  54           HB       VAL  54  -0.971   1.789   6.040
  404   1HG1  VAL  54          1HG1      VAL  54  -2.927   0.690   6.278
  405   2HG1  VAL  54          2HG1      VAL  54  -3.609   2.202   5.682
  406   3HG1  VAL  54          3HG1      VAL  54  -3.578   1.870   7.414
  407   1HG2  VAL  54          1HG2      VAL  54  -2.408   4.407   6.471
  408   2HG2  VAL  54          2HG2      VAL  54  -1.985   3.698   4.912
  409   3HG2  VAL  54          3HG2      VAL  54  -0.714   4.222   6.016
  410    H    THR  55           H        THR  55  -2.466   1.584  10.083
  411    HA   THR  55           HA       THR  55  -1.104  -1.014   9.923
  412    HB   THR  55           HB       THR  55  -2.413   0.091  12.396
  413    HG1  THR  55           1HG      THR  55  -0.575   1.091  12.895
  414   1HG2  THR  55          1HG2      THR  55  -0.171  -1.891  12.073
  415   2HG2  THR  55          2HG2      THR  55  -1.858  -2.318  12.369
  416   3HG2  THR  55          3HG2      THR  55  -0.956  -1.403  13.578
  417    H    GLU  56           H        GLU  56  -2.222  -2.728   9.404
  418    HA   GLU  56           HA       GLU  56  -4.929  -2.725   8.769
  419   1HB   GLU  56          2HB       GLU  56  -3.384  -4.386   7.893
  420   2HB   GLU  56          1HB       GLU  56  -3.126  -5.038   9.505
  421   1HG   GLU  56          2HG       GLU  56  -4.604  -6.461   8.222
  422   2HG   GLU  56          1HG       GLU  56  -5.453  -5.756   9.597
  423   1H    MET   1          1HT       MET   1   6.057  18.613  -2.622
  424   2H    MET   1          2HT       MET   1   5.722  19.478  -1.208
  425   3H    MET   1          3HT       MET   1   4.960  17.997  -1.490
  426    HA   MET   1           HA       MET   1   7.891  18.134  -1.358
  427   1HB   MET   1          2HB       MET   1   7.072  19.297   0.636
  428   2HB   MET   1          1HB       MET   1   5.993  17.957   0.994
  429   1HG   MET   1          2HG       MET   1   7.907  16.492   1.340
  430   2HG   MET   1          1HG       MET   1   8.999  17.823   0.959
  431   1HE   MET   1          1HE       MET   1   9.791  16.484   2.973
  432   2HE   MET   1          2HE       MET   1   9.000  16.444   4.549
  433   3HE   MET   1          3HE       MET   1  10.131  17.740   4.164
  434    H    GLN   2           H        GLN   2   8.710  16.068  -0.452
  435    HA   GLN   2           HA       GLN   2   7.140  13.836  -1.495
  436   1HB   GLN   2          2HB       GLN   2   9.423  14.081  -2.333
  437   2HB   GLN   2          1HB       GLN   2  10.053  14.038  -0.694
  438   1HG   GLN   2          2HG       GLN   2   8.532  11.754  -1.913
  439   2HG   GLN   2          1HG       GLN   2  10.281  11.929  -2.054
  440   1HE2  GLN   2          1HE2      GLN   2   7.984  10.370  -0.415
  441   2HE2  GLN   2          2HE2      GLN   2   8.783  10.120   1.095
  442    H    TYR   3           H        TYR   3   6.203  12.372  -0.187
  443    HA   TYR   3           HA       TYR   3   7.020  12.332   2.645
  444   1HB   TYR   3          2HB       TYR   3   4.209  12.130   1.549
  445   2HB   TYR   3          1HB       TYR   3   4.652  11.915   3.238
  446    HD1  TYR   3           1HD      TYR   3   4.940  13.776   4.666
  447    HD2  TYR   3           2HD      TYR   3   4.553  14.377   0.473
  448    HE1  TYR   3           1HE      TYR   3   4.708  16.194   5.041
  449    HE2  TYR   3           2HE      TYR   3   4.320  16.797   0.836
  450    HH   TYR   3           HH       TYR   3   3.913  18.154   3.996
  451    H    LYS   4           H        LYS   4   7.124  10.354   3.646
  452    HA   LYS   4           HA       LYS   4   6.882   8.044   1.844
  453   1HB   LYS   4          2HB       LYS   4   9.121   8.408   2.736
  454   2HB   LYS   4          1HB       LYS   4   8.498   8.369   4.380
  455   1HG   LYS   4          2HG       LYS   4   7.801   6.031   4.029
  456   2HG   LYS   4          1HG       LYS   4   8.513   6.084   2.417
  457   1HD   LYS   4          2HD       LYS   4  10.045   6.585   4.967
  458   2HD   LYS   4          1HD       LYS   4   9.960   5.023   4.155
  459   1HE   LYS   4          2HE       LYS   4  11.991   6.036   3.474
  460   2HE   LYS   4          1HE       LYS   4  10.884   6.154   2.109
  461   1HZ   LYS   4          1HZ       LYS   4  10.974   8.364   2.166
  462   2HZ   LYS   4          2HZ       LYS   4  12.299   8.202   3.204
  463   3HZ   LYS   4          3HZ       LYS   4  10.751   8.431   3.843
  464    H    VAL   5           H        VAL   5   5.073   6.934   2.087
  465    HA   VAL   5           HA       VAL   5   3.751   6.880   4.691
  466    HB   VAL   5           HB       VAL   5   2.764   5.899   2.006
  467   1HG1  VAL   5          1HG1      VAL   5   1.400   6.083   4.687
  468   2HG1  VAL   5          2HG1      VAL   5   1.693   4.632   3.729
  469   3HG1  VAL   5          3HG1      VAL   5   0.547   5.845   3.161
  470   1HG2  VAL   5          1HG2      VAL   5   1.139   7.939   2.661
  471   2HG2  VAL   5          2HG2      VAL   5   2.587   8.122   1.671
  472   3HG2  VAL   5          3HG2      VAL   5   2.644   8.495   3.394
  473    H    ILE   6           H        ILE   6   3.640   5.127   5.934
  474    HA   ILE   6           HA       ILE   6   4.970   2.684   4.990
  475    HB   ILE   6           HB       ILE   6   4.580   3.786   7.773
  476   1HG1  ILE   6          2HG1      ILE   6   7.066   3.254   6.135
  477   2HG1  ILE   6          1HG1      ILE   6   6.364   4.836   6.454
  478   1HG2  ILE   6          1HG2      ILE   6   4.571   1.656   8.443
  479   2HG2  ILE   6          2HG2      ILE   6   6.291   1.682   8.057
  480   3HG2  ILE   6          3HG2      ILE   6   5.134   1.059   6.881
  481   1HD1  ILE   6          1HD1      ILE   6   6.683   4.136   8.951
  482   2HD1  ILE   6          2HD1      ILE   6   8.035   4.766   8.010
  483   3HD1  ILE   6          3HD1      ILE   6   7.873   3.028   8.267
  484    H    LEU   7           H        LEU   7   3.773   0.922   4.676
  485    HA   LEU   7           HA       LEU   7   1.065   0.857   5.814
  486   1HB   LEU   7          2HB       LEU   7   2.074  -0.889   3.580
  487   2HB   LEU   7          1HB       LEU   7   0.417  -0.504   3.999
  488    HG   LEU   7           HG       LEU   7   2.413   1.397   2.790
  489   1HD1  LEU   7          1HD1      LEU   7   1.279   1.169   0.778
  490   2HD1  LEU   7          2HD1      LEU   7  -0.142   0.456   1.546
  491   3HD1  LEU   7          3HD1      LEU   7   1.341  -0.484   1.390
  492   1HD2  LEU   7          1HD2      LEU   7  -0.508   1.924   3.203
  493   2HD2  LEU   7          2HD2      LEU   7   0.793   3.069   2.868
  494   3HD2  LEU   7          3HD2      LEU   7   0.675   2.306   4.453
  495    H    ASN   8           H        ASN   8   1.748   0.111   7.840
  496    HA   ASN   8           HA       ASN   8   3.057  -2.495   7.992
  497   1HB   ASN   8          2HB       ASN   8   2.338  -0.463  10.101
  498   2HB   ASN   8          1HB       ASN   8   2.991  -2.048  10.489
  499   1HD2  ASN   8          1HD2      ASN   8   4.411  -1.321   7.653
  500   2HD2  ASN   8          2HD2      ASN   8   5.836  -0.541   8.226
  501    H    GLY   9           H        GLY   9   1.781  -4.217   7.774
  502   1HA   GLY   9          2HA       GLY   9  -0.809  -4.189   9.203
  503   2HA   GLY   9          1HA       GLY   9  -0.536  -5.070   7.707
  504    H    LYS  10           H        LYS  10  -1.440  -6.828   9.090
  505    HA   LYS  10           HA       LYS  10   0.327  -7.912  11.099
  506   1HB   LYS  10          2HB       LYS  10  -2.123  -9.171   9.850
  507   2HB   LYS  10          1HB       LYS  10  -1.332  -9.673  11.335
  508   1HG   LYS  10          2HG       LYS  10  -2.434  -6.910  11.096
  509   2HG   LYS  10          1HG       LYS  10  -3.508  -8.267  11.432
  510   1HD   LYS  10          2HD       LYS  10  -2.816  -7.203  13.501
  511   2HD   LYS  10          1HD       LYS  10  -2.151  -8.833  13.402
  512   1HE   LYS  10          2HE       LYS  10   0.005  -7.989  12.817
  513   2HE   LYS  10          1HE       LYS  10  -0.622  -6.350  12.643
  514   1HZ   LYS  10          1HZ       LYS  10   0.602  -6.923  14.776
  515   2HZ   LYS  10          2HZ       LYS  10  -0.773  -7.808  15.210
  516   3HZ   LYS  10          3HZ       LYS  10  -0.890  -6.142  14.936
  517    H    THR  11           H        THR  11  -0.929  -9.022   7.967
  518    HA   THR  11           HA       THR  11   1.293 -10.907   7.749
  519    HB   THR  11           HB       THR  11  -0.137 -11.738   5.788
  520    HG1  THR  11           1HG      THR  11  -2.159 -10.282   7.115
  521   1HG2  THR  11          1HG2      THR  11  -1.971 -12.608   7.478
  522   2HG2  THR  11          2HG2      THR  11  -0.810 -12.002   8.658
  523   3HG2  THR  11          3HG2      THR  11  -0.320 -13.229   7.488
  524    H    LEU  12           H        LEU  12   0.619  -7.809   6.861
  525    HA   LEU  12           HA       LEU  12   2.401  -8.022   4.553
  526   1HB   LEU  12          2HB       LEU  12   0.148  -7.876   3.659
  527   2HB   LEU  12          1HB       LEU  12  -0.167  -6.443   4.619
  528    HG   LEU  12           HG       LEU  12   1.391  -5.160   3.328
  529   1HD1  LEU  12          1HD1      LEU  12   3.175  -6.214   2.531
  530   2HD1  LEU  12          2HD1      LEU  12   2.150  -6.759   1.202
  531   3HD1  LEU  12          3HD1      LEU  12   2.378  -7.778   2.620
  532   1HD2  LEU  12          1HD2      LEU  12  -0.068  -4.821   1.681
  533   2HD2  LEU  12          2HD2      LEU  12  -0.975  -6.175   2.353
  534   3HD2  LEU  12          3HD2      LEU  12   0.162  -6.445   1.033
  535    H    LYS  13           H        LYS  13   3.901  -6.487   4.385
  536    HA   LYS  13           HA       LYS  13   3.690  -4.030   5.942
  537   1HB   LYS  13          2HB       LYS  13   6.020  -5.943   6.223
  538   2HB   LYS  13          1HB       LYS  13   5.922  -4.338   6.938
  539   1HG   LYS  13          2HG       LYS  13   4.022  -5.045   8.291
  540   2HG   LYS  13          1HG       LYS  13   4.098  -6.651   7.564
  541   1HD   LYS  13          2HD       LYS  13   6.351  -6.951   8.478
  542   2HD   LYS  13          1HD       LYS  13   6.268  -5.346   9.207
  543   1HE   LYS  13          2HE       LYS  13   4.359  -6.062  10.560
  544   2HE   LYS  13          1HE       LYS  13   4.439  -7.663   9.828
  545   1HZ   LYS  13          1HZ       LYS  13   6.119  -6.476  11.877
  546   2HZ   LYS  13          2HZ       LYS  13   6.928  -7.409  10.722
  547   3HZ   LYS  13          3HZ       LYS  13   5.680  -8.093  11.637
  548    H    GLY  14           H        GLY  14   4.930  -2.319   5.087
  549   1HA   GLY  14          2HA       GLY  14   6.941  -2.693   3.126
  550   2HA   GLY  14          1HA       GLY  14   5.404  -2.376   2.343
  551    H    GLU  15           H        GLU  15   7.009  -0.607   1.619
  552    HA   GLU  15           HA       GLU  15   6.403   1.771   3.221
  553   1HB   GLU  15          2HB       GLU  15   9.105   1.144   2.011
  554   2HB   GLU  15          1HB       GLU  15   8.656   2.688   2.716
  555   1HG   GLU  15          2HG       GLU  15   9.938   1.511   4.322
  556   2HG   GLU  15          1HG       GLU  15   8.264   1.501   4.875
  557    H    THR  16           H        THR  16   5.724   3.470   2.050
  558    HA   THR  16           HA       THR  16   6.114   3.424  -0.851
  559    HB   THR  16           HB       THR  16   3.966   2.575  -0.825
  560    HG1  THR  16           1HG      THR  16   3.447   5.327  -0.642
  561   1HG2  THR  16          1HG2      THR  16   3.424   4.264   1.587
  562   2HG2  THR  16          2HG2      THR  16   3.402   2.509   1.457
  563   3HG2  THR  16          3HG2      THR  16   2.151   3.468   0.666
  564    H    THR  17           H        THR  17   5.461   5.574  -1.869
  565    HA   THR  17           HA       THR  17   5.777   7.823  -0.028
  566    HB   THR  17           HB       THR  17   7.561   8.794  -1.460
  567    HG1  THR  17           1HG      THR  17   8.589   7.442  -2.933
  568   1HG2  THR  17          1HG2      THR  17   8.352   7.755   0.508
  569   2HG2  THR  17          2HG2      THR  17   9.384   7.202  -0.811
  570   3HG2  THR  17          3HG2      THR  17   8.127   6.144  -0.171
  571    H    THR  18           H        THR  18   4.377   9.356  -0.472
  572    HA   THR  18           HA       THR  18   3.336   9.644  -3.228
  573    HB   THR  18           HB       THR  18   1.644   9.021  -1.504
  574    HG1  THR  18           1HG      THR  18   1.100  10.354  -3.313
  575   1HG2  THR  18          1HG2      THR  18   2.264   9.963   0.514
  576   2HG2  THR  18          2HG2      THR  18   0.922  10.980  -0.009
  577   3HG2  THR  18          3HG2      THR  18   2.582  11.542  -0.204
  578    H    GLU  19           H        GLU  19   3.234  11.734  -4.112
  579    HA   GLU  19           HA       GLU  19   4.861  13.741  -2.695
  580   1HB   GLU  19          2HB       GLU  19   5.792  13.006  -4.840
  581   2HB   GLU  19          1HB       GLU  19   4.297  13.447  -5.653
  582   1HG   GLU  19          2HG       GLU  19   4.663  15.787  -5.060
  583   2HG   GLU  19          1HG       GLU  19   6.160  15.344  -4.244
  584    H    ALA  20           H        ALA  20   3.732  15.364  -1.802
  585    HA   ALA  20           HA       ALA  20   1.519  16.529  -3.299
  586   1HB   ALA  20          1HB       ALA  20   0.808  14.674  -1.565
  587   2HB   ALA  20          2HB       ALA  20  -0.134  16.150  -1.773
  588   3HB   ALA  20          3HB       ALA  20   0.991  16.004  -0.422
  589    H    VAL  21           H        VAL  21   0.959  18.610  -2.672
  590    HA   VAL  21           HA       VAL  21   2.987  20.360  -2.081
  591    HB   VAL  21           HB       VAL  21   0.089  20.864  -1.404
  592   1HG1  VAL  21          1HG1      VAL  21   2.208  22.805  -2.308
  593   2HG1  VAL  21          2HG1      VAL  21   1.775  22.531  -0.620
  594   3HG1  VAL  21          3HG1      VAL  21   0.577  23.175  -1.743
  595   1HG2  VAL  21          1HG2      VAL  21   0.134  21.862  -3.785
  596   2HG2  VAL  21          2HG2      VAL  21  -0.029  20.116  -3.597
  597   3HG2  VAL  21          3HG2      VAL  21   1.533  20.815  -4.025
  598    H    ASP  22           H        ASP  22   1.074  18.535   0.166
  599    HA   ASP  22           HA       ASP  22   2.798  19.364   2.326
  600   1HB   ASP  22          2HB       ASP  22   1.064  20.197   3.814
  601   2HB   ASP  22          1HB       ASP  22   1.103  21.160   2.340
  602    H    ALA  23           H        ALA  23   1.975  18.303   4.468
  603    HA   ALA  23           HA       ALA  23   2.002  15.538   4.061
  604   1HB   ALA  23          1HB       ALA  23   1.741  17.332   6.377
  605   2HB   ALA  23          2HB       ALA  23   2.776  15.924   6.141
  606   3HB   ALA  23          3HB       ALA  23   1.086  15.710   6.596
  607    H    ALA  24           H        ALA  24  -0.690  17.716   4.776
  608    HA   ALA  24           HA       ALA  24  -2.643  15.695   5.089
  609   1HB   ALA  24          1HB       ALA  24  -4.275  17.431   4.902
  610   2HB   ALA  24          2HB       ALA  24  -3.139  18.494   4.073
  611   3HB   ALA  24          3HB       ALA  24  -2.897  18.100   5.775
  612    H    THR  25           H        THR  25  -1.857  17.759   2.270
  613    HA   THR  25           HA       THR  25  -3.580  16.649   0.435
  614    HB   THR  25           HB       THR  25  -1.893  17.331  -1.268
  615    HG1  THR  25           1HG      THR  25  -0.309  17.547   1.022
  616   1HG2  THR  25          1HG2      THR  25  -1.595  19.743  -0.426
  617   2HG2  THR  25          2HG2      THR  25  -2.614  19.222   0.916
  618   3HG2  THR  25          3HG2      THR  25  -3.223  19.137  -0.737
  619    H    ALA  26           H        ALA  26  -0.335  15.607   1.388
  620    HA   ALA  26           HA       ALA  26  -0.133  13.403  -0.342
  621   1HB   ALA  26          1HB       ALA  26   1.120  13.968   2.340
  622   2HB   ALA  26          2HB       ALA  26   1.840  14.162   0.741
  623   3HB   ALA  26          3HB       ALA  26   1.514  12.547   1.373
  624    H    GLU  27           H        GLU  27  -1.242  13.622   3.052
  625    HA   GLU  27           HA       GLU  27  -1.869  10.954   3.429
  626   1HB   GLU  27          2HB       GLU  27  -1.840  12.812   5.154
  627   2HB   GLU  27          1HB       GLU  27  -3.446  13.244   4.587
  628   1HG   GLU  27          2HG       GLU  27  -2.727  10.518   5.626
  629   2HG   GLU  27          1HG       GLU  27  -3.379  11.808   6.633
  630    H    LYS  28           H        LYS  28  -3.883  13.571   2.122
  631    HA   LYS  28           HA       LYS  28  -6.190  11.952   1.754
  632   1HB   LYS  28          2HB       LYS  28  -5.327  14.636   0.729
  633   2HB   LYS  28          1HB       LYS  28  -6.764  13.864   0.075
  634   1HG   LYS  28          2HG       LYS  28  -7.024  15.521   2.023
  635   2HG   LYS  28          1HG       LYS  28  -7.915  13.999   2.081
  636   1HD   LYS  28          2HD       LYS  28  -6.207  13.041   3.531
  637   2HD   LYS  28          1HD       LYS  28  -5.288  14.547   3.460
  638   1HE   LYS  28          2HE       LYS  28  -8.066  14.220   4.590
  639   2HE   LYS  28          1HE       LYS  28  -6.583  14.392   5.529
  640   1HZ   LYS  28          1HZ       LYS  28  -8.162  16.405   4.201
  641   2HZ   LYS  28          2HZ       LYS  28  -6.503  16.545   3.907
  642   3HZ   LYS  28          3HZ       LYS  28  -7.083  16.556   5.496
  643    H    VAL  29           H        VAL  29  -3.609  13.023  -0.455
  644    HA   VAL  29           HA       VAL  29  -4.550  11.789  -2.767
  645    HB   VAL  29           HB       VAL  29  -1.676  12.172  -1.894
  646   1HG1  VAL  29          1HG1      VAL  29  -1.908  10.513  -3.692
  647   2HG1  VAL  29          2HG1      VAL  29  -1.093  11.978  -4.238
  648   3HG1  VAL  29          3HG1      VAL  29  -2.783  11.701  -4.658
  649   1HG2  VAL  29          1HG2      VAL  29  -3.522  14.114  -2.335
  650   2HG2  VAL  29          2HG2      VAL  29  -2.835  13.921  -3.946
  651   3HG2  VAL  29          3HG2      VAL  29  -1.788  14.310  -2.583
  652    H    VAL  30           H        VAL  30  -2.608  10.541  -0.108
  653    HA   VAL  30           HA       VAL  30  -2.151   7.961  -1.178
  654    HB   VAL  30           HB       VAL  30  -2.332   8.812   1.723
  655   1HG1  VAL  30          1HG1      VAL  30  -2.330   6.245   0.773
  656   2HG1  VAL  30          2HG1      VAL  30  -1.750   6.742   2.362
  657   3HG1  VAL  30          3HG1      VAL  30  -0.612   6.550   1.030
  658   1HG2  VAL  30          1HG2      VAL  30  -0.502   9.615  -0.175
  659   2HG2  VAL  30          2HG2      VAL  30   0.308   8.270   0.628
  660   3HG2  VAL  30          3HG2      VAL  30  -0.266   9.645   1.572
  661    H    LYS  31           H        LYS  31  -4.694   9.299   0.956
  662    HA   LYS  31           HA       LYS  31  -6.128   7.030   1.501
  663   1HB   LYS  31          2HB       LYS  31  -7.013   9.852   1.039
  664   2HB   LYS  31          1HB       LYS  31  -8.199   8.588   1.334
  665   1HG   LYS  31          2HG       LYS  31  -6.901   8.039   3.427
  666   2HG   LYS  31          1HG       LYS  31  -6.014   9.538   3.151
  667   1HD   LYS  31          2HD       LYS  31  -7.992  10.843   3.360
  668   2HD   LYS  31          1HD       LYS  31  -9.017   9.407   3.325
  669   1HE   LYS  31          2HE       LYS  31  -8.041   8.674   5.456
  670   2HE   LYS  31          1HE       LYS  31  -7.045  10.127   5.493
  671   1HZ   LYS  31          1HZ       LYS  31  -9.671  10.955   5.120
  672   2HZ   LYS  31          2HZ       LYS  31  -8.710  11.156   6.497
  673   3HZ   LYS  31          3HZ       LYS  31  -9.706   9.799   6.355
  674    H    GLN  32           H        GLN  32  -6.357   9.086  -1.353
  675    HA   GLN  32           HA       GLN  32  -8.386   7.673  -2.688
  676   1HB   GLN  32          2HB       GLN  32  -7.609   9.918  -3.376
  677   2HB   GLN  32          1HB       GLN  32  -6.083   9.222  -3.898
  678   1HG   GLN  32          2HG       GLN  32  -7.469   9.600  -5.809
  679   2HG   GLN  32          1HG       GLN  32  -7.294   7.868  -5.557
  680   1HE2  GLN  32          1HE2      GLN  32  -9.384   9.205  -3.264
  681   2HE2  GLN  32          2HE2      GLN  32 -10.873   8.813  -4.037
  682    H    PHE  33           H        PHE  33  -4.927   7.209  -2.515
  683    HA   PHE  33           HA       PHE  33  -4.474   5.371  -4.528
  684   1HB   PHE  33          2HB       PHE  33  -2.799   6.449  -2.938
  685   2HB   PHE  33          1HB       PHE  33  -3.251   5.223  -1.763
  686    HD1  PHE  33           1HD      PHE  33  -2.065   5.533  -5.274
  687    HD2  PHE  33           2HD      PHE  33  -2.013   3.285  -1.649
  688    HE1  PHE  33           1HE      PHE  33  -0.398   4.001  -6.238
  689    HE2  PHE  33           2HE      PHE  33  -0.345   1.764  -2.619
  690    HZ   PHE  33           HZ       PHE  33   0.463   2.126  -4.918
  691    H    PHE  34           H        PHE  34  -4.869   4.465  -1.139
  692    HA   PHE  34           HA       PHE  34  -5.506   1.763  -1.664
  693   1HB   PHE  34          2HB       PHE  34  -6.071   3.379   0.823
  694   2HB   PHE  34          1HB       PHE  34  -6.045   1.616   0.712
  695    HD1  PHE  34           1HD      PHE  34  -3.792   0.859  -0.697
  696    HD2  PHE  34           2HD      PHE  34  -4.212   4.213   1.873
  697    HE1  PHE  34           1HE      PHE  34  -1.360   0.889  -0.347
  698    HE2  PHE  34           2HE      PHE  34  -1.783   4.245   2.243
  699    HZ   PHE  34           HZ       PHE  34  -0.358   2.580   1.116
  700    H    ASN  35           H        ASN  35  -7.513   4.604  -1.148
  701    HA   ASN  35           HA       ASN  35 -10.013   3.460  -0.837
  702   1HB   ASN  35          2HB       ASN  35  -9.600   5.876  -0.723
  703   2HB   ASN  35          1HB       ASN  35  -9.254   5.911  -2.449
  704   1HD2  ASN  35          1HD2      ASN  35 -11.451   6.782  -0.343
  705   2HD2  ASN  35          2HD2      ASN  35 -12.901   6.587  -1.258
  706    H    ASP  36           H        ASP  36  -8.121   3.985  -3.721
  707    HA   ASP  36           HA       ASP  36 -10.164   2.773  -5.422
  708   1HB   ASP  36          2HB       ASP  36  -7.539   4.078  -6.157
  709   2HB   ASP  36          1HB       ASP  36  -8.722   3.465  -7.307
  710    H    ASN  37           H        ASN  37  -7.135   1.932  -3.945
  711    HA   ASN  37           HA       ASN  37  -6.605  -0.261  -5.752
  712   1HB   ASN  37          2HB       ASN  37  -5.406   0.391  -3.047
  713   2HB   ASN  37          1HB       ASN  37  -4.844  -0.889  -4.113
  714   1HD2  ASN  37          1HD2      ASN  37  -3.752   1.772  -3.023
  715   2HD2  ASN  37          2HD2      ASN  37  -3.067   2.510  -4.428
  716    H    GLY  38           H        GLY  38  -7.801   0.190  -2.496
  717   1HA   GLY  38          2HA       GLY  38  -8.273  -1.760  -1.057
  718   2HA   GLY  38          1HA       GLY  38  -9.724  -1.059  -1.733
  719    H    VAL  39           H        VAL  39 -11.108  -2.443  -2.489
  720    HA   VAL  39           HA       VAL  39 -10.402  -5.194  -2.772
  721    HB   VAL  39           HB       VAL  39 -13.058  -3.864  -3.220
  722   1HG1  VAL  39          1HG1      VAL  39 -12.160  -6.694  -3.239
  723   2HG1  VAL  39          2HG1      VAL  39 -13.431  -5.902  -4.170
  724   3HG1  VAL  39          3HG1      VAL  39 -13.710  -6.331  -2.481
  725   1HG2  VAL  39          1HG2      VAL  39 -13.240  -5.186  -0.854
  726   2HG2  VAL  39          2HG2      VAL  39 -12.882  -3.467  -1.016
  727   3HG2  VAL  39          3HG2      VAL  39 -11.569  -4.627  -0.810
  728    H    ASP  40           H        ASP  40 -11.967  -2.956  -5.126
  729    HA   ASP  40           HA       ASP  40 -11.533  -4.949  -7.179
  730   1HB   ASP  40          2HB       ASP  40 -12.917  -2.268  -7.276
  731   2HB   ASP  40          1HB       ASP  40 -12.857  -3.421  -8.605
  732    H    GLY  41           H        GLY  41  -9.192  -3.445  -6.073
  733   1HA   GLY  41          2HA       GLY  41  -8.331  -1.564  -8.017
  734   2HA   GLY  41          1HA       GLY  41  -7.295  -2.409  -6.875
  735    H    GLU  42           H        GLU  42  -6.810  -1.782  -9.700
  736    HA   GLU  42           HA       GLU  42  -6.975  -4.299 -11.116
  737   1HB   GLU  42          2HB       GLU  42  -5.695  -1.646 -11.781
  738   2HB   GLU  42          1HB       GLU  42  -5.564  -3.051 -12.827
  739   1HG   GLU  42          2HG       GLU  42  -7.302  -1.582 -13.614
  740   2HG   GLU  42          1HG       GLU  42  -7.998  -3.102 -13.060
  741    H    TRP  43           H        TRP  43  -5.766  -5.802  -9.993
  742    HA   TRP  43           HA       TRP  43  -2.965  -5.165  -9.424
  743   1HB   TRP  43          2HB       TRP  43  -4.614  -7.549  -8.576
  744   2HB   TRP  43          1HB       TRP  43  -2.976  -7.192  -8.052
  745    HD1  TRP  43           HD       TRP  43  -5.459  -4.310  -8.161
  746    HE1  TRP  43           1HE      TRP  43  -6.035  -3.616  -5.756
  747    HE3  TRP  43           3HE      TRP  43  -3.167  -8.120  -5.671
  748    HZ2  TRP  43           2HZ      TRP  43  -5.559  -4.558  -3.139
  749    HZ3  TRP  43           3HZ      TRP  43  -3.268  -8.153  -3.219
  750    HH2  TRP  43           HH       TRP  43  -4.435  -6.407  -1.976
  751    H    THR  44           H        THR  44  -1.402  -5.835 -10.720
  752    HA   THR  44           HA       THR  44  -1.912  -8.115 -12.511
  753    HB   THR  44           HB       THR  44  -0.018  -7.224 -13.860
  754    HG1  THR  44           1HG      THR  44  -0.176  -4.968 -12.158
  755   1HG2  THR  44          1HG2      THR  44  -2.527  -6.391 -14.023
  756   2HG2  THR  44          2HG2      THR  44  -1.240  -5.720 -15.024
  757   3HG2  THR  44          3HG2      THR  44  -1.773  -4.861 -13.578
  758    H    TYR  45           H        TYR  45  -0.538  -9.888 -12.435
  759    HA   TYR  45           HA       TYR  45   1.432  -9.833 -10.248
  760   1HB   TYR  45          2HB       TYR  45  -0.449 -11.364  -9.875
  761   2HB   TYR  45          1HB       TYR  45  -0.081 -12.190 -11.384
  762    HD1  TYR  45           1HD      TYR  45   2.349 -11.007  -8.840
  763    HD2  TYR  45           2HD      TYR  45   0.423 -14.356 -10.619
  764    HE1  TYR  45           1HE      TYR  45   3.872 -12.515  -7.632
  765    HE2  TYR  45           2HE      TYR  45   1.940 -15.874  -9.418
  766    HH   TYR  45           HH       TYR  45   4.099 -15.859  -8.356
  767    H    ASP  46           H        ASP  46   3.474 -10.581 -10.534
  768    HA   ASP  46           HA       ASP  46   4.225 -11.444 -13.247
  769   1HB   ASP  46          2HB       ASP  46   4.983  -9.140 -12.850
  770   2HB   ASP  46          1HB       ASP  46   5.812  -9.656 -11.386
  771    H    ASP  47           H        ASP  47   3.996 -13.619 -12.461
  772    HA   ASP  47           HA       ASP  47   5.139 -14.758 -10.244
  773   1HB   ASP  47          2HB       ASP  47   4.929 -15.971 -13.007
  774   2HB   ASP  47          1HB       ASP  47   5.191 -16.874 -11.518
  775    H    ALA  48           H        ALA  48   6.704 -13.909 -13.273
  776    HA   ALA  48           HA       ALA  48   9.094 -15.254 -13.072
  777   1HB   ALA  48          1HB       ALA  48   8.837 -12.418 -14.045
  778   2HB   ALA  48          2HB       ALA  48   8.333 -13.827 -14.977
  779   3HB   ALA  48          3HB       ALA  48  10.028 -13.622 -14.537
  780    H    THR  49           H        THR  49   8.058 -12.411 -11.297
  781    HA   THR  49           HA       THR  49  10.626 -12.470  -9.850
  782    HB   THR  49           HB       THR  49  10.339 -10.054  -9.437
  783    HG1  THR  49           1HG      THR  49   8.048 -10.428 -11.047
  784   1HG2  THR  49          1HG2      THR  49  10.527  -9.264 -11.849
  785   2HG2  THR  49          2HG2      THR  49  10.389 -10.965 -12.288
  786   3HG2  THR  49          3HG2      THR  49  11.725 -10.422 -11.273
  787    H    LYS  50           H        LYS  50   7.695 -13.557  -9.447
  788    HA   LYS  50           HA       LYS  50   6.230 -13.861  -7.699
  789   1HB   LYS  50          2HB       LYS  50   8.892 -13.589  -6.309
  790   2HB   LYS  50          1HB       LYS  50   7.420 -13.979  -5.432
  791   1HG   LYS  50          2HG       LYS  50   8.289 -15.616  -7.781
  792   2HG   LYS  50          1HG       LYS  50   8.960 -15.891  -6.174
  793   1HD   LYS  50          2HD       LYS  50   6.754 -16.311  -5.279
  794   2HD   LYS  50          1HD       LYS  50   6.013 -15.896  -6.825
  795   1HE   LYS  50          2HE       LYS  50   6.131 -18.325  -6.455
  796   2HE   LYS  50          1HE       LYS  50   7.043 -17.815  -7.875
  797   1HZ   LYS  50          1HZ       LYS  50   8.647 -19.063  -6.969
  798   2HZ   LYS  50          2HZ       LYS  50   7.967 -19.028  -5.422
  799   3HZ   LYS  50          3HZ       LYS  50   8.917 -17.736  -5.958
  800    H    THR  51           H        THR  51   6.389 -11.169  -8.661
  801    HA   THR  51           HA       THR  51   5.707  -9.720  -6.192
  802    HB   THR  51           HB       THR  51   7.196  -8.659  -8.599
  803    HG1  THR  51           1HG      THR  51   8.839  -8.320  -7.041
  804   1HG2  THR  51          1HG2      THR  51   6.691  -6.589  -8.035
  805   2HG2  THR  51          2HG2      THR  51   7.237  -6.875  -6.383
  806   3HG2  THR  51          3HG2      THR  51   5.563  -7.211  -6.830
  807    H    PHE  52           H        PHE  52   3.918  -8.451  -6.244
  808    HA   PHE  52           HA       PHE  52   2.292  -8.554  -8.698
  809   1HB   PHE  52          2HB       PHE  52   1.357  -8.069  -5.859
  810   2HB   PHE  52          1HB       PHE  52   0.338  -8.299  -7.274
  811    HD1  PHE  52           1HD      PHE  52  -0.647 -10.350  -7.503
  812    HD2  PHE  52           2HD      PHE  52   3.097 -10.086  -5.497
  813    HE1  PHE  52           1HE      PHE  52  -0.730 -12.765  -7.038
  814    HE2  PHE  52           2HE      PHE  52   3.022 -12.500  -5.034
  815    HZ   PHE  52           HZ       PHE  52   1.108 -13.842  -5.805
  816    H    THR  53           H        THR  53   1.304  -6.618  -9.433
  817    HA   THR  53           HA       THR  53   2.284  -4.187  -8.104
  818    HB   THR  53           HB       THR  53   2.137  -3.192 -10.506
  819    HG1  THR  53           1HG      THR  53   2.579  -5.928 -11.080
  820   1HG2  THR  53          1HG2      THR  53   4.326  -4.821  -9.341
  821   2HG2  THR  53          2HG2      THR  53   4.252  -3.090  -9.679
  822   3HG2  THR  53          3HG2      THR  53   4.479  -4.241 -10.999
  823    H    VAL  54           H        VAL  54   0.863  -2.762  -7.522
  824    HA   VAL  54           HA       VAL  54  -1.891  -2.979  -8.545
  825    HB   VAL  54           HB       VAL  54  -0.929  -1.714  -5.965
  826   1HG1  VAL  54          1HG1      VAL  54  -2.855  -0.566  -6.230
  827   2HG1  VAL  54          2HG1      VAL  54  -3.582  -2.061  -5.643
  828   3HG1  VAL  54          3HG1      VAL  54  -3.518  -1.732  -7.375
  829   1HG2  VAL  54          1HG2      VAL  54  -2.423  -4.296  -6.416
  830   2HG2  VAL  54          2HG2      VAL  54  -2.005  -3.597  -4.851
  831   3HG2  VAL  54          3HG2      VAL  54  -0.731  -4.152  -5.936
  832    H    THR  55           H        THR  55  -2.361  -1.472 -10.028
  833    HA   THR  55           HA       THR  55  -0.939   1.092  -9.849
  834    HB   THR  55           HB       THR  55  -2.238   0.019 -12.339
  835    HG1  THR  55           1HG      THR  55  -0.419  -1.026 -12.812
  836   1HG2  THR  55          1HG2      THR  55   0.046   1.945 -11.984
  837   2HG2  THR  55          2HG2      THR  55  -1.626   2.413 -12.304
  838   3HG2  THR  55          3HG2      THR  55  -0.728   1.477 -13.499
  839    H    GLU  56           H        GLU  56  -2.022   2.832  -9.345
  840    HA   GLU  56           HA       GLU  56  -4.736   2.895  -8.749
  841   1HB   GLU  56          2HB       GLU  56  -3.165   4.517  -7.850
  842   2HB   GLU  56          1HB       GLU  56  -2.867   5.164  -9.458
  843   1HG   GLU  56          2HG       GLU  56  -4.330   6.622  -8.196
  844   2HG   GLU  56          1HG       GLU  56  -5.175   5.939  -9.583
  Start of MODEL   29
    1   1H    MET   1          1HT       MET   1   5.617 -18.866   2.476
    2   2H    MET   1          2HT       MET   1   5.362 -19.685   1.019
    3   3H    MET   1          3HT       MET   1   4.561 -18.225   1.321
    4    HA   MET   1           HA       MET   1   7.504 -18.332   1.285
    5   1HB   MET   1          2HB       MET   1   6.319 -19.330  -0.816
    6   2HB   MET   1          1HB       MET   1   5.869 -17.665  -1.152
    7   1HG   MET   1          2HG       MET   1   8.460 -17.278  -0.800
    8   2HG   MET   1          1HG       MET   1   8.525 -18.976  -1.253
    9   1HE   MET   1          1HE       MET   1   7.413 -19.744  -4.026
   10   2HE   MET   1          2HE       MET   1   6.215 -18.556  -4.546
   11   3HE   MET   1          3HE       MET   1   6.113 -19.267  -2.932
   12    H    GLN   2           H        GLN   2   8.331 -16.180   0.606
   13    HA   GLN   2           HA       GLN   2   6.618 -14.051   1.650
   14   1HB   GLN   2          2HB       GLN   2   8.846 -14.270   2.666
   15   2HB   GLN   2          1HB       GLN   2   9.593 -14.082   1.085
   16   1HG   GLN   2          2HG       GLN   2   8.697 -11.819   0.926
   17   2HG   GLN   2          1HG       GLN   2   7.936 -12.008   2.502
   18   1HE2  GLN   2          1HE2      GLN   2  10.793 -13.637   2.698
   19   2HE2  GLN   2          2HE2      GLN   2  11.794 -12.381   3.327
   20    H    TYR   3           H        TYR   3   5.924 -12.387   0.379
   21    HA   TYR   3           HA       TYR   3   6.903 -12.339  -2.398
   22   1HB   TYR   3          2HB       TYR   3   4.040 -12.007  -1.480
   23   2HB   TYR   3          1HB       TYR   3   4.606 -11.804  -3.136
   24    HD1  TYR   3           1HD      TYR   3   4.921 -13.676  -4.554
   25    HD2  TYR   3           2HD      TYR   3   4.163 -14.269  -0.411
   26    HE1  TYR   3           1HE      TYR   3   4.586 -16.077  -4.966
   27    HE2  TYR   3           2HE      TYR   3   3.828 -16.673  -0.810
   28    HH   TYR   3           HH       TYR   3   3.488 -17.985  -3.942
   29    H    LYS   4           H        LYS   4   7.057 -10.354  -3.394
   30    HA   LYS   4           HA       LYS   4   6.837  -8.042  -1.586
   31   1HB   LYS   4          2HB       LYS   4   9.123  -8.486  -2.328
   32   2HB   LYS   4          1HB       LYS   4   8.604  -8.446  -4.008
   33   1HG   LYS   4          2HG       LYS   4   8.008  -6.090  -3.773
   34   2HG   LYS   4          1HG       LYS   4   8.523  -6.127  -2.086
   35   1HD   LYS   4          2HD       LYS   4  10.292  -6.684  -4.467
   36   2HD   LYS   4          1HD       LYS   4  10.238  -5.165  -3.568
   37   1HE   LYS   4          2HE       LYS   4  11.005  -7.860  -2.448
   38   2HE   LYS   4          1HE       LYS   4  12.122  -6.563  -2.869
   39   1HZ   LYS   4          1HZ       LYS   4  10.009  -6.421  -0.786
   40   2HZ   LYS   4          2HZ       LYS   4  11.068  -5.169  -1.195
   41   3HZ   LYS   4          3HZ       LYS   4  11.669  -6.591  -0.504
   42    H    VAL   5           H        VAL   5   4.979  -7.013  -1.964
   43    HA   VAL   5           HA       VAL   5   3.927  -6.889  -4.682
   44    HB   VAL   5           HB       VAL   5   2.675  -5.952  -2.096
   45   1HG1  VAL   5          1HG1      VAL   5   0.882  -5.234  -3.244
   46   2HG1  VAL   5          2HG1      VAL   5   0.975  -6.554  -4.412
   47   3HG1  VAL   5          3HG1      VAL   5   2.006  -5.135  -4.599
   48   1HG2  VAL   5          1HG2      VAL   5   2.540  -8.178  -1.751
   49   2HG2  VAL   5          2HG2      VAL   5   2.768  -8.564  -3.457
   50   3HG2  VAL   5          3HG2      VAL   5   1.185  -8.053  -2.873
   51    H    ILE   6           H        ILE   6   3.878  -5.111  -5.889
   52    HA   ILE   6           HA       ILE   6   5.061  -2.667  -4.753
   53    HB   ILE   6           HB       ILE   6   4.845  -3.449  -7.665
   54   1HG1  ILE   6          2HG1      ILE   6   7.249  -3.445  -5.826
   55   2HG1  ILE   6          1HG1      ILE   6   6.396  -4.884  -6.369
   56   1HG2  ILE   6          1HG2      ILE   6   4.956  -0.955  -6.860
   57   2HG2  ILE   6          2HG2      ILE   6   5.942  -1.504  -8.215
   58   3HG2  ILE   6          3HG2      ILE   6   6.660  -1.330  -6.614
   59   1HD1  ILE   6          1HD1      ILE   6   8.475  -4.452  -7.613
   60   2HD1  ILE   6          2HD1      ILE   6   7.788  -2.931  -8.182
   61   3HD1  ILE   6          3HD1      ILE   6   7.046  -4.461  -8.647
   62    H    LEU   7           H        LEU   7   3.869  -0.891  -4.577
   63    HA   LEU   7           HA       LEU   7   1.159  -0.941  -5.708
   64   1HB   LEU   7          2HB       LEU   7   2.097   0.919  -3.546
   65   2HB   LEU   7          1HB       LEU   7   0.463   0.381  -3.899
   66    HG   LEU   7           HG       LEU   7   2.664  -1.269  -2.668
   67   1HD1  LEU   7          1HD1      LEU   7   1.605   0.401  -1.192
   68   2HD1  LEU   7          2HD1      LEU   7   1.287  -1.260  -0.693
   69   3HD1  LEU   7          3HD1      LEU   7   0.038  -0.332  -1.527
   70   1HD2  LEU   7          1HD2      LEU   7  -0.177  -2.066  -3.290
   71   2HD2  LEU   7          2HD2      LEU   7   1.064  -3.067  -2.532
   72   3HD2  LEU   7          3HD2      LEU   7   1.239  -2.569  -4.213
   73    H    ASN   8           H        ASN   8   1.520  -0.089  -7.755
   74    HA   ASN   8           HA       ASN   8   2.837   2.517  -7.943
   75   1HB   ASN   8          2HB       ASN   8   1.950   0.574 -10.086
   76   2HB   ASN   8          1HB       ASN   8   2.736   2.119 -10.400
   77   1HD2  ASN   8          1HD2      ASN   8   4.812   1.984 -10.765
   78   2HD2  ASN   8          2HD2      ASN   8   5.887   0.782 -10.143
   79    H    GLY   9           H        GLY   9   1.455   4.155  -7.501
   80   1HA   GLY   9          2HA       GLY   9  -1.233   4.026  -8.715
   81   2HA   GLY   9          1HA       GLY   9  -0.830   4.959  -7.282
   82    H    LYS  10           H        LYS  10  -2.006   6.585  -8.659
   83    HA   LYS  10           HA       LYS  10  -0.749   7.652 -10.952
   84   1HB   LYS  10          2HB       LYS  10  -2.816   8.778  -9.069
   85   2HB   LYS  10          1HB       LYS  10  -2.252   9.645 -10.490
   86   1HG   LYS  10          2HG       LYS  10  -3.484   6.908 -10.578
   87   2HG   LYS  10          1HG       LYS  10  -4.391   8.405 -10.797
   88   1HD   LYS  10          2HD       LYS  10  -2.929   8.967 -12.706
   89   2HD   LYS  10          1HD       LYS  10  -2.102   7.422 -12.501
   90   1HE   LYS  10          2HE       LYS  10  -4.181   6.233 -12.936
   91   2HE   LYS  10          1HE       LYS  10  -5.042   7.765 -13.087
   92   1HZ   LYS  10          1HZ       LYS  10  -3.492   6.366 -15.027
   93   2HZ   LYS  10          2HZ       LYS  10  -2.951   7.958 -14.846
   94   3HZ   LYS  10          3HZ       LYS  10  -4.567   7.654 -15.239
   95    H    THR  11           H        THR  11  -0.918   8.846  -7.589
   96    HA   THR  11           HA       THR  11   1.489  10.452  -8.114
   97    HB   THR  11           HB       THR  11   0.544  11.890  -6.231
   98    HG1  THR  11           1HG      THR  11  -1.839  10.538  -6.925
   99   1HG2  THR  11          1HG2      THR  11  -0.280  11.808  -9.003
  100   2HG2  THR  11          2HG2      THR  11   0.132  13.189  -7.984
  101   3HG2  THR  11          3HG2      THR  11  -1.502  12.527  -7.954
  102    H    LEU  12           H        LEU  12   0.915   7.656  -6.927
  103    HA   LEU  12           HA       LEU  12   2.672   8.022  -4.626
  104   1HB   LEU  12          2HB       LEU  12   0.442   7.976  -3.701
  105   2HB   LEU  12          1HB       LEU  12   0.065   6.520  -4.593
  106    HG   LEU  12           HG       LEU  12   1.577   5.231  -3.242
  107   1HD1  LEU  12          1HD1      LEU  12   2.643   7.845  -2.639
  108   2HD1  LEU  12          2HD1      LEU  12   3.391   6.263  -2.480
  109   3HD1  LEU  12          3HD1      LEU  12   2.377   6.894  -1.183
  110   1HD2  LEU  12          1HD2      LEU  12   0.045   5.005  -1.651
  111   2HD2  LEU  12          2HD2      LEU  12  -0.746   6.441  -2.304
  112   3HD2  LEU  12          3HD2      LEU  12   0.415   6.596  -0.985
  113    H    LYS  13           H        LYS  13   4.110   6.399  -4.298
  114    HA   LYS  13           HA       LYS  13   3.859   3.917  -5.810
  115   1HB   LYS  13          2HB       LYS  13   6.355   5.609  -6.006
  116   2HB   LYS  13          1HB       LYS  13   6.041   4.085  -6.823
  117   1HG   LYS  13          2HG       LYS  13   5.644   5.561  -8.516
  118   2HG   LYS  13          1HG       LYS  13   4.021   5.402  -7.841
  119   1HD   LYS  13          2HD       LYS  13   4.388   7.447  -6.523
  120   2HD   LYS  13          1HD       LYS  13   5.989   7.608  -7.240
  121   1HE   LYS  13          2HE       LYS  13   4.978   7.805  -9.456
  122   2HE   LYS  13          1HE       LYS  13   3.376   7.631  -8.744
  123   1HZ   LYS  13          1HZ       LYS  13   5.280   9.830  -8.148
  124   2HZ   LYS  13          2HZ       LYS  13   3.715   9.674  -7.528
  125   3HZ   LYS  13          3HZ       LYS  13   3.945   9.950  -9.180
  126    H    GLY  14           H        GLY  14   5.067   2.190  -4.927
  127   1HA   GLY  14          2HA       GLY  14   6.996   2.545  -2.883
  128   2HA   GLY  14          1HA       GLY  14   5.425   2.237  -2.164
  129    H    GLU  15           H        GLU  15   6.908   0.440  -1.358
  130    HA   GLU  15           HA       GLU  15   6.333  -1.923  -2.973
  131   1HB   GLU  15          2HB       GLU  15   9.049  -1.327  -1.778
  132   2HB   GLU  15          1HB       GLU  15   8.580  -2.855  -2.514
  133   1HG   GLU  15          2HG       GLU  15   8.239  -1.716  -4.651
  134   2HG   GLU  15          1HG       GLU  15   8.726  -0.192  -3.912
  135    H    THR  16           H        THR  16   5.611  -3.581  -1.803
  136    HA   THR  16           HA       THR  16   6.010  -3.552   1.098
  137    HB   THR  16           HB       THR  16   3.869  -2.677   1.047
  138    HG1  THR  16           1HG      THR  16   3.327  -5.430   0.890
  139   1HG2  THR  16          1HG2      THR  16   3.374  -4.357  -1.376
  140   2HG2  THR  16          2HG2      THR  16   3.267  -2.606  -1.205
  141   3HG2  THR  16          3HG2      THR  16   2.057  -3.643  -0.448
  142    H    THR  17           H        THR  17   5.301  -5.700   2.105
  143    HA   THR  17           HA       THR  17   5.621  -7.943   0.261
  144    HB   THR  17           HB       THR  17   7.341  -8.950   1.770
  145    HG1  THR  17           1HG      THR  17   7.657  -7.972   3.578
  146   1HG2  THR  17          1HG2      THR  17   8.254  -8.052  -0.184
  147   2HG2  THR  17          2HG2      THR  17   9.212  -7.360   1.127
  148   3HG2  THR  17          3HG2      THR  17   7.964  -6.393   0.340
  149    H    THR  18           H        THR  18   4.115  -9.384   0.646
  150    HA   THR  18           HA       THR  18   3.041  -9.700   3.384
  151    HB   THR  18           HB       THR  18   1.421  -9.009   1.606
  152    HG1  THR  18           1HG      THR  18   0.776 -10.264   3.426
  153   1HG2  THR  18          1HG2      THR  18   0.630 -10.785   0.050
  154   2HG2  THR  18          2HG2      THR  18   2.098 -11.687   0.428
  155   3HG2  THR  18          3HG2      THR  18   2.208 -10.107  -0.348
  156    H    GLU  19           H        GLU  19   2.905 -11.771   4.266
  157    HA   GLU  19           HA       GLU  19   4.518 -13.822   2.898
  158   1HB   GLU  19          2HB       GLU  19   5.374 -13.152   5.077
  159   2HB   GLU  19          1HB       GLU  19   3.816 -13.476   5.821
  160   1HG   GLU  19          2HG       GLU  19   5.378 -15.251   6.309
  161   2HG   GLU  19          1HG       GLU  19   4.060 -15.850   5.304
  162    H    ALA  20           H        ALA  20   3.371 -15.400   1.914
  163    HA   ALA  20           HA       ALA  20   1.094 -16.553   3.312
  164   1HB   ALA  20          1HB       ALA  20   0.533 -14.620   1.539
  165   2HB   ALA  20          2HB       ALA  20  -0.528 -15.993   1.850
  166   3HB   ALA  20          3HB       ALA  20   0.560 -16.016   0.462
  167    H    VAL  21           H        VAL  21   0.511 -18.601   2.626
  168    HA   VAL  21           HA       VAL  21   2.510 -20.372   1.997
  169    HB   VAL  21           HB       VAL  21  -0.395 -20.804   1.301
  170   1HG1  VAL  21          1HG1      VAL  21   1.661 -22.819   2.177
  171   2HG1  VAL  21          2HG1      VAL  21   1.293 -22.475   0.487
  172   3HG1  VAL  21          3HG1      VAL  21   0.043 -23.126   1.548
  173   1HG2  VAL  21          1HG2      VAL  21  -0.533 -20.136   3.509
  174   2HG2  VAL  21          2HG2      VAL  21   1.042 -20.816   3.923
  175   3HG2  VAL  21          3HG2      VAL  21  -0.340 -21.883   3.663
  176    H    ASP  22           H        ASP  22   0.620 -18.471  -0.213
  177    HA   ASP  22           HA       ASP  22   2.348 -19.263  -2.383
  178   1HB   ASP  22          2HB       ASP  22   0.616 -20.054  -3.896
  179   2HB   ASP  22          1HB       ASP  22   0.655 -21.053  -2.448
  180    H    ALA  23           H        ALA  23   1.531 -18.159  -4.514
  181    HA   ALA  23           HA       ALA  23   1.572 -15.403  -4.065
  182   1HB   ALA  23          1HB       ALA  23   0.674 -15.495  -6.589
  183   2HB   ALA  23          2HB       ALA  23   1.234 -17.159  -6.415
  184   3HB   ALA  23          3HB       ALA  23   2.351 -15.818  -6.148
  185    H    ALA  24           H        ALA  24  -1.122 -17.558  -4.829
  186    HA   ALA  24           HA       ALA  24  -3.079 -15.543  -5.103
  187   1HB   ALA  24          1HB       ALA  24  -3.357 -17.910  -5.841
  188   2HB   ALA  24          2HB       ALA  24  -4.710 -17.301  -4.889
  189   3HB   ALA  24          3HB       ALA  24  -3.522 -18.374  -4.148
  190    H    THR  25           H        THR  25  -2.300 -17.644  -2.319
  191    HA   THR  25           HA       THR  25  -4.022 -16.539  -0.470
  192    HB   THR  25           HB       THR  25  -2.350 -17.286   1.231
  193    HG1  THR  25           1HG      THR  25  -0.774 -17.498  -1.059
  194   1HG2  THR  25          1HG2      THR  25  -2.079 -19.698   0.092
  195   2HG2  THR  25          2HG2      THR  25  -3.388 -19.032  -0.885
  196   3HG2  THR  25          3HG2      THR  25  -3.561 -19.135   0.867
  197    H    ALA  26           H        ALA  26  -0.735 -15.543  -1.371
  198    HA   ALA  26           HA       ALA  26  -0.512 -13.380   0.412
  199   1HB   ALA  26          1HB       ALA  26   0.853 -12.705  -1.973
  200   2HB   ALA  26          2HB       ALA  26   0.987 -14.453  -1.777
  201   3HB   ALA  26          3HB       ALA  26   1.527 -13.376  -0.488
  202    H    GLU  27           H        GLU  27  -1.529 -13.493  -3.008
  203    HA   GLU  27           HA       GLU  27  -2.194 -10.855  -3.396
  204   1HB   GLU  27          2HB       GLU  27  -2.190 -12.508  -5.182
  205   2HB   GLU  27          1HB       GLU  27  -3.558 -13.333  -4.452
  206   1HG   GLU  27          2HG       GLU  27  -4.281 -12.036  -6.341
  207   2HG   GLU  27          1HG       GLU  27  -4.947 -11.362  -4.856
  208    H    LYS  28           H        LYS  28  -4.225 -13.470  -2.117
  209    HA   LYS  28           HA       LYS  28  -6.541 -11.913  -1.718
  210   1HB   LYS  28          2HB       LYS  28  -5.643 -14.430  -0.303
  211   2HB   LYS  28          1HB       LYS  28  -7.262 -13.750  -0.228
  212   1HG   LYS  28          2HG       LYS  28  -5.877 -14.866  -2.653
  213   2HG   LYS  28          1HG       LYS  28  -7.254 -15.558  -1.793
  214   1HD   LYS  28          2HD       LYS  28  -8.609 -13.621  -2.402
  215   2HD   LYS  28          1HD       LYS  28  -7.232 -12.917  -3.250
  216   1HE   LYS  28          2HE       LYS  28  -8.599 -15.520  -3.933
  217   2HE   LYS  28          1HE       LYS  28  -8.773 -13.998  -4.807
  218   1HZ   LYS  28          1HZ       LYS  28  -7.202 -15.477  -5.895
  219   2HZ   LYS  28          2HZ       LYS  28  -6.246 -15.528  -4.500
  220   3HZ   LYS  28          3HZ       LYS  28  -6.423 -14.077  -5.349
  221    H    VAL  29           H        VAL  29  -3.886 -12.825   0.450
  222    HA   VAL  29           HA       VAL  29  -4.860 -11.607   2.768
  223    HB   VAL  29           HB       VAL  29  -1.974 -11.943   1.925
  224   1HG1  VAL  29          1HG1      VAL  29  -1.334 -11.108   3.887
  225   2HG1  VAL  29          2HG1      VAL  29  -2.527 -12.066   4.765
  226   3HG1  VAL  29          3HG1      VAL  29  -2.981 -10.509   4.074
  227   1HG2  VAL  29          1HG2      VAL  29  -3.067 -13.773   3.920
  228   2HG2  VAL  29          2HG2      VAL  29  -2.082 -14.104   2.495
  229   3HG2  VAL  29          3HG2      VAL  29  -3.829 -13.919   2.337
  230    H    VAL  30           H        VAL  30  -2.941 -10.317   0.101
  231    HA   VAL  30           HA       VAL  30  -2.451  -7.768   1.213
  232    HB   VAL  30           HB       VAL  30  -2.846  -8.359  -1.726
  233   1HG1  VAL  30          1HG1      VAL  30  -2.644  -5.965  -0.794
  234   2HG1  VAL  30          2HG1      VAL  30  -1.613  -6.424  -2.149
  235   3HG1  VAL  30          3HG1      VAL  30  -0.952  -6.376  -0.517
  236   1HG2  VAL  30          1HG2      VAL  30  -0.099  -8.350  -1.060
  237   2HG2  VAL  30          2HG2      VAL  30  -1.066  -9.688  -1.682
  238   3HG2  VAL  30          3HG2      VAL  30  -0.903  -9.452   0.058
  239    H    LYS  31           H        LYS  31  -5.100  -9.041  -0.826
  240    HA   LYS  31           HA       LYS  31  -6.560  -6.777  -1.297
  241   1HB   LYS  31          2HB       LYS  31  -7.738  -9.426  -0.444
  242   2HB   LYS  31          1HB       LYS  31  -8.574  -8.159  -1.327
  243   1HG   LYS  31          2HG       LYS  31  -6.474 -10.051  -2.275
  244   2HG   LYS  31          1HG       LYS  31  -8.048  -9.681  -2.973
  245   1HD   LYS  31          2HD       LYS  31  -7.147  -7.365  -3.446
  246   2HD   LYS  31          1HD       LYS  31  -5.559  -7.998  -3.009
  247   1HE   LYS  31          2HE       LYS  31  -5.905  -8.038  -5.430
  248   2HE   LYS  31          1HE       LYS  31  -5.712  -9.660  -4.772
  249   1HZ   LYS  31          1HZ       LYS  31  -7.592  -9.178  -6.457
  250   2HZ   LYS  31          2HZ       LYS  31  -8.409  -8.543  -5.117
  251   3HZ   LYS  31          3HZ       LYS  31  -7.915 -10.160  -5.116
  252    H    GLN  32           H        GLN  32  -6.705  -8.826   1.565
  253    HA   GLN  32           HA       GLN  32  -8.577  -7.308   3.007
  254   1HB   GLN  32          2HB       GLN  32  -8.159  -9.487   3.794
  255   2HB   GLN  32          1HB       GLN  32  -6.426  -9.244   3.849
  256   1HG   GLN  32          2HG       GLN  32  -8.300  -7.727   5.631
  257   2HG   GLN  32          1HG       GLN  32  -7.715  -9.332   6.050
  258   1HE2  GLN  32          1HE2      GLN  32  -5.169  -8.146   4.436
  259   2HE2  GLN  32          2HE2      GLN  32  -4.319  -7.376   5.721
  260    H    PHE  33           H        PHE  33  -5.112  -7.026   2.638
  261    HA   PHE  33           HA       PHE  33  -4.490  -5.209   4.639
  262   1HB   PHE  33          2HB       PHE  33  -2.897  -6.404   3.087
  263   2HB   PHE  33          1HB       PHE  33  -3.327  -5.236   1.844
  264    HD1  PHE  33           1HD      PHE  33  -1.843  -5.576   5.205
  265    HD2  PHE  33           2HD      PHE  33  -2.245  -3.157   1.715
  266    HE1  PHE  33           1HE      PHE  33  -0.088  -4.070   6.034
  267    HE2  PHE  33           2HE      PHE  33  -0.491  -1.652   2.559
  268    HZ   PHE  33           HZ       PHE  33   0.583  -2.117   4.726
  269    H    PHE  34           H        PHE  34  -5.120  -4.427   1.245
  270    HA   PHE  34           HA       PHE  34  -5.484  -1.633   1.735
  271   1HB   PHE  34          2HB       PHE  34  -6.181  -3.292  -0.690
  272   2HB   PHE  34          1HB       PHE  34  -6.180  -1.526  -0.628
  273    HD1  PHE  34           1HD      PHE  34  -3.853  -0.836   0.841
  274    HD2  PHE  34           2HD      PHE  34  -4.383  -3.982  -1.965
  275    HE1  PHE  34           1HE      PHE  34  -1.440  -0.833   0.395
  276    HE2  PHE  34           2HE      PHE  34  -1.966  -3.981  -2.429
  277    HZ   PHE  34           HZ       PHE  34  -0.499  -2.403  -1.232
  278    H    ASN  35           H        ASN  35  -7.663  -4.356   1.314
  279    HA   ASN  35           HA       ASN  35 -10.107  -3.092   1.120
  280   1HB   ASN  35          2HB       ASN  35  -9.788  -5.537   1.025
  281   2HB   ASN  35          1HB       ASN  35  -9.426  -5.552   2.749
  282   1HD2  ASN  35          1HD2      ASN  35 -11.654  -6.450   0.745
  283   2HD2  ASN  35          2HD2      ASN  35 -13.095  -6.135   1.642
  284    H    ASP  36           H        ASP  36  -8.104  -3.688   3.909
  285    HA   ASP  36           HA       ASP  36  -9.996  -2.370   5.697
  286   1HB   ASP  36          2HB       ASP  36  -7.416  -3.834   6.274
  287   2HB   ASP  36          1HB       ASP  36  -8.439  -3.096   7.505
  288    H    ASN  37           H        ASN  37  -7.019  -1.649   4.042
  289    HA   ASN  37           HA       ASN  37  -6.344   0.529   5.831
  290   1HB   ASN  37          2HB       ASN  37  -5.220  -0.241   3.128
  291   2HB   ASN  37          1HB       ASN  37  -4.617   1.091   4.108
  292   1HD2  ASN  37          1HD2      ASN  37  -3.519  -1.579   3.144
  293   2HD2  ASN  37          2HD2      ASN  37  -2.839  -2.274   4.573
  294    H    GLY  38           H        GLY  38  -7.586   0.144   2.554
  295   1HA   GLY  38          2HA       GLY  38  -7.962   2.195   1.198
  296   2HA   GLY  38          1HA       GLY  38  -9.441   1.478   1.795
  297    H    VAL  39           H        VAL  39 -10.820   2.808   2.673
  298    HA   VAL  39           HA       VAL  39  -9.878   5.461   3.531
  299    HB   VAL  39           HB       VAL  39 -12.653   4.631   2.760
  300   1HG1  VAL  39          1HG1      VAL  39 -11.368   7.223   3.460
  301   2HG1  VAL  39          2HG1      VAL  39 -12.965   6.605   3.881
  302   3HG1  VAL  39          3HG1      VAL  39 -12.657   7.218   2.258
  303   1HG2  VAL  39          1HG2      VAL  39 -10.680   6.085   1.012
  304   2HG2  VAL  39          2HG2      VAL  39 -12.266   5.456   0.565
  305   3HG2  VAL  39          3HG2      VAL  39 -10.949   4.344   0.934
  306    H    ASP  40           H        ASP  40 -10.684   2.690   5.130
  307    HA   ASP  40           HA       ASP  40 -11.983   4.232   7.269
  308   1HB   ASP  40          2HB       ASP  40 -12.502   1.349   6.519
  309   2HB   ASP  40          1HB       ASP  40 -13.186   2.173   7.918
  310    H    GLY  41           H        GLY  41  -9.112   3.132   6.552
  311   1HA   GLY  41          2HA       GLY  41  -8.561   1.443   8.835
  312   2HA   GLY  41          1HA       GLY  41  -7.391   2.035   7.667
  313    H    GLU  42           H        GLU  42  -6.510   2.019  10.129
  314    HA   GLU  42           HA       GLU  42  -6.946   4.676  11.300
  315   1HB   GLU  42          2HB       GLU  42  -5.460   2.288  12.420
  316   2HB   GLU  42          1HB       GLU  42  -5.733   3.808  13.260
  317   1HG   GLU  42          2HG       GLU  42  -7.317   2.308  14.116
  318   2HG   GLU  42          1HG       GLU  42  -8.203   3.357  13.013
  319    H    TRP  43           H        TRP  43  -5.701   6.119  10.228
  320    HA   TRP  43           HA       TRP  43  -2.978   5.388   9.485
  321   1HB   TRP  43          2HB       TRP  43  -4.606   7.849   8.851
  322   2HB   TRP  43          1HB       TRP  43  -3.001   7.500   8.219
  323    HD1  TRP  43           HD       TRP  43  -6.056   5.100   8.374
  324    HE1  TRP  43           1HE      TRP  43  -6.537   4.305   5.970
  325    HE3  TRP  43           3HE      TRP  43  -2.563   7.876   5.894
  326    HZ2  TRP  43           2HZ      TRP  43  -5.560   4.799   3.370
  327    HZ3  TRP  43           3HZ      TRP  43  -2.399   7.666   3.455
  328    HH2  TRP  43           HH       TRP  43  -3.869   6.154   2.216
  329    H    THR  44           H        THR  44  -1.336   5.838  10.780
  330    HA   THR  44           HA       THR  44  -1.573   8.072  12.672
  331    HB   THR  44           HB       THR  44   0.395   7.009  13.798
  332    HG1  THR  44           1HG      THR  44   1.059   5.857  11.854
  333   1HG2  THR  44          1HG2      THR  44  -2.010   5.240  13.444
  334   2HG2  THR  44          2HG2      THR  44  -1.766   6.470  14.684
  335   3HG2  THR  44          3HG2      THR  44  -0.764   5.020  14.674
  336    H    TYR  45           H        TYR  45  -0.276   9.828  12.485
  337    HA   TYR  45           HA       TYR  45   1.576   9.863  10.205
  338   1HB   TYR  45          2HB       TYR  45  -0.253  11.482  10.114
  339   2HB   TYR  45          1HB       TYR  45   0.224  12.133  11.678
  340    HD1  TYR  45           1HD      TYR  45   2.563  11.192   8.967
  341    HD2  TYR  45           2HD      TYR  45   0.626  14.370  11.025
  342    HE1  TYR  45           1HE      TYR  45   4.032  12.808   7.839
  343    HE2  TYR  45           2HE      TYR  45   2.086  15.996   9.901
  344    HH   TYR  45           HH       TYR  45   4.070  16.188   8.719
  345    H    ASP  46           H        ASP  46   3.696  10.457  10.401
  346    HA   ASP  46           HA       ASP  46   4.659  11.062  13.121
  347   1HB   ASP  46          2HB       ASP  46   5.256   8.764  12.488
  348   2HB   ASP  46          1HB       ASP  46   6.029   9.362  11.023
  349    H    ASP  47           H        ASP  47   4.491  13.292  12.518
  350    HA   ASP  47           HA       ASP  47   5.599  14.568  10.358
  351   1HB   ASP  47          2HB       ASP  47   5.566  15.560  13.214
  352   2HB   ASP  47          1HB       ASP  47   5.787  16.568  11.788
  353    H    ALA  48           H        ALA  48   7.243  13.420  13.248
  354    HA   ALA  48           HA       ALA  48   9.669  14.680  13.074
  355   1HB   ALA  48          1HB       ALA  48   9.054  13.208  14.909
  356   2HB   ALA  48          2HB       ALA  48  10.621  12.757  14.239
  357   3HB   ALA  48          3HB       ALA  48   9.189  11.808  13.846
  358    H    THR  49           H        THR  49   8.490  12.052  11.062
  359    HA   THR  49           HA       THR  49  10.980  12.254   9.501
  360    HB   THR  49           HB       THR  49  10.782   9.847   8.979
  361    HG1  THR  49           1HG      THR  49   9.061   8.808   9.521
  362   1HG2  THR  49          1HG2      THR  49  12.177   9.516  10.653
  363   2HG2  THR  49          2HG2      THR  49  10.803   9.347  11.746
  364   3HG2  THR  49          3HG2      THR  49  11.541  10.928  11.497
  365    H    LYS  50           H        LYS  50   7.986  13.215   9.333
  366    HA   LYS  50           HA       LYS  50   6.453  13.604   7.667
  367   1HB   LYS  50          2HB       LYS  50   8.847  13.049   5.902
  368   2HB   LYS  50          1HB       LYS  50   7.371  13.856   5.396
  369   1HG   LYS  50          2HG       LYS  50   8.884  14.996   7.684
  370   2HG   LYS  50          1HG       LYS  50   9.532  15.201   6.057
  371   1HD   LYS  50          2HD       LYS  50   8.170  17.109   6.606
  372   2HD   LYS  50          1HD       LYS  50   7.359  16.160   5.363
  373   1HE   LYS  50          2HE       LYS  50   5.840  16.975   7.130
  374   2HE   LYS  50          1HE       LYS  50   5.859  15.223   6.971
  375   1HZ   LYS  50          1HZ       LYS  50   7.569  16.599   8.948
  376   2HZ   LYS  50          2HZ       LYS  50   7.059  14.986   8.937
  377   3HZ   LYS  50          3HZ       LYS  50   5.959  16.218   9.304
  378    H    THR  51           H        THR  51   6.751  10.883   8.668
  379    HA   THR  51           HA       THR  51   6.016   9.319   6.288
  380    HB   THR  51           HB       THR  51   7.122   8.468   8.966
  381    HG1  THR  51           1HG      THR  51   8.533   9.335   7.265
  382   1HG2  THR  51          1HG2      THR  51   5.967   6.571   8.589
  383   2HG2  THR  51          2HG2      THR  51   7.344   6.239   7.540
  384   3HG2  THR  51          3HG2      THR  51   5.843   6.853   6.854
  385    H    PHE  52           H        PHE  52   4.237   7.823   6.450
  386    HA   PHE  52           HA       PHE  52   2.373   8.434   8.647
  387   1HB   PHE  52          2HB       PHE  52   1.562   8.033   5.773
  388   2HB   PHE  52          1HB       PHE  52   0.508   8.412   7.127
  389    HD1  PHE  52           1HD      PHE  52  -0.170  10.587   7.362
  390    HD2  PHE  52           2HD      PHE  52   3.543   9.784   5.443
  391    HE1  PHE  52           1HE      PHE  52   0.101  12.986   6.893
  392    HE2  PHE  52           2HE      PHE  52   3.822  12.181   4.973
  393    HZ   PHE  52           HZ       PHE  52   2.099  13.785   5.696
  394    H    THR  53           H        THR  53   2.725   6.588   9.716
  395    HA   THR  53           HA       THR  53   2.681   4.002   8.487
  396    HB   THR  53           HB       THR  53   2.331   3.241  10.959
  397    HG1  THR  53           1HG      THR  53   2.616   4.717  12.463
  398   1HG2  THR  53          1HG2      THR  53   4.766   4.383   9.723
  399   2HG2  THR  53          2HG2      THR  53   4.408   2.729  10.228
  400   3HG2  THR  53          3HG2      THR  53   4.804   3.956  11.435
  401    H    VAL  54           H        VAL  54   1.056   2.743   7.986
  402    HA   VAL  54           HA       VAL  54  -1.623   3.448   8.992
  403    HB   VAL  54           HB       VAL  54  -0.932   2.219   6.313
  404   1HG1  VAL  54          1HG1      VAL  54  -3.048   1.395   6.862
  405   2HG1  VAL  54          2HG1      VAL  54  -3.389   2.823   5.885
  406   3HG1  VAL  54          3HG1      VAL  54  -3.534   2.901   7.641
  407   1HG2  VAL  54          1HG2      VAL  54  -0.382   4.366   5.869
  408   2HG2  VAL  54          2HG2      VAL  54  -1.331   5.003   7.214
  409   3HG2  VAL  54          3HG2      VAL  54  -2.129   4.545   5.709
  410    H    THR  55           H        THR  55  -2.465   1.973  10.287
  411    HA   THR  55           HA       THR  55  -1.503  -0.792  10.104
  412    HB   THR  55           HB       THR  55  -3.045   0.503  12.357
  413    HG1  THR  55           1HG      THR  55  -0.882   1.346  11.985
  414   1HG2  THR  55          1HG2      THR  55  -3.263  -1.902  12.390
  415   2HG2  THR  55          2HG2      THR  55  -2.203  -1.369  13.695
  416   3HG2  THR  55          3HG2      THR  55  -1.514  -2.085  12.236
  417    H    GLU  56           H        GLU  56  -2.756  -2.117   8.940
  418    HA   GLU  56           HA       GLU  56  -5.253  -1.550   7.959
  419   1HB   GLU  56          2HB       GLU  56  -5.465  -3.859   7.377
  420   2HB   GLU  56          1HB       GLU  56  -3.767  -3.425   7.233
  421   1HG   GLU  56          2HG       GLU  56  -3.853  -5.556   8.231
  422   2HG   GLU  56          1HG       GLU  56  -3.421  -4.419   9.507
  423   1H    MET   1          1HT       MET   1   6.108  18.776  -2.304
  424   2H    MET   1          2HT       MET   1   5.851  19.601  -0.849
  425   3H    MET   1          3HT       MET   1   5.020  18.162  -1.162
  426    HA   MET   1           HA       MET   1   7.964  18.196  -1.085
  427   1HB   MET   1          2HB       MET   1   6.774  19.224   1.000
  428   2HB   MET   1          1HB       MET   1   6.280  17.570   1.329
  429   1HG   MET   1          2HG       MET   1   8.865  17.121   1.012
  430   2HG   MET   1          1HG       MET   1   8.965  18.817   1.466
  431   1HE   MET   1          1HE       MET   1   7.832  19.611   4.224
  432   2HE   MET   1          2HE       MET   1   6.599  18.454   4.727
  433   3HE   MET   1          3HE       MET   1   6.537  19.166   3.113
  434    H    GLN   2           H        GLN   2   8.731  16.025  -0.396
  435    HA   GLN   2           HA       GLN   2   6.981  13.939  -1.465
  436   1HB   GLN   2          2HB       GLN   2   9.228  14.104  -2.448
  437   2HB   GLN   2          1HB       GLN   2   9.947  13.899  -0.856
  438   1HG   GLN   2          2HG       GLN   2   8.994  11.657  -0.710
  439   2HG   GLN   2          1HG       GLN   2   8.261  11.864  -2.298
  440   1HE2  GLN   2          1HE2      GLN   2  11.159  13.422  -2.452
  441   2HE2  GLN   2          2HE2      GLN   2  12.137  12.142  -3.068
  442    H    TYR   3           H        TYR   3   6.228  12.292  -0.203
  443    HA   TYR   3           HA       TYR   3   7.165  12.222   2.588
  444   1HB   TYR   3          2HB       TYR   3   4.309  11.957   1.629
  445   2HB   TYR   3          1HB       TYR   3   4.846  11.743   3.292
  446    HD1  TYR   3           1HD      TYR   3   5.186  13.605   4.717
  447    HD2  TYR   3           2HD      TYR   3   4.502  14.216   0.562
  448    HE1  TYR   3           1HE      TYR   3   4.904  16.014   5.124
  449    HE2  TYR   3           2HE      TYR   3   4.219  16.627   0.957
  450    HH   TYR   3           HH       TYR   3   3.866  17.949   4.084
  451    H    LYS   4           H        LYS   4   7.257  10.232   3.584
  452    HA   LYS   4           HA       LYS   4   7.007   7.925   1.773
  453   1HB   LYS   4          2HB       LYS   4   9.293   8.313   2.548
  454   2HB   LYS   4          1HB       LYS   4   8.750   8.288   4.219
  455   1HG   LYS   4          2HG       LYS   4   8.099   5.946   3.978
  456   2HG   LYS   4          1HG       LYS   4   8.638   5.971   2.298
  457   1HD   LYS   4          2HD       LYS   4  10.387   6.485   4.704
  458   2HD   LYS   4          1HD       LYS   4  10.309   4.969   3.804
  459   1HE   LYS   4          2HE       LYS   4  11.157   7.643   2.695
  460   2HE   LYS   4          1HE       LYS   4  12.236   6.319   3.131
  461   1HZ   LYS   4          1HZ       LYS   4  10.150   6.229   1.018
  462   2HZ   LYS   4          2HZ       LYS   4  11.173   4.951   1.441
  463   3HZ   LYS   4          3HZ       LYS   4  11.817   6.357   0.757
  464    H    VAL   5           H        VAL   5   5.119   6.942   2.125
  465    HA   VAL   5           HA       VAL   5   4.028   6.845   4.826
  466    HB   VAL   5           HB       VAL   5   2.790   5.939   2.225
  467   1HG1  VAL   5          1HG1      VAL   5   0.963   5.264   3.346
  468   2HG1  VAL   5          2HG1      VAL   5   1.071   6.580   4.516
  469   3HG1  VAL   5          3HG1      VAL   5   2.065   5.139   4.717
  470   1HG2  VAL   5          1HG2      VAL   5   2.714   8.166   1.878
  471   2HG2  VAL   5          2HG2      VAL   5   2.926   8.548   3.588
  472   3HG2  VAL   5          3HG2      VAL   5   1.340   8.076   2.980
  473    H    ILE   6           H        ILE   6   3.917   5.067   6.033
  474    HA   ILE   6           HA       ILE   6   5.055   2.596   4.914
  475    HB   ILE   6           HB       ILE   6   4.819   3.383   7.824
  476   1HG1  ILE   6          2HG1      ILE   6   7.247   3.321   6.019
  477   2HG1  ILE   6          1HG1      ILE   6   6.422   4.781   6.549
  478   1HG2  ILE   6          1HG2      ILE   6   4.879   0.887   7.020
  479   2HG2  ILE   6          2HG2      ILE   6   5.861   1.412   8.388
  480   3HG2  ILE   6          3HG2      ILE   6   6.596   1.221   6.796
  481   1HD1  ILE   6          1HD1      ILE   6   8.471   4.299   7.822
  482   2HD1  ILE   6          2HD1      ILE   6   7.740   2.794   8.381
  483   3HD1  ILE   6          3HD1      ILE   6   7.029   4.343   8.835
  484    H    LEU   7           H        LEU   7   3.824   0.850   4.721
  485    HA   LEU   7           HA       LEU   7   1.099   0.967   5.814
  486   1HB   LEU   7          2HB       LEU   7   2.023  -0.917   3.665
  487   2HB   LEU   7          1HB       LEU   7   0.399  -0.339   3.995
  488    HG   LEU   7           HG       LEU   7   2.655   1.258   2.796
  489   1HD1  LEU   7          1HD1      LEU   7   1.579  -0.387   1.303
  490   2HD1  LEU   7          2HD1      LEU   7   1.308   1.281   0.802
  491   3HD1  LEU   7          3HD1      LEU   7   0.024   0.385   1.616
  492   1HD2  LEU   7          1HD2      LEU   7  -0.174   2.123   3.378
  493   2HD2  LEU   7          2HD2      LEU   7   1.101   3.092   2.636
  494   3HD2  LEU   7          3HD2      LEU   7   1.241   2.591   4.321
  495    H    ASN   8           H        ASN   8   1.413   0.106   7.865
  496    HA   ASN   8           HA       ASN   8   2.663  -2.530   8.071
  497   1HB   ASN   8          2HB       ASN   8   1.792  -0.567  10.201
  498   2HB   ASN   8          1HB       ASN   8   2.536  -2.130  10.526
  499   1HD2  ASN   8          1HD2      ASN   8   4.611  -2.046  10.921
  500   2HD2  ASN   8          2HD2      ASN   8   5.722  -0.872  10.314
  501    H    GLY   9           H        GLY   9   1.247  -4.136   7.610
  502   1HA   GLY   9          2HA       GLY   9  -1.453  -3.941   8.784
  503   2HA   GLY   9          1HA       GLY   9  -1.052  -4.883   7.357
  504    H    LYS  10           H        LYS  10  -2.288  -6.480   8.717
  505    HA   LYS  10           HA       LYS  10  -1.089  -7.577  11.027
  506   1HB   LYS  10          2HB       LYS  10  -3.156  -8.653   9.115
  507   2HB   LYS  10          1HB       LYS  10  -2.635  -9.533  10.545
  508   1HG   LYS  10          2HG       LYS  10  -3.801  -6.766  10.616
  509   2HG   LYS  10          1HG       LYS  10  -4.746  -8.243  10.821
  510   1HD   LYS  10          2HD       LYS  10  -3.327  -8.839  12.751
  511   2HD   LYS  10          1HD       LYS  10  -2.459  -7.314  12.559
  512   1HE   LYS  10          2HE       LYS  10  -4.514  -6.076  12.963
  513   2HE   LYS  10          1HE       LYS  10  -5.413  -7.585  13.102
  514   1HZ   LYS  10          1HZ       LYS  10  -3.858  -6.226  15.065
  515   2HZ   LYS  10          2HZ       LYS  10  -3.353  -7.831  14.891
  516   3HZ   LYS  10          3HZ       LYS  10  -4.968  -7.488  15.259
  517    H    THR  11           H        THR  11  -1.240  -8.768   7.663
  518    HA   THR  11           HA       THR  11   1.119 -10.431   8.222
  519    HB   THR  11           HB       THR  11   0.167 -11.844   6.324
  520    HG1  THR  11           1HG      THR  11  -2.193 -10.437   6.987
  521   1HG2  THR  11          1HG2      THR  11  -0.695 -11.745   9.085
  522   2HG2  THR  11          2HG2      THR  11  -0.300 -13.135   8.072
  523   3HG2  THR  11          3HG2      THR  11  -1.919 -12.432   8.019
  524    H    LEU  12           H        LEU  12   0.632  -7.622   7.028
  525    HA   LEU  12           HA       LEU  12   2.410  -8.031   4.752
  526   1HB   LEU  12          2HB       LEU  12   0.195  -7.931   3.794
  527   2HB   LEU  12          1HB       LEU  12  -0.159  -6.467   4.681
  528    HG   LEU  12           HG       LEU  12   1.403  -5.215   3.352
  529   1HD1  LEU  12          1HD1      LEU  12   2.414  -7.855   2.763
  530   2HD1  LEU  12          2HD1      LEU  12   3.203  -6.290   2.616
  531   3HD1  LEU  12          3HD1      LEU  12   2.192  -6.896   1.303
  532   1HD2  LEU  12          1HD2      LEU  12  -0.101  -4.951   1.740
  533   2HD2  LEU  12          2HD2      LEU  12  -0.934  -6.369   2.381
  534   3HD2  LEU  12          3HD2      LEU  12   0.240  -6.551   1.078
  535    H    LYS  13           H        LYS  13   3.891  -6.443   4.444
  536    HA   LYS  13           HA       LYS  13   3.680  -3.957   5.952
  537   1HB   LYS  13          2HB       LYS  13   6.132  -5.708   6.184
  538   2HB   LYS  13          1HB       LYS  13   5.843  -4.177   6.996
  539   1HG   LYS  13          2HG       LYS  13   5.387  -5.644   8.682
  540   2HG   LYS  13          1HG       LYS  13   3.779  -5.445   7.986
  541   1HD   LYS  13          2HD       LYS  13   4.113  -7.498   6.673
  542   2HD   LYS  13          1HD       LYS  13   5.699  -7.699   7.412
  543   1HE   LYS  13          2HE       LYS  13   4.653  -7.869   9.613
  544   2HE   LYS  13          1HE       LYS  13   3.064  -7.657   8.878
  545   1HZ   LYS  13          1HZ       LYS  13   4.924  -9.902   8.309
  546   2HZ   LYS  13          2HZ       LYS  13   3.372  -9.708   7.666
  547   3HZ   LYS  13          3HZ       LYS  13   3.571  -9.989   9.322
  548    H    GLY  14           H        GLY  14   4.942  -2.260   5.087
  549   1HA   GLY  14          2HA       GLY  14   6.891  -2.661   3.071
  550   2HA   GLY  14          1HA       GLY  14   5.339  -2.317   2.329
  551    H    GLU  15           H        GLU  15   6.877  -0.556   1.545
  552    HA   GLU  15           HA       GLU  15   6.336   1.820   3.151
  553   1HB   GLU  15          2HB       GLU  15   9.051   1.160   1.995
  554   2HB   GLU  15          1HB       GLU  15   8.611   2.698   2.724
  555   1HG   GLU  15          2HG       GLU  15   8.211   1.569   4.857
  556   2HG   GLU  15          1HG       GLU  15   8.671   0.033   4.124
  557    H    THR  16           H        THR  16   5.670   3.496   1.973
  558    HA   THR  16           HA       THR  16   6.108   3.457  -0.923
  559    HB   THR  16           HB       THR  16   3.948   2.634  -0.902
  560    HG1  THR  16           1HG      THR  16   3.471   5.399  -0.752
  561   1HG2  THR  16          1HG2      THR  16   3.458   4.325   1.515
  562   2HG2  THR  16          2HG2      THR  16   3.312   2.578   1.339
  563   3HG2  THR  16          3HG2      THR  16   2.139   3.645   0.567
  564    H    THR  17           H        THR  17   5.466   5.623  -1.940
  565    HA   THR  17           HA       THR  17   5.816   7.856  -0.090
  566    HB   THR  17           HB       THR  17   7.581   8.821  -1.575
  567    HG1  THR  17           1HG      THR  17   7.899   7.835  -3.379
  568   1HG2  THR  17          1HG2      THR  17   8.444   7.902   0.391
  569   2HG2  THR  17          2HG2      THR  17   9.403   7.186  -0.904
  570   3HG2  THR  17          3HG2      THR  17   8.120   6.250  -0.137
  571    H    THR  18           H        THR  18   4.351   9.332  -0.496
  572    HA   THR  18           HA       THR  18   3.323   9.675  -3.249
  573    HB   THR  18           HB       THR  18   1.662   9.024  -1.493
  574    HG1  THR  18           1HG      THR  18   1.073  10.294  -3.324
  575   1HG2  THR  18          1HG2      THR  18   0.893  10.820   0.050
  576   2HG2  THR  18          2HG2      THR  18   2.387  11.685  -0.307
  577   3HG2  THR  18          3HG2      THR  18   2.449  10.104   0.470
  578    H    GLU  19           H        GLU  19   3.248  11.749  -4.132
  579    HA   GLU  19           HA       GLU  19   4.892  13.761  -2.741
  580   1HB   GLU  19          2HB       GLU  19   5.763  13.070  -4.908
  581   2HB   GLU  19          1HB       GLU  19   4.224  13.431  -5.674
  582   1HG   GLU  19          2HG       GLU  19   5.835  15.169  -6.139
  583   2HG   GLU  19          1HG       GLU  19   4.517  15.800  -5.151
  584    H    ALA  20           H        ALA  20   3.771  15.365  -1.774
  585    HA   ALA  20           HA       ALA  20   1.541  16.572  -3.203
  586   1HB   ALA  20          1HB       ALA  20   0.911  14.655  -1.439
  587   2HB   ALA  20          2HB       ALA  20  -0.114  16.052  -1.764
  588   3HB   ALA  20          3HB       ALA  20   0.956  16.050  -0.362
  589    H    VAL  21           H        VAL  21   0.999  18.635  -2.525
  590    HA   VAL  21           HA       VAL  21   3.032  20.357  -1.869
  591    HB   VAL  21           HB       VAL  21   0.129  20.858  -1.213
  592   1HG1  VAL  21          1HG1      VAL  21   2.246  22.825  -2.059
  593   2HG1  VAL  21          2HG1      VAL  21   1.845  22.490  -0.374
  594   3HG1  VAL  21          3HG1      VAL  21   0.626  23.169  -1.452
  595   1HG2  VAL  21          1HG2      VAL  21   0.005  20.196  -3.422
  596   2HG2  VAL  21          2HG2      VAL  21   1.601  20.838  -3.814
  597   3HG2  VAL  21          3HG2      VAL  21   0.242  21.937  -3.573
  598    H    ASP  22           H        ASP  22   1.064  18.504   0.315
  599    HA   ASP  22           HA       ASP  22   2.781  19.253   2.509
  600   1HB   ASP  22          2HB       ASP  22   1.048  20.087   3.998
  601   2HB   ASP  22          1HB       ASP  22   1.131  21.083   2.549
  602    H    ALA  23           H        ALA  23   1.908  18.170   4.628
  603    HA   ALA  23           HA       ALA  23   1.887  15.414   4.179
  604   1HB   ALA  23          1HB       ALA  23   0.957  15.528   6.689
  605   2HB   ALA  23          2HB       ALA  23   1.560  17.176   6.525
  606   3HB   ALA  23          3HB       ALA  23   2.647  15.810   6.274
  607    H    ALA  24           H        ALA  24  -0.764  17.633   4.906
  608    HA   ALA  24           HA       ALA  24  -2.772  15.666   5.151
  609   1HB   ALA  24          1HB       ALA  24  -3.004  18.039   5.886
  610   2HB   ALA  24          2HB       ALA  24  -4.357  17.463   4.914
  611   3HB   ALA  24          3HB       ALA  24  -3.134  18.507   4.191
  612    H    THR  25           H        THR  25  -1.904  17.748   2.379
  613    HA   THR  25           HA       THR  25  -3.626  16.684   0.505
  614    HB   THR  25           HB       THR  25  -1.913  17.389  -1.171
  615    HG1  THR  25           1HG      THR  25  -0.364  17.565   1.141
  616   1HG2  THR  25          1HG2      THR  25  -1.599  19.795  -0.029
  617   2HG2  THR  25          2HG2      THR  25  -2.938  19.161   0.930
  618   3HG2  THR  25          3HG2      THR  25  -3.082  19.269  -0.824
  619    H    ALA  26           H        ALA  26  -0.377  15.610   1.452
  620    HA   ALA  26           HA       ALA  26  -0.180  13.442  -0.327
  621   1HB   ALA  26          1HB       ALA  26   1.134  12.735   2.077
  622   2HB   ALA  26          2HB       ALA  26   1.312  14.477   1.882
  623   3HB   ALA  26          3HB       ALA  26   1.844  13.388   0.601
  624    H    GLU  27           H        GLU  27  -1.242  13.579   3.078
  625    HA   GLU  27           HA       GLU  27  -1.977  10.958   3.455
  626   1HB   GLU  27          2HB       GLU  27  -1.957  12.611   5.242
  627   2HB   GLU  27          1HB       GLU  27  -3.296  13.468   4.495
  628   1HG   GLU  27          2HG       GLU  27  -4.078  12.189   6.371
  629   2HG   GLU  27          1HG       GLU  27  -4.737  11.531   4.876
  630    H    LYS  28           H        LYS  28  -3.925  13.623   2.149
  631    HA   LYS  28           HA       LYS  28  -6.272  12.121   1.717
  632   1HB   LYS  28          2HB       LYS  28  -5.294  14.616   0.315
  633   2HB   LYS  28          1HB       LYS  28  -6.929  13.975   0.215
  634   1HG   LYS  28          2HG       LYS  28  -5.552  15.058   2.663
  635   2HG   LYS  28          1HG       LYS  28  -6.900  15.782   1.782
  636   1HD   LYS  28          2HD       LYS  28  -8.309  13.878   2.372
  637   2HD   LYS  28          1HD       LYS  28  -6.960  13.143   3.240
  638   1HE   LYS  28          2HE       LYS  28  -8.274  15.776   3.904
  639   2HE   LYS  28          1HE       LYS  28  -8.498  14.260   4.774
  640   1HZ   LYS  28          1HZ       LYS  28  -6.907  15.699   5.884
  641   2HZ   LYS  28          2HZ       LYS  28  -5.931  15.728   4.504
  642   3HZ   LYS  28          3HZ       LYS  28  -6.154  14.281   5.351
  643    H    VAL  29           H        VAL  29  -3.566  12.970  -0.415
  644    HA   VAL  29           HA       VAL  29  -4.537  11.774  -2.745
  645    HB   VAL  29           HB       VAL  29  -1.657  12.040  -1.861
  646   1HG1  VAL  29          1HG1      VAL  29  -1.008  11.190  -3.813
  647   2HG1  VAL  29          2HG1      VAL  29  -2.165  12.176  -4.708
  648   3HG1  VAL  29          3HG1      VAL  29  -2.667  10.631  -4.025
  649   1HG2  VAL  29          1HG2      VAL  29  -2.675  13.896  -3.872
  650   2HG2  VAL  29          2HG2      VAL  29  -1.704  14.202  -2.432
  651   3HG2  VAL  29          3HG2      VAL  29  -3.456  14.060  -2.298
  652    H    VAL  30           H        VAL  30  -2.687  10.437  -0.052
  653    HA   VAL  30           HA       VAL  30  -2.243   7.878  -1.157
  654    HB   VAL  30           HB       VAL  30  -2.666   8.478   1.776
  655   1HG1  VAL  30          1HG1      VAL  30  -2.507   6.079   0.847
  656   2HG1  VAL  30          2HG1      VAL  30  -1.486   6.514   2.216
  657   3HG1  VAL  30          3HG1      VAL  30  -0.803   6.451   0.593
  658   1HG2  VAL  30          1HG2      VAL  30   0.089   8.405   1.149
  659   2HG2  VAL  30          2HG2      VAL  30  -0.853   9.764   1.757
  660   3HG2  VAL  30          3HG2      VAL  30  -0.673   9.524   0.020
  661    H    LYS  31           H        LYS  31  -4.890   9.216   0.845
  662    HA   LYS  31           HA       LYS  31  -6.412   6.988   1.295
  663   1HB   LYS  31          2HB       LYS  31  -7.512   9.666   0.426
  664   2HB   LYS  31          1HB       LYS  31  -8.390   8.419   1.295
  665   1HG   LYS  31          2HG       LYS  31  -6.260  10.259   2.275
  666   2HG   LYS  31          1HG       LYS  31  -7.853   9.927   2.951
  667   1HD   LYS  31          2HD       LYS  31  -7.016   7.591   3.436
  668   2HD   LYS  31          1HD       LYS  31  -5.406   8.183   3.021
  669   1HE   LYS  31          2HE       LYS  31  -5.785   8.233   5.436
  670   2HE   LYS  31          1HE       LYS  31  -5.542   9.849   4.782
  671   1HZ   LYS  31          1HZ       LYS  31  -7.458   9.412   6.439
  672   2HZ   LYS  31          2HZ       LYS  31  -8.271   8.799   5.090
  673   3HZ   LYS  31          3HZ       LYS  31  -7.737  10.402   5.096
  674    H    GLN  32           H        GLN  32  -6.466   9.039  -1.569
  675    HA   GLN  32           HA       GLN  32  -8.353   7.566  -3.037
  676   1HB   GLN  32          2HB       GLN  32  -7.871   9.735  -3.818
  677   2HB   GLN  32          1HB       GLN  32  -6.144   9.448  -3.848
  678   1HG   GLN  32          2HG       GLN  32  -8.028   7.977  -5.657
  679   2HG   GLN  32          1HG       GLN  32  -7.400   9.568  -6.067
  680   1HE2  GLN  32          1HE2      GLN  32  -4.907   8.320  -4.418
  681   2HE2  GLN  32          2HE2      GLN  32  -4.057   7.530  -5.691
  682    H    PHE  33           H        PHE  33  -4.904   7.200  -2.619
  683    HA   PHE  33           HA       PHE  33  -4.295   5.368  -4.610
  684   1HB   PHE  33          2HB       PHE  33  -2.697   6.524  -3.038
  685   2HB   PHE  33          1HB       PHE  33  -3.172   5.367  -1.800
  686    HD1  PHE  33           1HD      PHE  33  -1.634   5.671  -5.140
  687    HD2  PHE  33           2HD      PHE  33  -2.144   3.262  -1.657
  688    HE1  PHE  33           1HE      PHE  33   0.095   4.122  -5.945
  689    HE2  PHE  33           2HE      PHE  33  -0.416   1.716  -2.477
  690    HZ   PHE  33           HZ       PHE  33   0.700   2.152  -4.629
  691    H    PHE  34           H        PHE  34  -4.993   4.602  -1.226
  692    HA   PHE  34           HA       PHE  34  -5.419   1.820  -1.723
  693   1HB   PHE  34          2HB       PHE  34  -6.109   3.492   0.694
  694   2HB   PHE  34          1HB       PHE  34  -6.149   1.727   0.630
  695    HD1  PHE  34           1HD      PHE  34  -3.820   0.981  -0.806
  696    HD2  PHE  34           2HD      PHE  34  -4.312   4.140   1.993
  697    HE1  PHE  34           1HE      PHE  34  -1.414   0.920  -0.325
  698    HE2  PHE  34           2HE      PHE  34  -1.902   4.080   2.489
  699    HZ   PHE  34           HZ       PHE  34  -0.458   2.468   1.315
  700    H    ASN  35           H        ASN  35  -7.535   4.593  -1.332
  701    HA   ASN  35           HA       ASN  35 -10.013   3.388  -1.173
  702   1HB   ASN  35          2HB       ASN  35  -9.635   5.826  -1.074
  703   2HB   ASN  35          1HB       ASN  35  -9.249   5.832  -2.791
  704   1HD2  ASN  35          1HD2      ASN  35 -11.482   6.782  -0.817
  705   2HD2  ASN  35          2HD2      ASN  35 -12.920   6.501  -1.733
  706    H    ASP  36           H        ASP  36  -7.956   3.937  -3.933
  707    HA   ASP  36           HA       ASP  36  -9.854   2.665  -5.748
  708   1HB   ASP  36          2HB       ASP  36  -7.231   4.065  -6.287
  709   2HB   ASP  36          1HB       ASP  36  -8.252   3.352  -7.532
  710    H    ASN  37           H        ASN  37  -6.918   1.871  -4.051
  711    HA   ASN  37           HA       ASN  37  -6.273  -0.322  -5.830
  712   1HB   ASN  37          2HB       ASN  37  -5.166   0.421  -3.112
  713   2HB   ASN  37          1HB       ASN  37  -4.583  -0.926  -4.083
  714   1HD2  ASN  37          1HD2      ASN  37  -3.434   1.716  -3.105
  715   2HD2  ASN  37          2HD2      ASN  37  -2.718   2.397  -4.526
  716    H    GLY  38           H        GLY  38  -7.552   0.093  -2.573
  717   1HA   GLY  38          2HA       GLY  38  -7.998  -1.949  -1.222
  718   2HA   GLY  38          1HA       GLY  38  -9.449  -1.196  -1.841
  719    H    VAL  39           H        VAL  39 -10.847  -2.494  -2.738
  720    HA   VAL  39           HA       VAL  39  -9.957  -5.169  -3.583
  721    HB   VAL  39           HB       VAL  39 -12.723  -4.272  -2.852
  722   1HG1  VAL  39          1HG1      VAL  39 -11.492  -6.894  -3.535
  723   2HG1  VAL  39          2HG1      VAL  39 -13.067  -6.236  -3.978
  724   3HG1  VAL  39          3HG1      VAL  39 -12.797  -6.857  -2.350
  725   1HG2  VAL  39          1HG2      VAL  39 -10.812  -5.772  -1.074
  726   2HG2  VAL  39          2HG2      VAL  39 -12.389  -5.104  -0.653
  727   3HG2  VAL  39          3HG2      VAL  39 -11.040  -4.024  -1.001
  728    H    ASP  40           H        ASP  40 -10.672  -2.379  -5.191
  729    HA   ASP  40           HA       ASP  40 -11.978  -3.887  -7.348
  730   1HB   ASP  40          2HB       ASP  40 -12.438  -0.994  -6.602
  731   2HB   ASP  40          1HB       ASP  40 -13.121  -1.798  -8.011
  732    H    GLY  41           H        GLY  41  -9.090  -2.858  -6.592
  733   1HA   GLY  41          2HA       GLY  41  -8.469  -1.183  -8.865
  734   2HA   GLY  41          1HA       GLY  41  -7.328  -1.802  -7.681
  735    H    GLU  42           H        GLU  42  -6.412  -1.809 -10.131
  736    HA   GLU  42           HA       GLU  42  -6.898  -4.455 -11.308
  737   1HB   GLU  42          2HB       GLU  42  -5.338  -2.105 -12.408
  738   2HB   GLU  42          1HB       GLU  42  -5.636  -3.617 -13.251
  739   1HG   GLU  42          2HG       GLU  42  -7.169  -2.078 -14.129
  740   2HG   GLU  42          1HG       GLU  42  -8.098  -3.106 -13.040
  741    H    TRP  43           H        TRP  43  -5.704  -5.927 -10.218
  742    HA   TRP  43           HA       TRP  43  -2.974  -5.263  -9.436
  743   1HB   TRP  43          2HB       TRP  43  -4.668  -7.685  -8.826
  744   2HB   TRP  43          1HB       TRP  43  -3.066  -7.373  -8.171
  745    HD1  TRP  43           HD       TRP  43  -6.059  -4.901  -8.370
  746    HE1  TRP  43           1HE      TRP  43  -6.554  -4.094  -5.973
  747    HE3  TRP  43           3HE      TRP  43  -2.670  -7.759  -5.842
  748    HZ2  TRP  43           2HZ      TRP  43  -5.627  -4.611  -3.358
  749    HZ3  TRP  43           3HZ      TRP  43  -2.535  -7.553  -3.400
  750    HH2  TRP  43           HH       TRP  43  -3.986  -6.007  -2.183
  751    H    THR  44           H        THR  44  -1.325  -5.753 -10.709
  752    HA   THR  44           HA       THR  44  -1.590  -7.980 -12.605
  753    HB   THR  44           HB       THR  44   0.420  -6.966 -13.703
  754    HG1  THR  44           1HG      THR  44   1.084  -5.831 -11.749
  755   1HG2  THR  44          1HG2      THR  44  -1.946  -5.139 -13.383
  756   2HG2  THR  44          2HG2      THR  44  -1.715  -6.376 -14.620
  757   3HG2  THR  44          3HG2      THR  44  -0.678  -4.948 -14.593
  758    H    TYR  45           H        TYR  45  -0.338  -9.768 -12.402
  759    HA   TYR  45           HA       TYR  45   1.479  -9.847 -10.094
  760   1HB   TYR  45          2HB       TYR  45  -0.388 -11.422 -10.029
  761   2HB   TYR  45          1HB       TYR  45   0.094 -12.084 -11.586
  762    HD1  TYR  45           1HD      TYR  45   2.416 -11.199  -8.842
  763    HD2  TYR  45           2HD      TYR  45   0.433 -14.330 -10.929
  764    HE1  TYR  45           1HE      TYR  45   3.829 -12.851  -7.693
  765    HE2  TYR  45           2HE      TYR  45   1.838 -15.992  -9.786
  766    HH   TYR  45           HH       TYR  45   3.798 -16.232  -8.575
  767    H    ASP  46           H        ASP  46   3.588 -10.492 -10.261
  768    HA   ASP  46           HA       ASP  46   4.573 -11.122 -12.967
  769   1HB   ASP  46          2HB       ASP  46   5.216  -8.838 -12.326
  770   2HB   ASP  46          1HB       ASP  46   5.954  -9.454 -10.849
  771    H    ASP  47           H        ASP  47   4.344 -13.347 -12.367
  772    HA   ASP  47           HA       ASP  47   5.390 -14.649 -10.191
  773   1HB   ASP  47          2HB       ASP  47   5.372 -15.640 -13.049
  774   2HB   ASP  47          1HB       ASP  47   5.549 -16.654 -11.621
  775    H    ALA  48           H        ALA  48   7.100 -13.541 -13.058
  776    HA   ALA  48           HA       ALA  48   9.492 -14.860 -12.849
  777   1HB   ALA  48          1HB       ALA  48   8.940 -13.375 -14.694
  778   2HB   ALA  48          2HB       ALA  48  10.509 -12.962 -14.002
  779   3HB   ALA  48          3HB       ALA  48   9.095 -11.978 -13.627
  780    H    THR  49           H        THR  49   8.350 -12.204 -10.855
  781    HA   THR  49           HA       THR  49  10.812 -12.467  -9.259
  782    HB   THR  49           HB       THR  49  10.665 -10.055  -8.739
  783    HG1  THR  49           1HG      THR  49   8.978  -8.974  -9.305
  784   1HG2  THR  49          1HG2      THR  49  12.091  -9.758 -10.392
  785   2HG2  THR  49          2HG2      THR  49  10.738  -9.555 -11.506
  786   3HG2  THR  49          3HG2      THR  49  11.434 -11.155 -11.246
  787    H    LYS  50           H        LYS  50   7.794 -13.354  -9.133
  788    HA   LYS  50           HA       LYS  50   6.229 -13.706  -7.488
  789   1HB   LYS  50          2HB       LYS  50   8.611 -13.208  -5.689
  790   2HB   LYS  50          1HB       LYS  50   7.108 -13.979  -5.205
  791   1HG   LYS  50          2HG       LYS  50   8.625 -15.156  -7.471
  792   2HG   LYS  50          1HG       LYS  50   9.245 -15.378  -5.835
  793   1HD   LYS  50          2HD       LYS  50   7.844 -17.252  -6.405
  794   2HD   LYS  50          1HD       LYS  50   7.039 -16.283  -5.174
  795   1HE   LYS  50          2HE       LYS  50   5.525 -17.061  -6.961
  796   2HE   LYS  50          1HE       LYS  50   5.585 -15.309  -6.801
  797   1HZ   LYS  50          1HZ       LYS  50   7.289 -16.727  -8.754
  798   2HZ   LYS  50          2HZ       LYS  50   6.818 -15.103  -8.751
  799   3HZ   LYS  50          3HZ       LYS  50   5.695 -16.306  -9.132
  800    H    THR  51           H        THR  51   6.606 -10.993  -8.484
  801    HA   THR  51           HA       THR  51   5.875  -9.411  -6.115
  802    HB   THR  51           HB       THR  51   7.041  -8.586  -8.777
  803    HG1  THR  51           1HG      THR  51   8.406  -9.488  -7.057
  804   1HG2  THR  51          1HG2      THR  51   5.926  -6.663  -8.416
  805   2HG2  THR  51          2HG2      THR  51   7.297  -6.365  -7.348
  806   3HG2  THR  51          3HG2      THR  51   5.771  -6.941  -6.683
  807    H    PHE  52           H        PHE  52   4.137  -7.871  -6.302
  808    HA   PHE  52           HA       PHE  52   2.290  -8.436  -8.525
  809   1HB   PHE  52          2HB       PHE  52   1.449  -8.016  -5.663
  810   2HB   PHE  52          1HB       PHE  52   0.405  -8.370  -7.031
  811    HD1  PHE  52           1HD      PHE  52  -0.324 -10.528  -7.276
  812    HD2  PHE  52           2HD      PHE  52   3.381  -9.815  -5.306
  813    HE1  PHE  52           1HE      PHE  52  -0.117 -12.933  -6.804
  814    HE2  PHE  52           2HE      PHE  52   3.594 -12.220  -4.833
  815    HZ   PHE  52           HZ       PHE  52   1.843 -13.780  -5.579
  816    H    THR  53           H        THR  53   2.701  -6.601  -9.588
  817    HA   THR  53           HA       THR  53   2.703  -4.014  -8.360
  818    HB   THR  53           HB       THR  53   2.406  -3.246 -10.837
  819    HG1  THR  53           1HG      THR  53   2.676  -4.728 -12.337
  820   1HG2  THR  53          1HG2      THR  53   4.795  -4.446  -9.567
  821   2HG2  THR  53          2HG2      THR  53   4.485  -2.785 -10.076
  822   3HG2  THR  53          3HG2      THR  53   4.868  -4.021 -11.278
  823    H    VAL  54           H        VAL  54   1.102  -2.717  -7.883
  824    HA   VAL  54           HA       VAL  54  -1.580  -3.357  -8.925
  825    HB   VAL  54           HB       VAL  54  -0.895  -2.144  -6.237
  826   1HG1  VAL  54          1HG1      VAL  54  -2.982  -1.270  -6.816
  827   2HG1  VAL  54          2HG1      VAL  54  -3.372  -2.688  -5.842
  828   3HG1  VAL  54          3HG1      VAL  54  -3.495  -2.763  -7.600
  829   1HG2  VAL  54          1HG2      VAL  54  -0.405  -4.304  -5.786
  830   2HG2  VAL  54          2HG2      VAL  54  -1.350  -4.918  -7.144
  831   3HG2  VAL  54          3HG2      VAL  54  -2.158  -4.440  -5.650
  832    H    THR  55           H        THR  55  -2.367  -1.861 -10.232
  833    HA   THR  55           HA       THR  55  -1.340   0.880 -10.036
  834    HB   THR  55           HB       THR  55  -2.882  -0.378 -12.310
  835    HG1  THR  55           1HG      THR  55  -0.745  -1.272 -11.907
  836   1HG2  THR  55          1HG2      THR  55  -3.041   2.031 -12.345
  837   2HG2  THR  55          2HG2      THR  55  -1.977   1.472 -13.636
  838   3HG2  THR  55          3HG2      THR  55  -1.292   2.170 -12.167
  839    H    GLU  56           H        GLU  56  -2.576   2.235  -8.888
  840    HA   GLU  56           HA       GLU  56  -5.100   1.729  -7.943
  841   1HB   GLU  56          2HB       GLU  56  -5.265   4.042  -7.363
  842   2HB   GLU  56          1HB       GLU  56  -3.580   3.567  -7.197
  843   1HG   GLU  56          2HG       GLU  56  -3.600   5.699  -8.194
  844   2HG   GLU  56          1HG       GLU  56  -3.179   4.552  -9.465
  Start of MODEL   30
    1   1H    MET   1          1HT       MET   1   5.875 -18.418   3.616
    2   2H    MET   1          2HT       MET   1   5.123 -19.412   2.473
    3   3H    MET   1          3HT       MET   1   4.513 -17.863   2.777
    4    HA   MET   1           HA       MET   1   7.271 -18.216   1.813
    5   1HB   MET   1          2HB       MET   1   5.716 -19.472   0.327
    6   2HB   MET   1          1HB       MET   1   4.793 -17.995   0.090
    7   1HG   MET   1          2HG       MET   1   6.254 -18.398  -1.790
    8   2HG   MET   1          1HG       MET   1   6.743 -16.938  -0.931
    9   1HE   MET   1          1HE       MET   1   8.952 -17.059  -2.335
   10   2HE   MET   1          2HE       MET   1   8.652 -18.639  -3.059
   11   3HE   MET   1          3HE       MET   1  10.163 -18.334  -2.202
   12    H    GLN   2           H        GLN   2   8.084 -16.282   0.887
   13    HA   GLN   2           HA       GLN   2   6.657 -13.882   1.804
   14   1HB   GLN   2          2HB       GLN   2   8.948 -14.307   2.695
   15   2HB   GLN   2          1HB       GLN   2   9.570 -14.196   1.055
   16   1HG   GLN   2          2HG       GLN   2   9.973 -12.121   2.132
   17   2HG   GLN   2          1HG       GLN   2   8.699 -11.874   0.942
   18   1HE2  GLN   2          1HE2      GLN   2   7.418 -13.543   3.543
   19   2HE2  GLN   2          2HE2      GLN   2   6.767 -12.206   4.413
   20    H    TYR   3           H        TYR   3   5.885 -12.437   0.387
   21    HA   TYR   3           HA       TYR   3   6.816 -12.598  -2.405
   22   1HB   TYR   3          2HB       TYR   3   4.000 -12.134  -1.405
   23   2HB   TYR   3          1HB       TYR   3   4.501 -11.942  -3.082
   24    HD1  TYR   3           1HD      TYR   3   4.904 -13.855  -4.486
   25    HD2  TYR   3           2HD      TYR   3   3.907 -14.365  -0.381
   26    HE1  TYR   3           1HE      TYR   3   4.486 -16.244  -4.890
   27    HE2  TYR   3           2HE      TYR   3   3.487 -16.754  -0.775
   28    HH   TYR   3           HH       TYR   3   4.314 -18.505  -2.525
   29    H    LYS   4           H        LYS   4   6.939 -10.648  -3.561
   30    HA   LYS   4           HA       LYS   4   7.021  -8.271  -1.825
   31   1HB   LYS   4          2HB       LYS   4   9.156  -8.910  -2.872
   32   2HB   LYS   4          1HB       LYS   4   8.416  -8.770  -4.461
   33   1HG   LYS   4          2HG       LYS   4   8.052  -6.389  -4.092
   34   2HG   LYS   4          1HG       LYS   4   8.768  -6.525  -2.485
   35   1HD   LYS   4          2HD       LYS   4  10.880  -7.256  -3.509
   36   2HD   LYS   4          1HD       LYS   4  10.159  -7.068  -5.108
   37   1HE   LYS   4          2HE       LYS   4  10.578  -4.884  -3.071
   38   2HE   LYS   4          1HE       LYS   4  11.528  -5.135  -4.535
   39   1HZ   LYS   4          1HZ       LYS   4   8.926  -3.921  -4.211
   40   2HZ   LYS   4          2HZ       LYS   4   9.033  -4.996  -5.511
   41   3HZ   LYS   4          3HZ       LYS   4  10.092  -3.681  -5.414
   42    H    VAL   5           H        VAL   5   5.128  -7.233  -1.970
   43    HA   VAL   5           HA       VAL   5   3.801  -7.014  -4.560
   44    HB   VAL   5           HB       VAL   5   2.863  -6.181  -1.811
   45   1HG1  VAL   5          1HG1      VAL   5   1.489  -6.116  -4.488
   46   2HG1  VAL   5          2HG1      VAL   5   1.789  -4.769  -3.392
   47   3HG1  VAL   5          3HG1      VAL   5   0.628  -6.020  -2.952
   48   1HG2  VAL   5          1HG2      VAL   5   2.646  -8.672  -3.375
   49   2HG2  VAL   5          2HG2      VAL   5   1.175  -8.128  -2.570
   50   3HG2  VAL   5          3HG2      VAL   5   2.637  -8.421  -1.630
   51    H    ILE   6           H        ILE   6   3.828  -5.228  -5.748
   52    HA   ILE   6           HA       ILE   6   5.023  -2.811  -4.566
   53    HB   ILE   6           HB       ILE   6   4.944  -3.619  -7.477
   54   1HG1  ILE   6          2HG1      ILE   6   7.262  -3.531  -5.534
   55   2HG1  ILE   6          1HG1      ILE   6   6.463  -4.997  -6.085
   56   1HG2  ILE   6          1HG2      ILE   6   4.966  -1.105  -6.740
   57   2HG2  ILE   6          2HG2      ILE   6   6.040  -1.670  -8.018
   58   3HG2  ILE   6          3HG2      ILE   6   6.662  -1.438  -6.385
   59   1HD1  ILE   6          1HD1      ILE   6   7.107  -4.259  -8.435
   60   2HD1  ILE   6          2HD1      ILE   6   8.399  -4.832  -7.380
   61   3HD1  ILE   6          3HD1      ILE   6   8.179  -3.104  -7.645
   62    H    LEU   7           H        LEU   7   3.893  -0.988  -4.501
   63    HA   LEU   7           HA       LEU   7   1.225  -0.981  -5.741
   64   1HB   LEU   7          2HB       LEU   7   2.142   0.813  -3.502
   65   2HB   LEU   7          1HB       LEU   7   0.500   0.423  -3.980
   66    HG   LEU   7           HG       LEU   7   2.437  -1.466  -2.662
   67   1HD1  LEU   7          1HD1      LEU   7  -0.151  -0.456  -1.538
   68   2HD1  LEU   7          2HD1      LEU   7   1.355   0.434  -1.319
   69   3HD1  LEU   7          3HD1      LEU   7   1.208  -1.210  -0.701
   70   1HD2  LEU   7          1HD2      LEU   7  -0.472  -1.975  -3.177
   71   2HD2  LEU   7          2HD2      LEU   7   0.804  -3.125  -2.770
   72   3HD2  LEU   7          3HD2      LEU   7   0.756  -2.390  -4.373
   73    H    ASN   8           H        ASN   8   1.757  -0.153  -7.762
   74    HA   ASN   8           HA       ASN   8   3.218   2.372  -7.881
   75   1HB   ASN   8          2HB       ASN   8   2.257   0.579 -10.120
   76   2HB   ASN   8          1HB       ASN   8   3.289   1.995 -10.305
   77   1HD2  ASN   8          1HD2      ASN   8   5.359   1.584 -10.470
   78   2HD2  ASN   8          2HD2      ASN   8   6.180   0.202  -9.836
   79    H    GLY   9           H        GLY   9   1.981   4.124  -7.542
   80   1HA   GLY   9          2HA       GLY   9  -0.654   4.221  -8.871
   81   2HA   GLY   9          1HA       GLY   9  -0.236   5.121  -7.420
   82    H    LYS  10           H        LYS  10  -1.253   6.758  -8.996
   83    HA   LYS  10           HA       LYS  10   0.514   7.754 -11.026
   84   1HB   LYS  10          2HB       LYS  10  -2.015   8.885  -9.816
   85   2HB   LYS  10          1HB       LYS  10  -1.138   9.645 -11.136
   86   1HG   LYS  10          2HG       LYS  10  -1.570   7.789 -12.580
   87   2HG   LYS  10          1HG       LYS  10  -2.275   6.865 -11.254
   88   1HD   LYS  10          2HD       LYS  10  -4.012   7.816 -12.687
   89   2HD   LYS  10          1HD       LYS  10  -4.080   8.504 -11.064
   90   1HE   LYS  10          2HE       LYS  10  -2.859  10.477 -11.861
   91   2HE   LYS  10          1HE       LYS  10  -2.817   9.790 -13.485
   92   1HZ   LYS  10          1HZ       LYS  10  -4.656  11.068 -13.687
   93   2HZ   LYS  10          2HZ       LYS  10  -5.038  11.009 -12.040
   94   3HZ   LYS  10          3HZ       LYS  10  -5.411   9.697 -13.041
   95    H    THR  11           H        THR  11  -0.704   8.979  -7.923
   96    HA   THR  11           HA       THR  11   1.524  10.861  -7.768
   97    HB   THR  11           HB       THR  11   0.045  11.663  -5.774
   98    HG1  THR  11           1HG      THR  11  -2.223  11.191  -6.367
   99   1HG2  THR  11          1HG2      THR  11   0.250  12.553  -8.317
  100   2HG2  THR  11          2HG2      THR  11  -0.745  13.310  -7.074
  101   3HG2  THR  11          3HG2      THR  11  -1.473  12.189  -8.225
  102    H    LEU  12           H        LEU  12   0.894   7.789  -6.840
  103    HA   LEU  12           HA       LEU  12   2.621   8.056  -4.493
  104   1HB   LEU  12          2HB       LEU  12   0.356   7.860  -3.650
  105   2HB   LEU  12          1HB       LEU  12   0.090   6.422  -4.618
  106    HG   LEU  12           HG       LEU  12   1.669   5.175  -3.300
  107   1HD1  LEU  12          1HD1      LEU  12   3.380   6.269  -2.409
  108   2HD1  LEU  12          2HD1      LEU  12   2.282   6.811  -1.139
  109   3HD1  LEU  12          3HD1      LEU  12   2.554   7.814  -2.561
  110   1HD2  LEU  12          1HD2      LEU  12   0.155   4.769  -1.720
  111   2HD2  LEU  12          2HD2      LEU  12  -0.763   6.115  -2.394
  112   3HD2  LEU  12          3HD2      LEU  12   0.324   6.383  -1.032
  113    H    LYS  13           H        LYS  13   4.112   6.491  -4.226
  114    HA   LYS  13           HA       LYS  13   4.001   4.073  -5.863
  115   1HB   LYS  13          2HB       LYS  13   6.309   6.028  -5.940
  116   2HB   LYS  13          1HB       LYS  13   6.312   4.431  -6.678
  117   1HG   LYS  13          2HG       LYS  13   4.588   5.072  -8.213
  118   2HG   LYS  13          1HG       LYS  13   4.382   6.624  -7.400
  119   1HD   LYS  13          2HD       LYS  13   6.901   5.713  -8.791
  120   2HD   LYS  13          1HD       LYS  13   5.697   6.802  -9.485
  121   1HE   LYS  13          2HE       LYS  13   6.090   8.374  -7.626
  122   2HE   LYS  13          1HE       LYS  13   7.340   7.298  -7.004
  123   1HZ   LYS  13          1HZ       LYS  13   7.701   7.986  -9.770
  124   2HZ   LYS  13          2HZ       LYS  13   8.806   8.037  -8.490
  125   3HZ   LYS  13          3HZ       LYS  13   7.743   9.330  -8.743
  126    H    GLY  14           H        GLY  14   5.082   2.325  -4.941
  127   1HA   GLY  14          2HA       GLY  14   7.049   2.586  -2.921
  128   2HA   GLY  14          1HA       GLY  14   5.479   2.344  -2.177
  129    H    GLU  15           H        GLU  15   6.874   0.477  -1.390
  130    HA   GLU  15           HA       GLU  15   6.223  -1.854  -3.031
  131   1HB   GLU  15          2HB       GLU  15   8.921  -1.402  -1.735
  132   2HB   GLU  15          1HB       GLU  15   8.404  -2.895  -2.503
  133   1HG   GLU  15          2HG       GLU  15   9.750  -1.820  -4.081
  134   2HG   GLU  15          1HG       GLU  15   8.097  -1.539  -4.619
  135    H    THR  16           H        THR  16   5.899  -3.779  -1.820
  136    HA   THR  16           HA       THR  16   6.055  -3.640   1.067
  137    HB   THR  16           HB       THR  16   3.952  -2.691   1.004
  138    HG1  THR  16           1HG      THR  16   3.293  -5.417   0.822
  139   1HG2  THR  16          1HG2      THR  16   3.255  -4.425  -1.348
  140   2HG2  THR  16          2HG2      THR  16   3.523  -2.684  -1.356
  141   3HG2  THR  16          3HG2      THR  16   2.131  -3.359  -0.507
  142    H    THR  17           H        THR  17   5.307  -5.758   2.076
  143    HA   THR  17           HA       THR  17   5.526  -8.023   0.237
  144    HB   THR  17           HB       THR  17   7.251  -9.083   1.654
  145    HG1  THR  17           1HG      THR  17   6.786  -7.779   3.536
  146   1HG2  THR  17          1HG2      THR  17   7.680  -7.196  -0.271
  147   2HG2  THR  17          2HG2      THR  17   8.914  -8.224   0.458
  148   3HG2  THR  17          3HG2      THR  17   8.642  -6.595   1.079
  149    H    THR  18           H        THR  18   4.026  -9.444   0.656
  150    HA   THR  18           HA       THR  18   2.940  -9.702   3.402
  151    HB   THR  18           HB       THR  18   1.318  -9.002   1.645
  152    HG1  THR  18           1HG      THR  18   0.674 -10.291   3.448
  153   1HG2  THR  18          1HG2      THR  18   1.485  -9.903  -0.375
  154   2HG2  THR  18          2HG2      THR  18   0.676 -11.311   0.315
  155   3HG2  THR  18          3HG2      THR  18   2.435 -11.264   0.214
  156    H    GLU  19           H        GLU  19   2.743 -11.779   4.302
  157    HA   GLU  19           HA       GLU  19   4.315 -13.850   2.922
  158   1HB   GLU  19          2HB       GLU  19   5.143 -13.076   5.139
  159   2HB   GLU  19          1HB       GLU  19   3.647 -13.643   5.865
  160   1HG   GLU  19          2HG       GLU  19   5.438 -15.484   4.320
  161   2HG   GLU  19          1HG       GLU  19   5.711 -15.136   6.026
  162    H    ALA  20           H        ALA  20   3.193 -15.453   2.009
  163    HA   ALA  20           HA       ALA  20   0.909 -16.582   3.408
  164   1HB   ALA  20          1HB       ALA  20   0.486 -15.905   0.536
  165   2HB   ALA  20          2HB       ALA  20   0.221 -14.677   1.774
  166   3HB   ALA  20          3HB       ALA  20  -0.698 -16.182   1.814
  167    H    VAL  21           H        VAL  21   0.325 -18.644   2.730
  168    HA   VAL  21           HA       VAL  21   2.330 -20.412   2.102
  169    HB   VAL  21           HB       VAL  21  -0.569 -20.861   1.399
  170   1HG1  VAL  21          1HG1      VAL  21   1.606 -22.789   2.196
  171   2HG1  VAL  21          2HG1      VAL  21   0.972 -22.563   0.566
  172   3HG1  VAL  21          3HG1      VAL  21  -0.069 -23.204   1.837
  173   1HG2  VAL  21          1HG2      VAL  21   0.845 -20.864   4.037
  174   2HG2  VAL  21          2HG2      VAL  21  -0.551 -21.907   3.766
  175   3HG2  VAL  21          3HG2      VAL  21  -0.712 -20.158   3.603
  176    H    ASP  22           H        ASP  22   0.416 -18.521  -0.088
  177    HA   ASP  22           HA       ASP  22   2.119 -19.319  -2.286
  178   1HB   ASP  22          2HB       ASP  22   0.142 -19.847  -3.781
  179   2HB   ASP  22          1HB       ASP  22   0.536 -21.060  -2.567
  180    H    ALA  23           H        ALA  23   1.344 -18.158  -4.388
  181    HA   ALA  23           HA       ALA  23   1.452 -15.411  -3.907
  182   1HB   ALA  23          1HB       ALA  23   2.210 -15.827  -6.000
  183   2HB   ALA  23          2HB       ALA  23   0.542 -15.444  -6.423
  184   3HB   ALA  23          3HB       ALA  23   1.050 -17.126  -6.278
  185    H    ALA  24           H        ALA  24  -1.294 -17.495  -4.686
  186    HA   ALA  24           HA       ALA  24  -3.209 -15.440  -4.922
  187   1HB   ALA  24          1HB       ALA  24  -3.326 -18.380  -4.441
  188   2HB   ALA  24          2HB       ALA  24  -4.017 -17.424  -5.751
  189   3HB   ALA  24          3HB       ALA  24  -4.781 -17.423  -4.161
  190    H    THR  25           H        THR  25  -2.491 -17.593  -2.159
  191    HA   THR  25           HA       THR  25  -4.165 -16.412  -0.301
  192    HB   THR  25           HB       THR  25  -2.471 -17.201   1.401
  193    HG1  THR  25           1HG      THR  25  -0.993 -17.511  -0.910
  194   1HG2  THR  25          1HG2      THR  25  -4.162 -18.750   0.835
  195   2HG2  THR  25          2HG2      THR  25  -2.628 -19.617   0.818
  196   3HG2  THR  25          3HG2      THR  25  -3.384 -19.133  -0.699
  197    H    ALA  26           H        ALA  26  -0.864 -15.556  -1.248
  198    HA   ALA  26           HA       ALA  26  -0.512 -13.410   0.539
  199   1HB   ALA  26          1HB       ALA  26   0.952 -12.661  -1.637
  200   2HB   ALA  26          2HB       ALA  26   0.803 -14.400  -1.892
  201   3HB   ALA  26          3HB       ALA  26   1.503 -13.785  -0.394
  202    H    GLU  27           H        GLU  27  -1.581 -13.459  -2.876
  203    HA   GLU  27           HA       GLU  27  -2.121 -10.782  -3.201
  204   1HB   GLU  27          2HB       GLU  27  -2.182 -12.412  -5.027
  205   2HB   GLU  27          1HB       GLU  27  -3.629 -13.137  -4.339
  206   1HG   GLU  27          2HG       GLU  27  -4.848 -11.055  -4.707
  207   2HG   GLU  27          1HG       GLU  27  -3.399 -10.330  -5.401
  208    H    LYS  28           H        LYS  28  -4.262 -13.334  -1.973
  209    HA   LYS  28           HA       LYS  28  -6.520 -11.703  -1.559
  210   1HB   LYS  28          2HB       LYS  28  -5.687 -14.232  -0.120
  211   2HB   LYS  28          1HB       LYS  28  -7.286 -13.505  -0.042
  212   1HG   LYS  28          2HG       LYS  28  -5.952 -14.660  -2.480
  213   2HG   LYS  28          1HG       LYS  28  -7.311 -15.346  -1.586
  214   1HD   LYS  28          2HD       LYS  28  -8.672 -13.397  -2.170
  215   2HD   LYS  28          1HD       LYS  28  -7.312 -12.714  -3.061
  216   1HE   LYS  28          2HE       LYS  28  -8.897 -13.797  -4.568
  217   2HE   LYS  28          1HE       LYS  28  -7.341 -14.627  -4.579
  218   1HZ   LYS  28          1HZ       LYS  28  -9.670 -15.505  -2.963
  219   2HZ   LYS  28          2HZ       LYS  28  -8.219 -16.341  -3.201
  220   3HZ   LYS  28          3HZ       LYS  28  -9.291 -16.127  -4.491
  221    H    VAL  29           H        VAL  29  -3.845 -12.638   0.559
  222    HA   VAL  29           HA       VAL  29  -4.756 -11.361   2.884
  223    HB   VAL  29           HB       VAL  29  -1.910 -11.875   1.995
  224   1HG1  VAL  29          1HG1      VAL  29  -1.364 -10.583   3.733
  225   2HG1  VAL  29          2HG1      VAL  29  -1.929 -11.920   4.736
  226   3HG1  VAL  29          3HG1      VAL  29  -3.011 -10.580   4.362
  227   1HG2  VAL  29          1HG2      VAL  29  -3.076 -13.528   4.111
  228   2HG2  VAL  29          2HG2      VAL  29  -2.111 -13.992   2.710
  229   3HG2  VAL  29          3HG2      VAL  29  -3.845 -13.722   2.536
  230    H    VAL  30           H        VAL  30  -2.886 -10.200   0.135
  231    HA   VAL  30           HA       VAL  30  -2.317  -7.635   1.223
  232    HB   VAL  30           HB       VAL  30  -2.541  -8.420  -1.686
  233   1HG1  VAL  30          1HG1      VAL  30  -2.454  -5.926  -0.845
  234   2HG1  VAL  30          2HG1      VAL  30  -1.508  -6.442  -2.239
  235   3HG1  VAL  30          3HG1      VAL  30  -0.738  -6.281  -0.663
  236   1HG2  VAL  30          1HG2      VAL  30   0.122  -8.175  -0.491
  237   2HG2  VAL  30          2HG2      VAL  30  -0.512  -9.376  -1.616
  238   3HG2  VAL  30          3HG2      VAL  30  -0.830  -9.532   0.112
  239    H    LYS  31           H        LYS  31  -4.818  -8.852  -1.033
  240    HA   LYS  31           HA       LYS  31  -6.237  -6.557  -1.517
  241   1HB   LYS  31          2HB       LYS  31  -7.216  -9.367  -1.049
  242   2HB   LYS  31          1HB       LYS  31  -8.295  -8.067  -1.527
  243   1HG   LYS  31          2HG       LYS  31  -7.043  -7.755  -3.580
  244   2HG   LYS  31          1HG       LYS  31  -5.914  -9.025  -3.096
  245   1HD   LYS  31          2HD       LYS  31  -7.710 -10.661  -3.117
  246   2HD   LYS  31          1HD       LYS  31  -8.879  -9.401  -3.515
  247   1HE   LYS  31          2HE       LYS  31  -7.737  -8.995  -5.632
  248   2HE   LYS  31          1HE       LYS  31  -6.540 -10.225  -5.233
  249   1HZ   LYS  31          1HZ       LYS  31  -8.076 -11.920  -5.494
  250   2HZ   LYS  31          2HZ       LYS  31  -8.485 -10.861  -6.747
  251   3HZ   LYS  31          3HZ       LYS  31  -9.411 -10.894  -5.331
  252    H    GLN  32           H        GLN  32  -6.493  -8.723   1.241
  253    HA   GLN  32           HA       GLN  32  -8.551  -7.359   2.594
  254   1HB   GLN  32          2HB       GLN  32  -7.533  -9.694   3.063
  255   2HB   GLN  32          1HB       GLN  32  -6.342  -8.824   4.019
  256   1HG   GLN  32          2HG       GLN  32  -8.162  -9.697   5.389
  257   2HG   GLN  32          1HG       GLN  32  -8.087  -7.936   5.441
  258   1HE2  GLN  32          1HE2      GLN  32 -10.004 -10.645   4.790
  259   2HE2  GLN  32          2HE2      GLN  32 -11.395  -9.825   4.180
  260    H    PHE  33           H        PHE  33  -5.085  -6.938   2.485
  261    HA   PHE  33           HA       PHE  33  -4.670  -5.184   4.600
  262   1HB   PHE  33          2HB       PHE  33  -2.915  -6.260   3.140
  263   2HB   PHE  33          1HB       PHE  33  -3.305  -5.078   1.896
  264    HD1  PHE  33           1HD      PHE  33  -2.384  -5.204   5.498
  265    HD2  PHE  33           2HD      PHE  33  -1.999  -3.194   1.755
  266    HE1  PHE  33           1HE      PHE  33  -0.807  -3.603   6.503
  267    HE2  PHE  33           2HE      PHE  33  -0.411  -1.612   2.769
  268    HZ   PHE  33           HZ       PHE  33   0.184  -1.826   5.152
  269    H    PHE  34           H        PHE  34  -5.094  -4.319   1.189
  270    HA   PHE  34           HA       PHE  34  -5.556  -1.556   1.709
  271   1HB   PHE  34          2HB       PHE  34  -6.183  -3.161  -0.772
  272   2HB   PHE  34          1HB       PHE  34  -6.094  -1.401  -0.669
  273    HD1  PHE  34           1HD      PHE  34  -3.805  -0.727   0.739
  274    HD2  PHE  34           2HD      PHE  34  -4.365  -4.056  -1.838
  275    HE1  PHE  34           1HE      PHE  34  -1.377  -0.846   0.377
  276    HE2  PHE  34           2HE      PHE  34  -1.937  -4.179  -2.217
  277    HZ   PHE  34           HZ       PHE  34  -0.448  -2.572  -1.094
  278    H    ASN  35           H        ASN  35  -7.659  -4.304   1.079
  279    HA   ASN  35           HA       ASN  35 -10.121  -3.080   0.819
  280   1HB   ASN  35          2HB       ASN  35  -9.746  -5.508   0.634
  281   2HB   ASN  35          1HB       ASN  35  -9.441  -5.597   2.365
  282   1HD2  ASN  35          1HD2      ASN  35 -11.587  -6.373   0.195
  283   2HD2  ASN  35          2HD2      ASN  35 -13.062  -6.165   1.071
  284    H    ASP  36           H        ASP  36  -8.204  -3.733   3.654
  285    HA   ASP  36           HA       ASP  36 -10.193  -2.565   5.443
  286   1HB   ASP  36          2HB       ASP  36  -7.555  -3.905   6.067
  287   2HB   ASP  36          1HB       ASP  36  -8.716  -3.341   7.264
  288    H    ASN  37           H        ASN  37  -7.177  -1.689   3.930
  289    HA   ASN  37           HA       ASN  37  -6.630   0.447   5.812
  290   1HB   ASN  37          2HB       ASN  37  -5.400  -0.192   3.119
  291   2HB   ASN  37          1HB       ASN  37  -4.869   1.120   4.161
  292   1HD2  ASN  37          1HD2      ASN  37  -3.671  -1.495   3.134
  293   2HD2  ASN  37          2HD2      ASN  37  -3.004  -2.205   4.562
  294    H    GLY  38           H        GLY  38  -7.752   0.119   2.504
  295   1HA   GLY  38          2HA       GLY  38  -8.139   2.172   1.166
  296   2HA   GLY  38          1HA       GLY  38  -9.617   1.408   1.702
  297    H    VAL  39           H        VAL  39 -11.061   2.675   2.553
  298    HA   VAL  39           HA       VAL  39 -10.439   5.420   3.029
  299    HB   VAL  39           HB       VAL  39 -13.039   3.934   3.150
  300   1HG1  VAL  39          1HG1      VAL  39 -13.760   6.509   2.812
  301   2HG1  VAL  39          2HG1      VAL  39 -12.355   6.714   3.858
  302   3HG1  VAL  39          3HG1      VAL  39 -13.705   5.709   4.384
  303   1HG2  VAL  39          1HG2      VAL  39 -13.168   4.239   0.953
  304   2HG2  VAL  39          2HG2      VAL  39 -11.472   4.721   0.994
  305   3HG2  VAL  39          3HG2      VAL  39 -12.742   5.944   1.099
  306    H    ASP  40           H        ASP  40 -12.009   2.986   5.187
  307    HA   ASP  40           HA       ASP  40 -11.714   4.869   7.362
  308   1HB   ASP  40          2HB       ASP  40 -12.986   2.134   7.265
  309   2HB   ASP  40          1HB       ASP  40 -13.016   3.214   8.655
  310    H    GLY  41           H        GLY  41  -9.273   3.515   6.259
  311   1HA   GLY  41          2HA       GLY  41  -8.432   1.608   8.219
  312   2HA   GLY  41          1HA       GLY  41  -7.394   2.434   7.064
  313    H    GLU  42           H        GLU  42  -6.576   1.948   9.703
  314    HA   GLU  42           HA       GLU  42  -6.914   4.460  11.146
  315   1HB   GLU  42          2HB       GLU  42  -5.367   1.964  11.875
  316   2HB   GLU  42          1HB       GLU  42  -5.610   3.353  12.925
  317   1HG   GLU  42          2HG       GLU  42  -8.017   2.949  12.908
  318   2HG   GLU  42          1HG       GLU  42  -7.774   1.556  11.855
  319    H    TRP  43           H        TRP  43  -5.764   6.008  10.038
  320    HA   TRP  43           HA       TRP  43  -2.996   5.451   9.304
  321   1HB   TRP  43          2HB       TRP  43  -4.734   7.854   8.736
  322   2HB   TRP  43          1HB       TRP  43  -3.116   7.588   8.099
  323    HD1  TRP  43           HD       TRP  43  -6.107   5.121   8.172
  324    HE1  TRP  43           1HE      TRP  43  -6.548   4.350   5.755
  325    HE3  TRP  43           3HE      TRP  43  -2.629   7.979   5.794
  326    HZ2  TRP  43           2HZ      TRP  43  -5.538   4.901   3.172
  327    HZ3  TRP  43           3HZ      TRP  43  -2.419   7.803   3.361
  328    HH2  TRP  43           HH       TRP  43  -3.843   6.298   2.067
  329    H    THR  44           H        THR  44  -1.404   5.938  10.645
  330    HA   THR  44           HA       THR  44  -1.765   8.157  12.545
  331    HB   THR  44           HB       THR  44   0.105   7.107  13.811
  332    HG1  THR  44           1HG      THR  44   0.742   5.011  13.198
  333   1HG2  THR  44          1HG2      THR  44  -1.220   5.710  14.951
  334   2HG2  THR  44          2HG2      THR  44  -1.687   4.805  13.512
  335   3HG2  THR  44          3HG2      THR  44  -2.476   6.338  13.884
  336    H    TYR  45           H        TYR  45  -0.360   9.875  12.493
  337    HA   TYR  45           HA       TYR  45   1.615   9.852  10.312
  338   1HB   TYR  45          2HB       TYR  45  -0.244  11.491  10.111
  339   2HB   TYR  45          1HB       TYR  45   0.286  12.237  11.614
  340    HD1  TYR  45           1HD      TYR  45   2.564  10.975   8.987
  341    HD2  TYR  45           2HD      TYR  45   0.761  14.401  10.753
  342    HE1  TYR  45           1HE      TYR  45   4.089  12.427   7.715
  343    HE2  TYR  45           2HE      TYR  45   2.279  15.861   9.485
  344    HH   TYR  45           HH       TYR  45   4.998  15.029   8.214
  345    H    ASP  46           H        ASP  46   3.699  10.500  10.646
  346    HA   ASP  46           HA       ASP  46   4.471  11.087  13.428
  347   1HB   ASP  46          2HB       ASP  46   5.119   8.798  12.814
  348   2HB   ASP  46          1HB       ASP  46   5.989   9.413  11.412
  349    H    ASP  47           H        ASP  47   4.393  13.332  12.907
  350    HA   ASP  47           HA       ASP  47   5.573  14.681  10.846
  351   1HB   ASP  47          2HB       ASP  47   5.547  15.501  13.757
  352   2HB   ASP  47          1HB       ASP  47   5.848  16.586  12.404
  353    H    ALA  48           H        ALA  48   7.161  13.331  13.685
  354    HA   ALA  48           HA       ALA  48   9.631  14.509  13.579
  355   1HB   ALA  48          1HB       ALA  48  10.482  12.646  14.778
  356   2HB   ALA  48          2HB       ALA  48   9.228  11.582  14.140
  357   3HB   ALA  48          3HB       ALA  48   8.805  12.862  15.277
  358    H    THR  49           H        THR  49   8.410  11.931  11.515
  359    HA   THR  49           HA       THR  49  10.854  12.195   9.893
  360    HB   THR  49           HB       THR  49  10.680   9.795   9.336
  361    HG1  THR  49           1HG      THR  49   8.919   8.799   9.823
  362   1HG2  THR  49          1HG2      THR  49  11.028  10.600  12.184
  363   2HG2  THR  49          2HG2      THR  49  12.229  10.045  11.018
  364   3HG2  THR  49          3HG2      THR  49  11.092   8.897  11.727
  365    H    LYS  50           H        LYS  50   7.851  13.118   9.846
  366    HA   LYS  50           HA       LYS  50   6.198  13.437   8.289
  367   1HB   LYS  50          2HB       LYS  50   8.599  13.353   6.461
  368   2HB   LYS  50          1HB       LYS  50   7.017  13.996   6.035
  369   1HG   LYS  50          2HG       LYS  50   7.601  15.348   8.340
  370   2HG   LYS  50          1HG       LYS  50   9.179  15.204   7.565
  371   1HD   LYS  50          2HD       LYS  50   6.704  16.216   6.188
  372   2HD   LYS  50          1HD       LYS  50   7.901  17.262   6.952
  373   1HE   LYS  50          2HE       LYS  50   8.352  17.165   4.593
  374   2HE   LYS  50          1HE       LYS  50   9.627  16.302   5.451
  375   1HZ   LYS  50          1HZ       LYS  50   7.297  14.848   4.375
  376   2HZ   LYS  50          2HZ       LYS  50   8.846  14.265   4.724
  377   3HZ   LYS  50          3HZ       LYS  50   8.598  15.244   3.370
  378    H    THR  51           H        THR  51   6.528  10.744   9.028
  379    HA   THR  51           HA       THR  51   6.012   9.327   6.506
  380    HB   THR  51           HB       THR  51   6.971   8.269   9.170
  381    HG1  THR  51           1HG      THR  51   8.474   9.416   7.725
  382   1HG2  THR  51          1HG2      THR  51   6.288   6.267   8.549
  383   2HG2  THR  51          2HG2      THR  51   7.425   6.360   7.204
  384   3HG2  THR  51          3HG2      THR  51   5.752   6.871   6.981
  385    H    PHE  52           H        PHE  52   4.227   7.920   6.364
  386    HA   PHE  52           HA       PHE  52   2.208   8.324   8.471
  387   1HB   PHE  52          2HB       PHE  52   1.738   7.894   5.521
  388   2HB   PHE  52          1HB       PHE  52   0.495   8.094   6.750
  389    HD1  PHE  52           1HD      PHE  52  -0.359  10.197   7.161
  390    HD2  PHE  52           2HD      PHE  52   3.464   9.834   5.328
  391    HE1  PHE  52           1HE      PHE  52  -0.287  12.635   6.840
  392    HE2  PHE  52           2HE      PHE  52   3.544  12.272   5.004
  393    HZ   PHE  52           HZ       PHE  52   1.668  13.676   5.761
  394    H    THR  53           H        THR  53   2.516   6.568   9.624
  395    HA   THR  53           HA       THR  53   2.749   3.927   8.497
  396    HB   THR  53           HB       THR  53   2.360   3.254  10.988
  397    HG1  THR  53           1HG      THR  53   1.643   5.476  11.459
  398   1HG2  THR  53          1HG2      THR  53   4.759   4.570   9.828
  399   2HG2  THR  53          2HG2      THR  53   4.504   2.889  10.303
  400   3HG2  THR  53          3HG2      THR  53   4.744   4.129  11.537
  401    H    VAL  54           H        VAL  54   1.186   2.691   7.822
  402    HA   VAL  54           HA       VAL  54  -1.557   3.211   8.755
  403    HB   VAL  54           HB       VAL  54  -0.663   1.901   6.171
  404   1HG1  VAL  54          1HG1      VAL  54  -3.051   2.035   5.557
  405   2HG1  VAL  54          2HG1      VAL  54  -3.420   2.590   7.190
  406   3HG1  VAL  54          3HG1      VAL  54  -2.766   0.971   6.935
  407   1HG2  VAL  54          1HG2      VAL  54  -0.563   4.543   6.723
  408   2HG2  VAL  54          2HG2      VAL  54  -2.220   4.401   6.138
  409   3HG2  VAL  54          3HG2      VAL  54  -0.879   3.883   5.117
  410    H    THR  55           H        THR  55  -2.086   1.827  10.314
  411    HA   THR  55           HA       THR  55  -1.076  -0.920  10.191
  412    HB   THR  55           HB       THR  55  -2.437   0.491  12.488
  413    HG1  THR  55           1HG      THR  55  -0.303   1.289  11.817
  414   1HG2  THR  55          1HG2      THR  55  -2.570  -1.969  12.587
  415   2HG2  THR  55          2HG2      THR  55  -1.590  -1.273  13.879
  416   3HG2  THR  55          3HG2      THR  55  -0.809  -2.039  12.493
  417    H    GLU  56           H        GLU  56  -2.362  -2.456   9.382
  418    HA   GLU  56           HA       GLU  56  -4.922  -2.119   8.486
  419   1HB   GLU  56          2HB       GLU  56  -5.144  -4.544   8.462
  420   2HB   GLU  56          1HB       GLU  56  -3.534  -4.065   7.946
  421   1HG   GLU  56          2HG       GLU  56  -3.311  -5.958   9.352
  422   2HG   GLU  56          1HG       GLU  56  -2.725  -4.561  10.250
  423   1H    MET   1          1HT       MET   1   6.371  18.321  -3.440
  424   2H    MET   1          2HT       MET   1   5.626  19.334  -2.307
  425   3H    MET   1          3HT       MET   1   4.984  17.801  -2.621
  426    HA   MET   1           HA       MET   1   7.735  18.087  -1.618
  427   1HB   MET   1          2HB       MET   1   6.191  19.381  -0.153
  428   2HB   MET   1          1HB       MET   1   5.229  17.926   0.071
  429   1HG   MET   1          2HG       MET   1   6.673  18.293   1.971
  430   2HG   MET   1          1HG       MET   1   7.139  16.823   1.119
  431   1HE   MET   1          1HE       MET   1   9.329  16.890   2.552
  432   2HE   MET   1          2HE       MET   1   9.058  18.476   3.273
  433   3HE   MET   1          3HE       MET   1  10.572  18.135   2.438
  434    H    GLN   2           H        GLN   2   8.489  16.133  -0.681
  435    HA   GLN   2           HA       GLN   2   7.018  13.769  -1.618
  436   1HB   GLN   2          2HB       GLN   2   9.330  14.137  -2.477
  437   2HB   GLN   2          1HB       GLN   2   9.926  14.010  -0.829
  438   1HG   GLN   2          2HG       GLN   2  10.294  11.928  -1.899
  439   2HG   GLN   2          1HG       GLN   2   8.999  11.712  -0.728
  440   1HE2  GLN   2          1HE2      GLN   2   7.794  13.412  -3.346
  441   2HE2  GLN   2          2HE2      GLN   2   7.123  12.089  -4.225
  442    H    TYR   3           H        TYR   3   6.190  12.343  -0.213
  443    HA   TYR   3           HA       TYR   3   7.085  12.482   2.592
  444   1HB   TYR   3          2HB       TYR   3   4.273  12.087   1.553
  445   2HB   TYR   3          1HB       TYR   3   4.745  11.882   3.236
  446    HD1  TYR   3           1HD      TYR   3   5.175  13.785   4.646
  447    HD2  TYR   3           2HD      TYR   3   4.249  14.318   0.528
  448    HE1  TYR   3           1HE      TYR   3   4.810  16.184   5.046
  449    HE2  TYR   3           2HE      TYR   3   3.882  16.718   0.916
  450    HH   TYR   3           HH       TYR   3   4.726  18.448   2.679
  451    H    LYS   4           H        LYS   4   7.144  10.529   3.751
  452    HA   LYS   4           HA       LYS   4   7.194   8.151   2.015
  453   1HB   LYS   4          2HB       LYS   4   9.328   8.740   3.094
  454   2HB   LYS   4          1HB       LYS   4   8.563   8.617   4.671
  455   1HG   LYS   4          2HG       LYS   4   8.146   6.244   4.296
  456   2HG   LYS   4          1HG       LYS   4   8.888   6.362   2.700
  457   1HD   LYS   4          2HD       LYS   4  11.004   7.042   3.753
  458   2HD   LYS   4          1HD       LYS   4  10.255   6.873   5.342
  459   1HE   LYS   4          2HE       LYS   4  10.647   4.678   3.310
  460   2HE   LYS   4          1HE       LYS   4  11.584   4.906   4.786
  461   1HZ   LYS   4          1HZ       LYS   4   8.958   3.757   4.426
  462   2HZ   LYS   4          2HZ       LYS   4   9.073   4.830   5.728
  463   3HZ   LYS   4          3HZ       LYS   4  10.101   3.490   5.646
  464    H    VAL   5           H        VAL   5   5.275   7.159   2.134
  465    HA   VAL   5           HA       VAL   5   3.905   6.972   4.704
  466    HB   VAL   5           HB       VAL   5   2.986   6.163   1.941
  467   1HG1  VAL   5          1HG1      VAL   5   1.574   6.132   4.600
  468   2HG1  VAL   5          2HG1      VAL   5   1.856   4.777   3.506
  469   3HG1  VAL   5          3HG1      VAL   5   0.731   6.058   3.050
  470   1HG2  VAL   5          1HG2      VAL   5   2.809   8.658   3.503
  471   2HG2  VAL   5          2HG2      VAL   5   1.336   8.150   2.678
  472   3HG2  VAL   5          3HG2      VAL   5   2.818   8.408   1.758
  473    H    ILE   6           H        ILE   6   3.874   5.187   5.892
  474    HA   ILE   6           HA       ILE   6   5.025   2.740   4.726
  475    HB   ILE   6           HB       ILE   6   4.925   3.551   7.638
  476   1HG1  ILE   6          2HG1      ILE   6   7.266   3.407   5.727
  477   2HG1  ILE   6          1HG1      ILE   6   6.494   4.893   6.267
  478   1HG2  ILE   6          1HG2      ILE   6   4.898   1.038   6.900
  479   2HG2  ILE   6          2HG2      ILE   6   5.968   1.576   8.193
  480   3HG2  ILE   6          3HG2      ILE   6   6.605   1.330   6.568
  481   1HD1  ILE   6          1HD1      ILE   6   7.090   4.139   8.626
  482   2HD1  ILE   6          2HD1      ILE   6   8.409   4.680   7.588
  483   3HD1  ILE   6          3HD1      ILE   6   8.143   2.957   7.850
  484    H    LEU   7           H        LEU   7   3.851   0.948   4.644
  485    HA   LEU   7           HA       LEU   7   1.167   1.004   5.847
  486   1HB   LEU   7          2HB       LEU   7   2.071  -0.812   3.620
  487   2HB   LEU   7          1HB       LEU   7   0.432  -0.381   4.076
  488    HG   LEU   7           HG       LEU   7   2.435   1.459   2.786
  489   1HD1  LEU   7          1HD1      LEU   7  -0.160   0.512   1.624
  490   2HD1  LEU   7          2HD1      LEU   7   1.327  -0.415   1.427
  491   3HD1  LEU   7          3HD1      LEU   7   1.226   1.232   0.807
  492   1HD2  LEU   7          1HD2      LEU   7  -0.468   2.040   3.259
  493   2HD2  LEU   7          2HD2      LEU   7   0.842   3.158   2.872
  494   3HD2  LEU   7          3HD2      LEU   7   0.752   2.424   4.472
  495    H    ASN   8           H        ASN   8   1.651   0.164   7.876
  496    HA   ASN   8           HA       ASN   8   3.048  -2.395   8.015
  497   1HB   ASN   8          2HB       ASN   8   2.100  -0.579  10.240
  498   2HB   ASN   8          1HB       ASN   8   3.093  -2.020  10.439
  499   1HD2  ASN   8          1HD2      ASN   8   5.171  -1.658  10.633
  500   2HD2  ASN   8          2HD2      ASN   8   6.034  -0.297  10.012
  501    H    GLY   9           H        GLY   9   1.776  -4.118   7.659
  502   1HA   GLY   9          2HA       GLY   9  -0.881  -4.150   8.950
  503   2HA   GLY   9          1HA       GLY   9  -0.465  -5.060   7.505
  504    H    LYS  10           H        LYS  10  -1.543  -6.672   9.066
  505    HA   LYS  10           HA       LYS  10   0.170  -7.711  11.120
  506   1HB   LYS  10          2HB       LYS  10  -2.369  -8.779   9.875
  507   2HB   LYS  10          1HB       LYS  10  -1.529  -9.561  11.207
  508   1HG   LYS  10          2HG       LYS  10  -1.936  -7.694  12.645
  509   2HG   LYS  10          1HG       LYS  10  -2.599  -6.753  11.309
  510   1HD   LYS  10          2HD       LYS  10  -4.379  -7.661  12.716
  511   2HD   LYS  10          1HD       LYS  10  -4.441  -8.347  11.094
  512   1HE   LYS  10          2HE       LYS  10  -3.281 -10.351  11.907
  513   2HE   LYS  10          1HE       LYS  10  -3.244  -9.664  13.530
  514   1HZ   LYS  10          1HZ       LYS  10  -5.115 -10.896  13.707
  515   2HZ   LYS  10          2HZ       LYS  10  -5.474 -10.829  12.056
  516   3HZ   LYS  10          3HZ       LYS  10  -5.829  -9.508  13.052
  517    H    THR  11           H        THR  11  -1.034  -8.906   8.000
  518    HA   THR  11           HA       THR  11   1.151 -10.841   7.877
  519    HB   THR  11           HB       THR  11  -0.320 -11.607   5.861
  520    HG1  THR  11           1HG      THR  11  -2.584 -11.081   6.423
  521   1HG2  THR  11          1HG2      THR  11  -0.173 -12.501   8.408
  522   2HG2  THR  11          2HG2      THR  11  -1.168 -13.234   7.149
  523   3HG2  THR  11          3HG2      THR  11  -1.884 -12.095   8.290
  524    H    LEU  12           H        LEU  12   0.607  -7.755   6.939
  525    HA   LEU  12           HA       LEU  12   2.360  -8.064   4.618
  526   1HB   LEU  12          2HB       LEU  12   0.113  -7.813   3.743
  527   2HB   LEU  12          1HB       LEU  12  -0.131  -6.368   4.709
  528    HG   LEU  12           HG       LEU  12   1.496  -5.160   3.412
  529   1HD1  LEU  12          1HD1      LEU  12   3.192  -6.297   2.545
  530   2HD1  LEU  12          2HD1      LEU  12   2.098  -6.813   1.259
  531   3HD1  LEU  12          3HD1      LEU  12   2.326  -7.820   2.686
  532   1HD2  LEU  12          1HD2      LEU  12   0.014  -4.717   1.810
  533   2HD2  LEU  12          2HD2      LEU  12  -0.946  -6.041   2.471
  534   3HD2  LEU  12          3HD2      LEU  12   0.154  -6.336   1.126
  535    H    LYS  13           H        LYS  13   3.892  -6.535   4.371
  536    HA   LYS  13           HA       LYS  13   3.817  -4.117   6.007
  537   1HB   LYS  13          2HB       LYS  13   6.076  -6.125   6.115
  538   2HB   LYS  13          1HB       LYS  13   6.107  -4.530   6.854
  539   1HG   LYS  13          2HG       LYS  13   4.346  -5.128   8.366
  540   2HG   LYS  13          1HG       LYS  13   4.115  -6.675   7.550
  541   1HD   LYS  13          2HD       LYS  13   6.634  -5.826   8.977
  542   2HD   LYS  13          1HD       LYS  13   5.394  -6.884   9.652
  543   1HE   LYS  13          2HE       LYS  13   5.776  -8.466   7.800
  544   2HE   LYS  13          1HE       LYS  13   7.060  -7.420   7.195
  545   1HZ   LYS  13          1HZ       LYS  13   7.367  -8.116   9.966
  546   2HZ   LYS  13          2HZ       LYS  13   8.487  -8.196   8.702
  547   3HZ   LYS  13          3HZ       LYS  13   7.391  -9.461   8.939
  548    H    GLY  14           H        GLY  14   4.954  -2.394   5.101
  549   1HA   GLY  14          2HA       GLY  14   6.943  -2.705   3.109
  550   2HA   GLY  14          1HA       GLY  14   5.389  -2.424   2.344
  551    H    GLU  15           H        GLU  15   6.841  -0.591   1.577
  552    HA   GLU  15           HA       GLU  15   6.222   1.755   3.207
  553   1HB   GLU  15          2HB       GLU  15   8.927   1.239   1.951
  554   2HB   GLU  15          1HB       GLU  15   8.435   2.744   2.712
  555   1HG   GLU  15          2HG       GLU  15   9.734   1.636   4.307
  556   2HG   GLU  15          1HG       GLU  15   8.066   1.396   4.822
  557    H    THR  16           H        THR  16   5.964   3.687   1.993
  558    HA   THR  16           HA       THR  16   6.155   3.543  -0.891
  559    HB   THR  16           HB       THR  16   4.029   2.647  -0.858
  560    HG1  THR  16           1HG      THR  16   3.436   5.389  -0.684
  561   1HG2  THR  16          1HG2      THR  16   3.342   4.398   1.483
  562   2HG2  THR  16          2HG2      THR  16   3.568   2.652   1.497
  563   3HG2  THR  16          3HG2      THR  16   2.205   3.359   0.627
  564    H    THR  17           H        THR  17   5.473   5.679  -1.911
  565    HA   THR  17           HA       THR  17   5.721   7.939  -0.069
  566    HB   THR  17           HB       THR  17   7.492   8.957  -1.460
  567    HG1  THR  17           1HG      THR  17   7.021   7.665  -3.348
  568   1HG2  THR  17          1HG2      THR  17   7.847   7.061   0.470
  569   2HG2  THR  17          2HG2      THR  17   9.117   8.057  -0.241
  570   3HG2  THR  17          3HG2      THR  17   8.813   6.436  -0.865
  571    H    THR  18           H        THR  18   4.262   9.395  -0.509
  572    HA   THR  18           HA       THR  18   3.223   9.680  -3.270
  573    HB   THR  18           HB       THR  18   1.560   9.019  -1.535
  574    HG1  THR  18           1HG      THR  18   0.971  10.323  -3.348
  575   1HG2  THR  18          1HG2      THR  18   1.719   9.917   0.487
  576   2HG2  THR  18          2HG2      THR  18   0.955  11.344  -0.213
  577   3HG2  THR  18          3HG2      THR  18   2.711  11.255  -0.089
  578    H    GLU  19           H        GLU  19   3.089  11.760  -4.171
  579    HA   GLU  19           HA       GLU  19   4.691  13.793  -2.770
  580   1HB   GLU  19          2HB       GLU  19   5.531  12.999  -4.973
  581   2HB   GLU  19          1HB       GLU  19   4.060  13.602  -5.722
  582   1HG   GLU  19          2HG       GLU  19   5.872  15.399  -4.151
  583   2HG   GLU  19          1HG       GLU  19   6.162  15.045  -5.852
  584    H    ALA  20           H        ALA  20   3.597  15.424  -1.871
  585    HA   ALA  20           HA       ALA  20   1.360  16.607  -3.303
  586   1HB   ALA  20          1HB       ALA  20   0.880  15.941  -0.436
  587   2HB   ALA  20          2HB       ALA  20   0.603  14.719  -1.679
  588   3HB   ALA  20          3HB       ALA  20  -0.279  16.247  -1.731
  589    H    VAL  21           H        VAL  21   0.817  18.683  -2.632
  590    HA   VAL  21           HA       VAL  21   2.855  20.403  -1.976
  591    HB   VAL  21           HB       VAL  21  -0.044  20.921  -1.314
  592   1HG1  VAL  21          1HG1      VAL  21   2.191  22.795  -2.079
  593   2HG1  VAL  21          2HG1      VAL  21   1.528  22.585  -0.459
  594   3HG1  VAL  21          3HG1      VAL  21   0.520  23.251  -1.744
  595   1HG2  VAL  21          1HG2      VAL  21   1.409  20.889  -3.931
  596   2HG2  VAL  21          2HG2      VAL  21   0.036  21.965  -3.680
  597   3HG2  VAL  21          3HG2      VAL  21  -0.171  20.220  -3.520
  598    H    ASP  22           H        ASP  22   0.863  18.559   0.186
  599    HA   ASP  22           HA       ASP  22   2.554  19.315   2.409
  600   1HB   ASP  22          2HB       ASP  22   0.570  19.892   3.876
  601   2HB   ASP  22          1HB       ASP  22   1.011  21.094   2.669
  602    H    ALA  23           H        ALA  23   1.721  18.173   4.500
  603    HA   ALA  23           HA       ALA  23   1.771  15.424   4.018
  604   1HB   ALA  23          1HB       ALA  23   2.510  15.822   6.122
  605   2HB   ALA  23          2HB       ALA  23   0.827  15.479   6.522
  606   3HB   ALA  23          3HB       ALA  23   1.377  17.148   6.384
  607    H    ALA  24           H        ALA  24  -0.934  17.574   4.759
  608    HA   ALA  24           HA       ALA  24  -2.902  15.566   4.968
  609   1HB   ALA  24          1HB       ALA  24  -2.943  18.509   4.487
  610   2HB   ALA  24          2HB       ALA  24  -3.675  17.570   5.787
  611   3HB   ALA  24          3HB       ALA  24  -4.414  17.586   4.186
  612    H    THR  25           H        THR  25  -2.094  17.701   2.215
  613    HA   THR  25           HA       THR  25  -3.770  16.562   0.335
  614    HB   THR  25           HB       THR  25  -2.033  17.308  -1.343
  615    HG1  THR  25           1HG      THR  25  -0.581  17.583   0.989
  616   1HG2  THR  25          1HG2      THR  25  -3.694  18.898  -0.801
  617   2HG2  THR  25          2HG2      THR  25  -2.138  19.727  -0.762
  618   3HG2  THR  25          3HG2      THR  25  -2.928  19.262   0.744
  619    H    ALA  26           H        ALA  26  -0.503  15.625   1.328
  620    HA   ALA  26           HA       ALA  26  -0.179  13.471  -0.455
  621   1HB   ALA  26          1HB       ALA  26   1.236  12.688   1.742
  622   2HB   ALA  26          2HB       ALA  26   1.126  14.430   1.994
  623   3HB   ALA  26          3HB       ALA  26   1.832  13.797   0.506
  624    H    GLU  27           H        GLU  27  -1.294  13.547   2.945
  625    HA   GLU  27           HA       GLU  27  -1.904  10.884   3.263
  626   1HB   GLU  27          2HB       GLU  27  -1.950  12.514   5.087
  627   2HB   GLU  27          1HB       GLU  27  -3.371  13.275   4.380
  628   1HG   GLU  27          2HG       GLU  27  -4.644  11.223   4.729
  629   2HG   GLU  27          1HG       GLU  27  -3.224  10.463   5.444
  630    H    LYS  28           H        LYS  28  -3.963  13.487   2.005
  631    HA   LYS  28           HA       LYS  28  -6.254  11.912   1.560
  632   1HB   LYS  28          2HB       LYS  28  -5.340  14.419   0.132
  633   2HB   LYS  28          1HB       LYS  28  -6.956  13.731   0.031
  634   1HG   LYS  28          2HG       LYS  28  -5.629  14.853   2.488
  635   2HG   LYS  28          1HG       LYS  28  -6.958  15.572   1.575
  636   1HD   LYS  28          2HD       LYS  28  -8.373  13.656   2.137
  637   2HD   LYS  28          1HD       LYS  28  -7.043  12.941   3.050
  638   1HE   LYS  28          2HE       LYS  28  -8.623  14.063   4.535
  639   2HE   LYS  28          1HE       LYS  28  -7.046  14.853   4.568
  640   1HZ   LYS  28          1HZ       LYS  28  -9.331  15.788   2.919
  641   2HZ   LYS  28          2HZ       LYS  28  -7.864  16.589   3.177
  642   3HZ   LYS  28          3HZ       LYS  28  -8.960  16.402   4.451
  643    H    VAL  29           H        VAL  29  -3.528  12.781  -0.522
  644    HA   VAL  29           HA       VAL  29  -4.439  11.524  -2.858
  645    HB   VAL  29           HB       VAL  29  -1.593  11.970  -1.929
  646   1HG1  VAL  29          1HG1      VAL  29  -1.054  10.665  -3.662
  647   2HG1  VAL  29          2HG1      VAL  29  -1.571  12.015  -4.671
  648   3HG1  VAL  29          3HG1      VAL  29  -2.692  10.702  -4.313
  649   1HG2  VAL  29          1HG2      VAL  29  -2.689  13.651  -4.061
  650   2HG2  VAL  29          2HG2      VAL  29  -1.731  14.090  -2.646
  651   3HG2  VAL  29          3HG2      VAL  29  -3.474  13.864  -2.498
  652    H    VAL  30           H        VAL  30  -2.634  10.320  -0.087
  653    HA   VAL  30           HA       VAL  30  -2.113   7.741  -1.165
  654    HB   VAL  30           HB       VAL  30  -2.359   8.531   1.742
  655   1HG1  VAL  30          1HG1      VAL  30  -2.321   6.036   0.901
  656   2HG1  VAL  30          2HG1      VAL  30  -1.382   6.530   2.308
  657   3HG1  VAL  30          3HG1      VAL  30  -0.594   6.350   0.742
  658   1HG2  VAL  30          1HG2      VAL  30   0.314   8.222   0.583
  659   2HG2  VAL  30          2HG2      VAL  30  -0.306   9.438   1.700
  660   3HG2  VAL  30          3HG2      VAL  30  -0.597   9.603  -0.032
  661    H    LYS  31           H        LYS  31  -4.616   9.020   1.056
  662    HA   LYS  31           HA       LYS  31  -6.097   6.759   1.520
  663   1HB   LYS  31          2HB       LYS  31  -7.000   9.593   1.037
  664   2HB   LYS  31          1HB       LYS  31  -8.118   8.319   1.501
  665   1HG   LYS  31          2HG       LYS  31  -6.903   7.976   3.571
  666   2HG   LYS  31          1HG       LYS  31  -5.736   9.219   3.105
  667   1HD   LYS  31          2HD       LYS  31  -7.492  10.898   3.099
  668   2HD   LYS  31          1HD       LYS  31  -8.696   9.666   3.480
  669   1HE   LYS  31          2HE       LYS  31  -7.594   9.234   5.612
  670   2HE   LYS  31          1HE       LYS  31  -6.362  10.434   5.231
  671   1HZ   LYS  31          1HZ       LYS  31  -7.860  12.166   5.470
  672   2HZ   LYS  31          2HZ       LYS  31  -8.313  11.118   6.717
  673   3HZ   LYS  31          3HZ       LYS  31  -9.218  11.172   5.288
  674    H    GLN  32           H        GLN  32  -6.260   8.931  -1.243
  675    HA   GLN  32           HA       GLN  32  -8.333   7.617  -2.623
  676   1HB   GLN  32          2HB       GLN  32  -7.251   9.927  -3.077
  677   2HB   GLN  32          1HB       GLN  32  -6.069   9.027  -4.017
  678   1HG   GLN  32          2HG       GLN  32  -7.847   9.944  -5.413
  679   2HG   GLN  32          1HG       GLN  32  -7.814   8.181  -5.463
  680   1HE2  GLN  32          1HE2      GLN  32  -9.673  10.938  -4.838
  681   2HE2  GLN  32          2HE2      GLN  32 -11.093  10.149  -4.250
  682    H    PHE  33           H        PHE  33  -4.880   7.113  -2.465
  683    HA   PHE  33           HA       PHE  33  -4.478   5.347  -4.574
  684   1HB   PHE  33          2HB       PHE  33  -2.718   6.381  -3.090
  685   2HB   PHE  33          1HB       PHE  33  -3.154   5.209  -1.854
  686    HD1  PHE  33           1HD      PHE  33  -2.179   5.312  -5.441
  687    HD2  PHE  33           2HD      PHE  33  -1.897   3.292  -1.694
  688    HE1  PHE  33           1HE      PHE  33  -0.626   3.674  -6.423
  689    HE2  PHE  33           2HE      PHE  33  -0.335   1.673  -2.685
  690    HZ   PHE  33           HZ       PHE  33   0.301   1.872  -5.059
  691    H    PHE  34           H        PHE  34  -4.970   4.494  -1.171
  692    HA   PHE  34           HA       PHE  34  -5.492   1.743  -1.699
  693   1HB   PHE  34          2HB       PHE  34  -6.114   3.363   0.775
  694   2HB   PHE  34          1HB       PHE  34  -6.066   1.600   0.672
  695    HD1  PHE  34           1HD      PHE  34  -3.776   0.872  -0.703
  696    HD2  PHE  34           2HD      PHE  34  -4.292   4.215   1.867
  697    HE1  PHE  34           1HE      PHE  34  -1.351   0.931  -0.307
  698    HE2  PHE  34           2HE      PHE  34  -1.865   4.279   2.281
  699    HZ   PHE  34           HZ       PHE  34  -0.400   2.635   1.178
  700    H    ASN  35           H        ASN  35  -7.536   4.542  -1.098
  701    HA   ASN  35           HA       ASN  35 -10.031   3.377  -0.873
  702   1HB   ASN  35          2HB       ASN  35  -9.598   5.795  -0.682
  703   2HB   ASN  35          1HB       ASN  35  -9.267   5.877  -2.409
  704   1HD2  ASN  35          1HD2      ASN  35 -11.424   6.705  -0.269
  705   2HD2  ASN  35          2HD2      ASN  35 -12.892   6.534  -1.164
  706    H    ASP  36           H        ASP  36  -8.059   3.985  -3.679
  707    HA   ASP  36           HA       ASP  36 -10.050   2.865  -5.496
  708   1HB   ASP  36          2HB       ASP  36  -7.372   4.140  -6.083
  709   2HB   ASP  36          1HB       ASP  36  -8.529   3.602  -7.296
  710    H    ASN  37           H        ASN  37  -7.078   1.914  -3.942
  711    HA   ASN  37           HA       ASN  37  -6.555  -0.234  -5.816
  712   1HB   ASN  37          2HB       ASN  37  -5.349   0.376  -3.105
  713   2HB   ASN  37          1HB       ASN  37  -4.836  -0.951  -4.141
  714   1HD2  ASN  37          1HD2      ASN  37  -3.590   1.635  -3.096
  715   2HD2  ASN  37          2HD2      ASN  37  -2.886   2.329  -4.513
  716    H    GLY  38           H        GLY  38  -7.717   0.121  -2.523
  717   1HA   GLY  38          2HA       GLY  38  -8.170  -1.921  -1.193
  718   2HA   GLY  38          1HA       GLY  38  -9.623  -1.122  -1.749
  719    H    VAL  39           H        VAL  39 -11.086  -2.354  -2.621
  720    HA   VAL  39           HA       VAL  39 -10.524  -5.113  -3.087
  721    HB   VAL  39           HB       VAL  39 -13.085  -3.563  -3.245
  722   1HG1  VAL  39          1HG1      VAL  39 -13.872  -6.121  -2.918
  723   2HG1  VAL  39          2HG1      VAL  39 -12.459  -6.360  -3.943
  724   3HG1  VAL  39          3HG1      VAL  39 -13.776  -5.322  -4.489
  725   1HG2  VAL  39          1HG2      VAL  39 -13.252  -3.864  -1.049
  726   2HG2  VAL  39          2HG2      VAL  39 -11.567  -4.390  -1.069
  727   3HG2  VAL  39          3HG2      VAL  39 -12.865  -5.578  -1.191
  728    H    ASP  40           H        ASP  40 -12.003  -2.641  -5.268
  729    HA   ASP  40           HA       ASP  40 -11.723  -4.532  -7.437
  730   1HB   ASP  40          2HB       ASP  40 -12.930  -1.767  -7.358
  731   2HB   ASP  40          1HB       ASP  40 -12.966  -2.847  -8.750
  732    H    GLY  41           H        GLY  41  -9.267  -3.236  -6.301
  733   1HA   GLY  41          2HA       GLY  41  -8.352  -1.351  -8.248
  734   2HA   GLY  41          1HA       GLY  41  -7.350  -2.202  -7.079
  735    H    GLU  42           H        GLU  42  -6.484  -1.736  -9.706
  736    HA   GLU  42           HA       GLU  42  -6.863  -4.240 -11.154
  737   1HB   GLU  42          2HB       GLU  42  -5.244  -1.783 -11.860
  738   2HB   GLU  42          1HB       GLU  42  -5.506  -3.167 -12.914
  739   1HG   GLU  42          2HG       GLU  42  -7.903  -2.703 -12.931
  740   2HG   GLU  42          1HG       GLU  42  -7.641  -1.316 -11.875
  741    H    TRP  43           H        TRP  43  -5.767  -5.815 -10.029
  742    HA   TRP  43           HA       TRP  43  -2.996  -5.326  -9.258
  743   1HB   TRP  43          2HB       TRP  43  -4.800  -7.685  -8.714
  744   2HB   TRP  43          1HB       TRP  43  -3.186  -7.460  -8.054
  745    HD1  TRP  43           HD       TRP  43  -6.112  -4.919  -8.169
  746    HE1  TRP  43           1HE      TRP  43  -6.571  -4.138  -5.758
  747    HE3  TRP  43           3HE      TRP  43  -2.738  -7.861  -5.744
  748    HZ2  TRP  43           2HZ      TRP  43  -5.610  -4.713  -3.161
  749    HZ3  TRP  43           3HZ      TRP  43  -2.559  -7.691  -3.307
  750    HH2  TRP  43           HH       TRP  43  -3.966  -6.149  -2.033
  751    H    THR  44           H        THR  44  -1.398  -5.851 -10.577
  752    HA   THR  44           HA       THR  44  -1.784  -8.060 -12.481
  753    HB   THR  44           HB       THR  44   0.127  -7.057 -13.720
  754    HG1  THR  44           1HG      THR  44   0.807  -4.977 -13.097
  755   1HG2  THR  44          1HG2      THR  44  -1.147  -5.629 -14.880
  756   2HG2  THR  44          2HG2      THR  44  -1.612  -4.712 -13.447
  757   3HG2  THR  44          3HG2      THR  44  -2.432  -6.226 -13.830
  758    H    TYR  45           H        TYR  45  -0.423  -9.813 -12.410
  759    HA   TYR  45           HA       TYR  45   1.520  -9.839 -10.201
  760   1HB   TYR  45          2HB       TYR  45  -0.380 -11.431 -10.026
  761   2HB   TYR  45          1HB       TYR  45   0.153 -12.189 -11.522
  762    HD1  TYR  45           1HD      TYR  45   2.424 -10.984  -8.864
  763    HD2  TYR  45           2HD      TYR  45   0.562 -14.365 -10.654
  764    HE1  TYR  45           1HE      TYR  45   3.894 -12.471  -7.569
  765    HE2  TYR  45           2HE      TYR  45   2.027 -15.861  -9.365
  766    HH   TYR  45           HH       TYR  45   4.747 -15.095  -8.056
  767    H    ASP  46           H        ASP  46   3.593 -10.536 -10.506
  768    HA   ASP  46           HA       ASP  46   4.390 -11.141 -13.276
  769   1HB   ASP  46          2HB       ASP  46   5.085  -8.870 -12.652
  770   2HB   ASP  46          1HB       ASP  46   5.920  -9.508 -11.239
  771    H    ASP  47           H        ASP  47   4.251 -13.385 -12.757
  772    HA   ASP  47           HA       ASP  47   5.369 -14.762 -10.680
  773   1HB   ASP  47          2HB       ASP  47   5.362 -15.581 -13.591
  774   2HB   ASP  47          1HB       ASP  47   5.617 -16.673 -12.234
  775    H    ALA  48           H        ALA  48   7.028 -13.451 -13.494
  776    HA   ALA  48           HA       ALA  48   9.468 -14.689 -13.354
  777   1HB   ALA  48          1HB       ALA  48  10.379 -12.847 -14.542
  778   2HB   ALA  48          2HB       ALA  48   9.143 -11.753 -13.923
  779   3HB   ALA  48          3HB       ALA  48   8.705 -13.023 -15.064
  780    H    THR  49           H        THR  49   8.279 -12.081 -11.307
  781    HA   THR  49           HA       THR  49  10.692 -12.405  -9.651
  782    HB   THR  49           HB       THR  49  10.571 -10.002  -9.096
  783    HG1  THR  49           1HG      THR  49   8.841  -8.962  -9.608
  784   1HG2  THR  49          1HG2      THR  49  10.937 -10.814 -11.940
  785   2HG2  THR  49          2HG2      THR  49  12.136 -10.290 -10.755
  786   3HG2  THR  49          3HG2      THR  49  11.037  -9.115 -11.480
  787    H    LYS  50           H        LYS  50   7.668 -13.254  -9.647
  788    HA   LYS  50           HA       LYS  50   5.986 -13.533  -8.114
  789   1HB   LYS  50          2HB       LYS  50   8.363 -13.508  -6.253
  790   2HB   LYS  50          1HB       LYS  50   6.759 -14.110  -5.848
  791   1HG   LYS  50          2HG       LYS  50   7.343 -15.479  -8.145
  792   2HG   LYS  50          1HG       LYS  50   8.913 -15.371  -7.348
  793   1HD   LYS  50          2HD       LYS  50   6.395 -16.323  -6.007
  794   2HD   LYS  50          1HD       LYS  50   7.576 -17.398  -6.753
  795   1HE   LYS  50          2HE       LYS  50   7.996 -17.312  -4.389
  796   2HE   LYS  50          1HE       LYS  50   9.304 -16.479  -5.228
  797   1HZ   LYS  50          1HZ       LYS  50   6.995 -14.968  -4.184
  798   2HZ   LYS  50          2HZ       LYS  50   8.563 -14.425  -4.512
  799   3HZ   LYS  50          3HZ       LYS  50   8.272 -15.397  -3.161
  800    H    THR  51           H        THR  51   6.392 -10.847  -8.846
  801    HA   THR  51           HA       THR  51   5.875  -9.418  -6.333
  802    HB   THR  51           HB       THR  51   6.898  -8.385  -8.983
  803    HG1  THR  51           1HG      THR  51   8.351  -9.568  -7.517
  804   1HG2  THR  51          1HG2      THR  51   6.255  -6.366  -8.371
  805   2HG2  THR  51          2HG2      THR  51   7.369  -6.487  -7.011
  806   3HG2  THR  51          3HG2      THR  51   5.681  -6.955  -6.813
  807    H    PHE  52           H        PHE  52   4.123  -7.969  -6.214
  808    HA   PHE  52           HA       PHE  52   2.124  -8.325  -8.351
  809   1HB   PHE  52          2HB       PHE  52   1.624  -7.880  -5.408
  810   2HB   PHE  52          1HB       PHE  52   0.394  -8.053  -6.655
  811    HD1  PHE  52           1HD      PHE  52  -0.506 -10.133  -7.078
  812    HD2  PHE  52           2HD      PHE  52   3.300  -9.864  -5.191
  813    HE1  PHE  52           1HE      PHE  52  -0.496 -12.572  -6.756
  814    HE2  PHE  52           2HE      PHE  52   3.316 -12.302  -4.867
  815    HZ   PHE  52           HZ       PHE  52   1.416 -13.660  -5.650
  816    H    THR  53           H        THR  53   2.490  -6.577  -9.500
  817    HA   THR  53           HA       THR  53   2.773  -3.940  -8.369
  818    HB   THR  53           HB       THR  53   2.436  -3.259 -10.864
  819    HG1  THR  53           1HG      THR  53   1.671  -5.463 -11.347
  820   1HG2  THR  53          1HG2      THR  53   4.785  -4.633  -9.672
  821   2HG2  THR  53          2HG2      THR  53   4.577  -2.945 -10.150
  822   3HG2  THR  53          3HG2      THR  53   4.806  -4.192 -11.381
  823    H    VAL  54           H        VAL  54   1.231  -2.669  -7.714
  824    HA   VAL  54           HA       VAL  54  -1.511  -3.122  -8.688
  825    HB   VAL  54           HB       VAL  54  -0.622  -1.833  -6.090
  826   1HG1  VAL  54          1HG1      VAL  54  -3.020  -1.908  -5.512
  827   2HG1  VAL  54          2HG1      VAL  54  -3.380  -2.455  -7.149
  828   3HG1  VAL  54          3HG1      VAL  54  -2.690  -0.853  -6.885
  829   1HG2  VAL  54          1HG2      VAL  54  -0.578  -4.476  -6.642
  830   2HG2  VAL  54          2HG2      VAL  54  -2.240  -4.294  -6.080
  831   3HG2  VAL  54          3HG2      VAL  54  -0.900  -3.808  -5.041
  832    H    THR  55           H        THR  55  -1.985  -1.725 -10.252
  833    HA   THR  55           HA       THR  55  -0.909   0.997 -10.115
  834    HB   THR  55           HB       THR  55  -2.271  -0.380 -12.432
  835    HG1  THR  55           1HG      THR  55  -0.166  -1.230 -11.731
  836   1HG2  THR  55          1HG2      THR  55  -2.342   2.082 -12.532
  837   2HG2  THR  55          2HG2      THR  55  -1.363   1.362 -13.810
  838   3HG2  THR  55          3HG2      THR  55  -0.582   2.108 -12.414
  839    H    GLU  56           H        GLU  56  -2.169   2.563  -9.324
  840    HA   GLU  56           HA       GLU  56  -4.748   2.290  -8.466
  841   1HB   GLU  56          2HB       GLU  56  -4.912   4.718  -8.444
  842   2HB   GLU  56          1HB       GLU  56  -3.321   4.202  -7.905
  843   1HG   GLU  56          2HG       GLU  56  -3.033   6.088  -9.307
  844   2HG   GLU  56          1HG       GLU  56  -2.468   4.676 -10.197
  Start of MODEL   31
    1   1H    MET   1          1HT       MET   1   7.493 -18.361   4.085
    2   2H    MET   1          2HT       MET   1   6.647 -19.604   3.308
    3   3H    MET   1          3HT       MET   1   5.838 -18.191   3.768
    4    HA   MET   1           HA       MET   1   8.107 -18.073   1.895
    5   1HB   MET   1          2HB       MET   1   6.321 -19.767   1.197
    6   2HB   MET   1          1HB       MET   1   5.224 -18.401   1.061
    7   1HG   MET   1          2HG       MET   1   6.100 -18.952  -1.102
    8   2HG   MET   1          1HG       MET   1   6.727 -17.385  -0.595
    9   1HE   MET   1          1HE       MET   1   9.530 -18.165  -2.591
   10   2HE   MET   1          2HE       MET   1   7.779 -18.199  -2.792
   11   3HE   MET   1          3HE       MET   1   8.712 -19.688  -2.939
   12    H    GLN   2           H        GLN   2   8.474 -16.004   1.309
   13    HA   GLN   2           HA       GLN   2   6.455 -14.004   2.080
   14   1HB   GLN   2          2HB       GLN   2   8.556 -13.801   3.318
   15   2HB   GLN   2          1HB       GLN   2   9.449 -13.691   1.808
   16   1HG   GLN   2          2HG       GLN   2   8.305 -11.602   1.278
   17   2HG   GLN   2          1HG       GLN   2   7.403 -11.714   2.788
   18   1HE2  GLN   2          1HE2      GLN   2   9.905 -10.217   1.374
   19   2HE2  GLN   2          2HE2      GLN   2  10.884  -9.874   2.756
   20    H    TYR   3           H        TYR   3   5.955 -12.314   0.695
   21    HA   TYR   3           HA       TYR   3   7.031 -12.474  -2.037
   22   1HB   TYR   3          2HB       TYR   3   4.111 -12.206  -1.287
   23   2HB   TYR   3          1HB       TYR   3   4.749 -12.048  -2.919
   24    HD1  TYR   3           1HD      TYR   3   4.705 -13.908  -4.288
   25    HD2  TYR   3           2HD      TYR   3   4.772 -14.469  -0.073
   26    HE1  TYR   3           1HE      TYR   3   4.483 -16.335  -4.613
   27    HE2  TYR   3           2HE      TYR   3   4.552 -16.898  -0.385
   28    HH   TYR   3           HH       TYR   3   3.824 -18.299  -3.458
   29    H    LYS   4           H        LYS   4   6.984 -10.489  -3.212
   30    HA   LYS   4           HA       LYS   4   6.755  -8.143  -1.443
   31   1HB   LYS   4          2HB       LYS   4   9.017  -8.553  -2.292
   32   2HB   LYS   4          1HB       LYS   4   8.416  -8.496  -3.944
   33   1HG   LYS   4          2HG       LYS   4   7.798  -6.161  -3.655
   34   2HG   LYS   4          1HG       LYS   4   8.349  -6.213  -1.980
   35   1HD   LYS   4          2HD       LYS   4  10.620  -6.725  -2.754
   36   2HD   LYS   4          1HD       LYS   4  10.062  -6.650  -4.427
   37   1HE   LYS   4          2HE       LYS   4   9.427  -4.305  -4.105
   38   2HE   LYS   4          1HE       LYS   4   9.997  -4.382  -2.437
   39   1HZ   LYS   4          1HZ       LYS   4  11.735  -4.904  -4.782
   40   2HZ   LYS   4          2HZ       LYS   4  12.215  -4.700  -3.174
   41   3HZ   LYS   4          3HZ       LYS   4  11.595  -3.388  -4.044
   42    H    VAL   5           H        VAL   5   4.903  -7.110  -1.738
   43    HA   VAL   5           HA       VAL   5   3.691  -7.026  -4.395
   44    HB   VAL   5           HB       VAL   5   2.589  -6.099  -1.736
   45   1HG1  VAL   5          1HG1      VAL   5   1.435  -4.820  -3.282
   46   2HG1  VAL   5          2HG1      VAL   5   0.406  -6.244  -3.128
   47   3HG1  VAL   5          3HG1      VAL   5   1.483  -6.080  -4.515
   48   1HG2  VAL   5          1HG2      VAL   5   1.018  -8.160  -2.519
   49   2HG2  VAL   5          2HG2      VAL   5   2.389  -8.316  -1.419
   50   3HG2  VAL   5          3HG2      VAL   5   2.587  -8.683  -3.132
   51    H    ILE   6           H        ILE   6   3.530  -5.214  -5.580
   52    HA   ILE   6           HA       ILE   6   4.758  -2.770  -4.489
   53    HB   ILE   6           HB       ILE   6   4.734  -3.832  -7.317
   54   1HG1  ILE   6          2HG1      ILE   6   7.002  -3.278  -5.395
   55   2HG1  ILE   6          1HG1      ILE   6   6.357  -4.869  -5.777
   56   1HG2  ILE   6          1HG2      ILE   6   5.473  -1.878  -8.153
   57   2HG2  ILE   6          2HG2      ILE   6   6.328  -1.437  -6.675
   58   3HG2  ILE   6          3HG2      ILE   6   4.584  -1.205  -6.788
   59   1HD1  ILE   6          1HD1      ILE   6   8.285  -4.683  -7.069
   60   2HD1  ILE   6          2HD1      ILE   6   7.931  -3.015  -7.522
   61   3HD1  ILE   6          3HD1      ILE   6   6.974  -4.336  -8.196
   62    H    LEU   7           H        LEU   7   3.661  -0.894  -4.583
   63    HA   LEU   7           HA       LEU   7   0.998  -0.950  -5.841
   64   1HB   LEU   7          2HB       LEU   7   1.821   0.914  -3.631
   65   2HB   LEU   7          1HB       LEU   7   0.203   0.457  -4.133
   66    HG   LEU   7           HG       LEU   7   2.163  -1.344  -2.731
   67   1HD1  LEU   7          1HD1      LEU   7  -0.431  -0.352  -1.622
   68   2HD1  LEU   7          2HD1      LEU   7   1.031   0.625  -1.492
   69   3HD1  LEU   7          3HD1      LEU   7   0.981  -0.983  -0.773
   70   1HD2  LEU   7          1HD2      LEU   7  -0.743  -1.901  -3.200
   71   2HD2  LEU   7          2HD2      LEU   7   0.557  -3.025  -2.797
   72   3HD2  LEU   7          3HD2      LEU   7   0.466  -2.324  -4.412
   73    H    ASN   8           H        ASN   8   1.192   0.025  -7.784
   74    HA   ASN   8           HA       ASN   8   2.725   2.535  -7.935
   75   1HB   ASN   8          2HB       ASN   8   1.895   0.654 -10.152
   76   2HB   ASN   8          1HB       ASN   8   2.797   2.151 -10.375
   77   1HD2  ASN   8          1HD2      ASN   8   4.889   1.900 -10.577
   78   2HD2  ASN   8          2HD2      ASN   8   5.835   0.621  -9.905
   79    H    GLY   9           H        GLY   9   1.405   4.242  -7.647
   80   1HA   GLY   9          2HA       GLY   9  -1.201   4.188  -9.044
   81   2HA   GLY   9          1HA       GLY   9  -0.912   5.070  -7.554
   82    H    LYS  10           H        LYS  10  -1.864   6.828  -8.873
   83    HA   LYS  10           HA       LYS  10  -0.310   7.906 -11.016
   84   1HB   LYS  10          2HB       LYS  10  -2.532   9.179  -9.407
   85   2HB   LYS  10          1HB       LYS  10  -1.866   9.809 -10.907
   86   1HG   LYS  10          2HG       LYS  10  -2.627   7.768 -12.065
   87   2HG   LYS  10          1HG       LYS  10  -3.364   7.221 -10.558
   88   1HD   LYS  10          2HD       LYS  10  -4.059   9.740 -12.070
   89   2HD   LYS  10          1HD       LYS  10  -5.025   8.264 -12.006
   90   1HE   LYS  10          2HE       LYS  10  -5.278   8.550  -9.580
   91   2HE   LYS  10          1HE       LYS  10  -4.330  10.034  -9.663
   92   1HZ   LYS  10          1HZ       LYS  10  -6.191  10.576 -11.461
   93   2HZ   LYS  10          2HZ       LYS  10  -6.376  10.937  -9.819
   94   3HZ   LYS  10          3HZ       LYS  10  -7.086   9.544 -10.462
   95    H    THR  11           H        THR  11  -1.020   9.049  -7.708
   96    HA   THR  11           HA       THR  11   1.381  10.729  -7.828
   97    HB   THR  11           HB       THR  11   0.222  11.840  -5.829
   98    HG1  THR  11           1HG      THR  11  -2.192  11.449  -6.194
   99   1HG2  THR  11          1HG2      THR  11   0.237  12.765  -8.175
  100   2HG2  THR  11          2HG2      THR  11  -1.105  13.269  -7.148
  101   3HG2  THR  11          3HG2      THR  11  -1.352  12.025  -8.375
  102    H    LEU  12           H        LEU  12   0.706   7.753  -6.849
  103    HA   LEU  12           HA       LEU  12   2.504   7.978  -4.556
  104   1HB   LEU  12          2HB       LEU  12   0.263   7.924  -3.623
  105   2HB   LEU  12          1HB       LEU  12  -0.107   6.475  -4.533
  106    HG   LEU  12           HG       LEU  12   1.444   5.188  -3.228
  107   1HD1  LEU  12          1HD1      LEU  12   3.258   6.237  -2.489
  108   2HD1  LEU  12          2HD1      LEU  12   2.263   6.820  -1.154
  109   3HD1  LEU  12          3HD1      LEU  12   2.480   7.810  -2.594
  110   1HD2  LEU  12          1HD2      LEU  12  -0.026   4.920  -1.579
  111   2HD2  LEU  12          2HD2      LEU  12  -0.885   6.310  -2.246
  112   3HD2  LEU  12          3HD2      LEU  12   0.283   6.538  -0.947
  113    H    LYS  13           H        LYS  13   3.937   6.369  -4.328
  114    HA   LYS  13           HA       LYS  13   3.627   3.889  -5.827
  115   1HB   LYS  13          2HB       LYS  13   6.008   5.717  -6.199
  116   2HB   LYS  13          1HB       LYS  13   5.891   4.075  -6.815
  117   1HG   LYS  13          2HG       LYS  13   3.969   4.744  -8.191
  118   2HG   LYS  13          1HG       LYS  13   4.143   6.398  -7.600
  119   1HD   LYS  13          2HD       LYS  13   6.214   4.847  -9.152
  120   2HD   LYS  13          1HD       LYS  13   5.177   6.119  -9.798
  121   1HE   LYS  13          2HE       LYS  13   6.176   7.720  -8.242
  122   2HE   LYS  13          1HE       LYS  13   7.212   6.448  -7.596
  123   1HZ   LYS  13          1HZ       LYS  13   7.307   7.741 -10.245
  124   2HZ   LYS  13          2HZ       LYS  13   7.983   6.207 -10.014
  125   3HZ   LYS  13          3HZ       LYS  13   8.555   7.525  -9.121
  126    H    GLY  14           H        GLY  14   4.895   2.159  -4.976
  127   1HA   GLY  14          2HA       GLY  14   6.885   2.547  -3.000
  128   2HA   GLY  14          1HA       GLY  14   5.342   2.258  -2.222
  129    H    GLU  15           H        GLU  15   6.819   0.477  -1.409
  130    HA   GLU  15           HA       GLU  15   6.242  -1.923  -2.975
  131   1HB   GLU  15          2HB       GLU  15   8.943  -1.317  -1.752
  132   2HB   GLU  15          1HB       GLU  15   8.477  -2.851  -2.467
  133   1HG   GLU  15          2HG       GLU  15   9.743  -1.760  -4.099
  134   2HG   GLU  15          1HG       GLU  15   8.067  -1.575  -4.611
  135    H    THR  16           H        THR  16   5.617  -3.635  -1.765
  136    HA   THR  16           HA       THR  16   5.959  -3.524   1.135
  137    HB   THR  16           HB       THR  16   3.827  -2.631   1.070
  138    HG1  THR  16           1HG      THR  16   3.259  -5.379   0.938
  139   1HG2  THR  16          1HG2      THR  16   3.379  -2.672  -1.284
  140   2HG2  THR  16          2HG2      THR  16   2.018  -3.387  -0.418
  141   3HG2  THR  16          3HG2      THR  16   3.175  -4.422  -1.249
  142    H    THR  17           H        THR  17   5.206  -5.664   2.160
  143    HA   THR  17           HA       THR  17   5.544  -7.926   0.334
  144    HB   THR  17           HB       THR  17   7.231  -8.929   1.876
  145    HG1  THR  17           1HG      THR  17   7.106  -6.348   3.018
  146   1HG2  THR  17          1HG2      THR  17   7.881  -6.378   0.449
  147   2HG2  THR  17          2HG2      THR  17   8.190  -8.040  -0.057
  148   3HG2  THR  17          3HG2      THR  17   9.116  -7.335   1.268
  149    H    THR  18           H        THR  18   4.034  -9.369   0.708
  150    HA   THR  18           HA       THR  18   2.892  -9.646   3.422
  151    HB   THR  18           HB       THR  18   1.317  -9.003   1.582
  152    HG1  THR  18           1HG      THR  18   0.639 -10.244   3.411
  153   1HG2  THR  18          1HG2      THR  18   0.593 -10.837   0.045
  154   2HG2  THR  18          2HG2      THR  18   2.076 -11.688   0.472
  155   3HG2  THR  18          3HG2      THR  18   2.160 -10.119  -0.330
  156    H    GLU  19           H        GLU  19   2.805 -11.689   4.359
  157    HA   GLU  19           HA       GLU  19   4.434 -13.741   3.020
  158   1HB   GLU  19          2HB       GLU  19   5.273 -12.995   5.200
  159   2HB   GLU  19          1HB       GLU  19   3.739 -13.420   5.947
  160   1HG   GLU  19          2HG       GLU  19   4.114 -15.767   5.389
  161   2HG   GLU  19          1HG       GLU  19   5.650 -15.342   4.638
  162    H    ALA  20           H        ALA  20   3.308 -15.346   2.066
  163    HA   ALA  20           HA       ALA  20   1.075 -16.528   3.501
  164   1HB   ALA  20          1HB       ALA  20   0.125 -16.344   0.872
  165   2HB   ALA  20          2HB       ALA  20   0.718 -14.738   1.292
  166   3HB   ALA  20          3HB       ALA  20  -0.494 -15.521   2.304
  167    H    VAL  21           H        VAL  21   0.457 -18.558   2.745
  168    HA   VAL  21           HA       VAL  21   2.449 -20.347   2.154
  169    HB   VAL  21           HB       VAL  21  -0.427 -20.736   1.333
  170   1HG1  VAL  21          1HG1      VAL  21   0.209 -23.124   2.089
  171   2HG1  VAL  21          2HG1      VAL  21   1.869 -22.576   1.864
  172   3HG1  VAL  21          3HG1      VAL  21   0.741 -22.554   0.508
  173   1HG2  VAL  21          1HG2      VAL  21  -0.632 -20.056   3.541
  174   2HG2  VAL  21          2HG2      VAL  21   0.886 -20.814   4.022
  175   3HG2  VAL  21          3HG2      VAL  21  -0.527 -21.812   3.681
  176    H    ASP  22           H        ASP  22   0.711 -18.360  -0.100
  177    HA   ASP  22           HA       ASP  22   2.483 -19.187  -2.218
  178   1HB   ASP  22          2HB       ASP  22   0.597 -19.724  -3.809
  179   2HB   ASP  22          1HB       ASP  22   0.905 -20.930  -2.564
  180    H    ALA  23           H        ALA  23   1.920 -18.005  -4.322
  181    HA   ALA  23           HA       ALA  23   1.913 -15.257  -3.817
  182   1HB   ALA  23          1HB       ALA  23   2.867 -15.583  -5.835
  183   2HB   ALA  23          2HB       ALA  23   1.223 -15.350  -6.430
  184   3HB   ALA  23          3HB       ALA  23   1.857 -16.980  -6.203
  185    H    ALA  24           H        ALA  24  -0.663 -17.442  -4.822
  186    HA   ALA  24           HA       ALA  24  -2.626 -15.449  -5.235
  187   1HB   ALA  24          1HB       ALA  24  -4.162 -17.188  -5.457
  188   2HB   ALA  24          2HB       ALA  24  -3.303 -18.226  -4.318
  189   3HB   ALA  24          3HB       ALA  24  -2.641 -17.947  -5.928
  190    H    THR  25           H        THR  25  -2.082 -17.640  -2.441
  191    HA   THR  25           HA       THR  25  -3.986 -16.506  -0.774
  192    HB   THR  25           HB       THR  25  -2.403 -17.277   1.099
  193    HG1  THR  25           1HG      THR  25  -0.914 -18.915   0.019
  194   1HG2  THR  25          1HG2      THR  25  -3.343 -19.238  -0.972
  195   2HG2  THR  25          2HG2      THR  25  -4.221 -18.689   0.457
  196   3HG2  THR  25          3HG2      THR  25  -2.768 -19.673   0.639
  197    H    ALA  26           H        ALA  26  -0.635 -15.598  -1.394
  198    HA   ALA  26           HA       ALA  26  -0.479 -13.492   0.470
  199   1HB   ALA  26          1HB       ALA  26   1.018 -14.221  -2.011
  200   2HB   ALA  26          2HB       ALA  26   1.596 -14.076  -0.350
  201   3HB   ALA  26          3HB       ALA  26   1.262 -12.626  -1.297
  202    H    GLU  27           H        GLU  27  -1.323 -13.529  -3.002
  203    HA   GLU  27           HA       GLU  27  -1.819 -10.814  -3.301
  204   1HB   GLU  27          2HB       GLU  27  -1.667 -12.381  -5.185
  205   2HB   GLU  27          1HB       GLU  27  -3.189 -13.110  -4.693
  206   1HG   GLU  27          2HG       GLU  27  -4.343 -11.012  -5.110
  207   2HG   GLU  27          1HG       GLU  27  -2.820 -10.263  -5.586
  208    H    LYS  28           H        LYS  28  -3.990 -13.440  -2.333
  209    HA   LYS  28           HA       LYS  28  -6.325 -11.869  -2.132
  210   1HB   LYS  28          2HB       LYS  28  -5.593 -14.430  -0.701
  211   2HB   LYS  28          1HB       LYS  28  -7.207 -13.732  -0.760
  212   1HG   LYS  28          2HG       LYS  28  -5.611 -14.772  -3.090
  213   2HG   LYS  28          1HG       LYS  28  -7.034 -15.517  -2.361
  214   1HD   LYS  28          2HD       LYS  28  -8.384 -13.589  -3.015
  215   2HD   LYS  28          1HD       LYS  28  -6.960 -12.827  -3.727
  216   1HE   LYS  28          2HE       LYS  28  -8.369 -13.904  -5.425
  217   2HE   LYS  28          1HE       LYS  28  -6.767 -14.634  -5.338
  218   1HZ   LYS  28          1HZ       LYS  28  -8.939 -16.089  -5.392
  219   2HZ   LYS  28          2HZ       LYS  28  -8.897 -15.823  -3.724
  220   3HZ   LYS  28          3HZ       LYS  28  -7.586 -16.564  -4.493
  221    H    VAL  29           H        VAL  29  -3.851 -12.800   0.215
  222    HA   VAL  29           HA       VAL  29  -5.034 -11.642   2.480
  223    HB   VAL  29           HB       VAL  29  -2.100 -12.021   1.850
  224   1HG1  VAL  29          1HG1      VAL  29  -3.524 -11.184   4.347
  225   2HG1  VAL  29          2HG1      VAL  29  -2.094 -10.481   3.590
  226   3HG1  VAL  29          3HG1      VAL  29  -1.980 -12.031   4.423
  227   1HG2  VAL  29          1HG2      VAL  29  -3.415 -13.758   3.815
  228   2HG2  VAL  29          2HG2      VAL  29  -2.278 -14.155   2.526
  229   3HG2  VAL  29          3HG2      VAL  29  -3.991 -13.953   2.160
  230    H    VAL  30           H        VAL  30  -2.909 -10.334  -0.003
  231    HA   VAL  30           HA       VAL  30  -2.470  -7.805   1.152
  232    HB   VAL  30           HB       VAL  30  -2.658  -8.457  -1.793
  233   1HG1  VAL  30          1HG1      VAL  30  -0.852  -6.381  -0.659
  234   2HG1  VAL  30          2HG1      VAL  30  -2.565  -6.005  -0.822
  235   3HG1  VAL  30          3HG1      VAL  30  -1.621  -6.456  -2.241
  236   1HG2  VAL  30          1HG2      VAL  30   0.025  -8.273  -0.779
  237   2HG2  VAL  30          2HG2      VAL  30  -0.749  -9.589  -1.662
  238   3HG2  VAL  30          3HG2      VAL  30  -0.880  -9.510   0.095
  239    H    LYS  31           H        LYS  31  -5.019  -9.044  -1.023
  240    HA   LYS  31           HA       LYS  31  -6.418  -6.757  -1.588
  241   1HB   LYS  31          2HB       LYS  31  -7.692  -9.375  -0.773
  242   2HB   LYS  31          1HB       LYS  31  -8.446  -8.104  -1.722
  243   1HG   LYS  31          2HG       LYS  31  -6.227  -9.950  -2.534
  244   2HG   LYS  31          1HG       LYS  31  -7.845  -9.818  -3.216
  245   1HD   LYS  31          2HD       LYS  31  -7.184  -7.423  -3.835
  246   2HD   LYS  31          1HD       LYS  31  -5.532  -7.937  -3.489
  247   1HE   LYS  31          2HE       LYS  31  -6.041  -8.129  -5.868
  248   2HE   LYS  31          1HE       LYS  31  -5.707  -9.701  -5.147
  249   1HZ   LYS  31          1HZ       LYS  31  -7.868  -9.083  -6.659
  250   2HZ   LYS  31          2HZ       LYS  31  -8.489  -9.004  -5.090
  251   3HZ   LYS  31          3HZ       LYS  31  -7.742 -10.421  -5.632
  252    H    GLN  32           H        GLN  32  -6.790  -8.822   1.250
  253    HA   GLN  32           HA       GLN  32  -8.722  -7.326   2.602
  254   1HB   GLN  32          2HB       GLN  32  -7.977  -9.622   3.242
  255   2HB   GLN  32          1HB       GLN  32  -6.481  -8.930   3.851
  256   1HG   GLN  32          2HG       GLN  32  -7.955  -9.342   5.684
  257   2HG   GLN  32          1HG       GLN  32  -7.776  -7.603   5.465
  258   1HE2  GLN  32          1HE2      GLN  32  -9.741  -8.897   3.048
  259   2HE2  GLN  32          2HE2      GLN  32 -11.269  -8.533   3.756
  260    H    PHE  33           H        PHE  33  -5.240  -7.002   2.460
  261    HA   PHE  33           HA       PHE  33  -4.747  -5.196   4.496
  262   1HB   PHE  33          2HB       PHE  33  -3.077  -6.350   2.970
  263   2HB   PHE  33          1HB       PHE  33  -3.451  -5.131   1.759
  264    HD1  PHE  33           1HD      PHE  33  -2.278  -5.492   5.259
  265    HD2  PHE  33           2HD      PHE  33  -2.212  -3.167   1.682
  266    HE1  PHE  33           1HE      PHE  33  -0.567  -4.020   6.235
  267    HE2  PHE  33           2HE      PHE  33  -0.500  -1.702   2.673
  268    HZ   PHE  33           HZ       PHE  33   0.320  -2.137   4.956
  269    H    PHE  34           H        PHE  34  -5.106  -4.319   1.091
  270    HA   PHE  34           HA       PHE  34  -5.611  -1.568   1.598
  271   1HB   PHE  34          2HB       PHE  34  -6.156  -3.180  -0.897
  272   2HB   PHE  34          1HB       PHE  34  -6.098  -1.417  -0.795
  273    HD1  PHE  34           1HD      PHE  34  -3.867  -0.724   0.711
  274    HD2  PHE  34           2HD      PHE  34  -4.287  -4.029  -1.919
  275    HE1  PHE  34           1HE      PHE  34  -1.426  -0.803   0.432
  276    HE2  PHE  34           2HE      PHE  34  -1.847  -4.113  -2.216
  277    HZ   PHE  34           HZ       PHE  34  -0.421  -2.499  -1.028
  278    H    ASN  35           H        ASN  35  -7.708  -4.329   1.006
  279    HA   ASN  35           HA       ASN  35 -10.165  -3.072   0.693
  280   1HB   ASN  35          2HB       ASN  35  -9.837  -5.499   0.491
  281   2HB   ASN  35          1HB       ASN  35  -9.518  -5.610   2.218
  282   1HD2  ASN  35          1HD2      ASN  35 -11.676  -6.478   0.159
  283   2HD2  ASN  35          2HD2      ASN  35 -13.147  -6.202   1.022
  284    H    ASP  36           H        ASP  36  -8.292  -3.775   3.552
  285    HA   ASP  36           HA       ASP  36 -10.291  -2.599   5.323
  286   1HB   ASP  36          2HB       ASP  36  -7.689  -4.013   5.920
  287   2HB   ASP  36          1HB       ASP  36  -8.789  -3.389   7.148
  288    H    ASN  37           H        ASN  37  -7.193  -1.774   3.923
  289    HA   ASN  37           HA       ASN  37  -6.663   0.344   5.816
  290   1HB   ASN  37          2HB       ASN  37  -5.411  -0.254   3.124
  291   2HB   ASN  37          1HB       ASN  37  -4.858   1.001   4.225
  292   1HD2  ASN  37          1HD2      ASN  37  -3.782  -1.661   3.121
  293   2HD2  ASN  37          2HD2      ASN  37  -3.142  -2.429   4.530
  294    H    GLY  38           H        GLY  38  -7.888   0.027   2.568
  295   1HA   GLY  38          2HA       GLY  38  -8.248   2.061   1.183
  296   2HA   GLY  38          1HA       GLY  38  -9.731   1.390   1.822
  297    H    VAL  39           H        VAL  39 -11.064   2.773   2.684
  298    HA   VAL  39           HA       VAL  39 -10.234   5.482   3.089
  299    HB   VAL  39           HB       VAL  39 -12.943   4.215   3.326
  300   1HG1  VAL  39          1HG1      VAL  39 -13.182   6.136   4.602
  301   2HG1  VAL  39          2HG1      VAL  39 -13.636   6.693   2.990
  302   3HG1  VAL  39          3HG1      VAL  39 -12.030   7.048   3.628
  303   1HG2  VAL  39          1HG2      VAL  39 -11.350   5.275   1.105
  304   2HG2  VAL  39          2HG2      VAL  39 -13.015   5.853   1.168
  305   3HG2  VAL  39          3HG2      VAL  39 -12.684   4.122   1.099
  306    H    ASP  40           H        ASP  40 -11.956   3.213   5.326
  307    HA   ASP  40           HA       ASP  40 -11.515   5.118   7.447
  308   1HB   ASP  40          2HB       ASP  40 -12.940   2.459   7.426
  309   2HB   ASP  40          1HB       ASP  40 -12.894   3.568   8.793
  310    H    GLY  41           H        GLY  41  -9.152   3.573   6.383
  311   1HA   GLY  41          2HA       GLY  41  -8.427   1.686   8.401
  312   2HA   GLY  41          1HA       GLY  41  -7.331   2.439   7.250
  313    H    GLU  42           H        GLU  42  -6.611   1.966   9.939
  314    HA   GLU  42           HA       GLU  42  -6.874   4.501  11.341
  315   1HB   GLU  42          2HB       GLU  42  -5.336   2.004  12.083
  316   2HB   GLU  42          1HB       GLU  42  -5.589   3.396  13.126
  317   1HG   GLU  42          2HG       GLU  42  -7.989   2.979  13.113
  318   2HG   GLU  42          1HG       GLU  42  -7.747   1.596  12.046
  319    H    TRP  43           H        TRP  43  -5.704   6.026  10.194
  320    HA   TRP  43           HA       TRP  43  -2.928   5.412   9.523
  321   1HB   TRP  43          2HB       TRP  43  -4.632   7.797   8.802
  322   2HB   TRP  43          1HB       TRP  43  -3.001   7.491   8.217
  323    HD1  TRP  43           HD       TRP  43  -5.875   4.910   8.342
  324    HE1  TRP  43           1HE      TRP  43  -6.330   4.106   5.940
  325    HE3  TRP  43           3HE      TRP  43  -2.642   7.970   5.883
  326    HZ2  TRP  43           2HZ      TRP  43  -5.418   4.715   3.333
  327    HZ3  TRP  43           3HZ      TRP  43  -2.476   7.799   3.446
  328    HH2  TRP  43           HH       TRP  43  -3.838   6.203   2.190
  329    H    THR  44           H        THR  44  -1.350   5.968  10.848
  330    HA   THR  44           HA       THR  44  -1.715   8.314  12.591
  331    HB   THR  44           HB       THR  44   0.042   7.298  14.030
  332    HG1  THR  44           1HG      THR  44   1.171   5.957  12.770
  333   1HG2  THR  44          1HG2      THR  44  -1.288   5.770  15.139
  334   2HG2  THR  44          2HG2      THR  44  -2.040   5.193  13.652
  335   3HG2  THR  44          3HG2      THR  44  -2.461   6.780  14.294
  336    H    TYR  45           H        TYR  45  -0.187   9.950  12.488
  337    HA   TYR  45           HA       TYR  45   1.818   9.644  10.354
  338   1HB   TYR  45          2HB       TYR  45   0.050  11.357   9.988
  339   2HB   TYR  45          1HB       TYR  45   0.612  12.200  11.426
  340    HD1  TYR  45           1HD      TYR  45   2.791  10.583   8.905
  341    HD2  TYR  45           2HD      TYR  45   1.259  14.247  10.428
  342    HE1  TYR  45           1HE      TYR  45   4.408  11.824   7.529
  343    HE2  TYR  45           2HE      TYR  45   2.872  15.498   9.057
  344    HH   TYR  45           HH       TYR  45   5.004  15.160   7.952
  345    H    ASP  46           H        ASP  46   3.922  10.292  10.649
  346    HA   ASP  46           HA       ASP  46   4.697  11.015  13.397
  347   1HB   ASP  46          2HB       ASP  46   5.294   8.679  12.923
  348   2HB   ASP  46          1HB       ASP  46   6.179   9.189  11.489
  349    H    ASP  47           H        ASP  47   4.633  13.224  12.694
  350    HA   ASP  47           HA       ASP  47   5.840  14.418  10.565
  351   1HB   ASP  47          2HB       ASP  47   5.851  15.433  13.415
  352   2HB   ASP  47          1HB       ASP  47   6.131  16.418  11.982
  353    H    ALA  48           H        ALA  48   7.410  13.173  13.441
  354    HA   ALA  48           HA       ALA  48   9.893  14.317  13.314
  355   1HB   ALA  48          1HB       ALA  48  10.053  13.000  15.089
  356   2HB   ALA  48          2HB       ALA  48  10.402  11.662  13.995
  357   3HB   ALA  48          3HB       ALA  48   8.744  11.968  14.513
  358    H    THR  49           H        THR  49   8.634  11.748  11.265
  359    HA   THR  49           HA       THR  49  11.148  11.878   9.735
  360    HB   THR  49           HB       THR  49  10.844   9.489   9.164
  361    HG1  THR  49           1HG      THR  49   9.078   8.518   9.686
  362   1HG2  THR  49          1HG2      THR  49  11.667  10.503  11.677
  363   2HG2  THR  49          2HG2      THR  49  12.192   9.038  10.848
  364   3HG2  THR  49          3HG2      THR  49  10.813   8.985  11.945
  365    H    LYS  50           H        LYS  50   8.243  13.026   9.505
  366    HA   LYS  50           HA       LYS  50   6.741  13.471   7.817
  367   1HB   LYS  50          2HB       LYS  50   9.269  12.977   6.233
  368   2HB   LYS  50          1HB       LYS  50   7.796  13.628   5.532
  369   1HG   LYS  50          2HG       LYS  50   8.920  15.002   7.906
  370   2HG   LYS  50          1HG       LYS  50   9.763  15.180   6.367
  371   1HD   LYS  50          2HD       LYS  50   6.840  15.770   6.843
  372   2HD   LYS  50          1HD       LYS  50   8.124  16.977   6.743
  373   1HE   LYS  50          2HE       LYS  50   7.161  15.133   4.562
  374   2HE   LYS  50          1HE       LYS  50   7.032  16.889   4.616
  375   1HZ   LYS  50          1HZ       LYS  50   9.449  17.026   4.506
  376   2HZ   LYS  50          2HZ       LYS  50   8.827  16.193   3.170
  377   3HZ   LYS  50          3HZ       LYS  50   9.560  15.338   4.432
  378    H    THR  51           H        THR  51   6.787  10.752   8.743
  379    HA   THR  51           HA       THR  51   5.919   9.392   6.284
  380    HB   THR  51           HB       THR  51   7.442   8.187   8.596
  381    HG1  THR  51           1HG      THR  51   8.628   9.414   6.980
  382   1HG2  THR  51          1HG2      THR  51   5.720   6.909   6.718
  383   2HG2  THR  51          2HG2      THR  51   6.688   6.201   8.010
  384   3HG2  THR  51          3HG2      THR  51   7.389   6.431   6.409
  385    H    PHE  52           H        PHE  52   4.121   8.137   6.384
  386    HA   PHE  52           HA       PHE  52   2.542   8.302   8.869
  387   1HB   PHE  52          2HB       PHE  52   1.496   7.796   6.077
  388   2HB   PHE  52          1HB       PHE  52   0.558   8.171   7.514
  389    HD1  PHE  52           1HD      PHE  52  -0.230  10.311   7.739
  390    HD2  PHE  52           2HD      PHE  52   3.305   9.648   5.465
  391    HE1  PHE  52           1HE      PHE  52  -0.175  12.696   7.132
  392    HE2  PHE  52           2HE      PHE  52   3.368  12.032   4.861
  393    HZ   PHE  52           HZ       PHE  52   1.628  13.559   5.697
  394    H    THR  53           H        THR  53   1.398   6.425   9.570
  395    HA   THR  53           HA       THR  53   2.282   3.922   8.308
  396    HB   THR  53           HB       THR  53   1.967   2.968  10.700
  397    HG1  THR  53           1HG      THR  53   2.524   5.668  11.336
  398   1HG2  THR  53          1HG2      THR  53   4.277   4.499   9.658
  399   2HG2  THR  53          2HG2      THR  53   4.131   2.787  10.061
  400   3HG2  THR  53          3HG2      THR  53   4.305   3.984  11.345
  401    H    VAL  54           H        VAL  54   0.749   2.591   7.666
  402    HA   VAL  54           HA       VAL  54  -2.014   3.119   8.531
  403    HB   VAL  54           HB       VAL  54  -1.038   1.684   6.046
  404   1HG1  VAL  54          1HG1      VAL  54  -3.792   2.245   7.112
  405   2HG1  VAL  54          2HG1      VAL  54  -3.105   0.706   6.594
  406   3HG1  VAL  54          3HG1      VAL  54  -3.492   1.945   5.401
  407   1HG2  VAL  54          1HG2      VAL  54  -1.386   3.592   4.845
  408   2HG2  VAL  54          2HG2      VAL  54  -0.887   4.303   6.380
  409   3HG2  VAL  54          3HG2      VAL  54  -2.598   4.211   5.967
  410    H    THR  55           H        THR  55  -2.508   1.836  10.199
  411    HA   THR  55           HA       THR  55  -1.518  -0.915  10.223
  412    HB   THR  55           HB       THR  55  -2.889   0.616  12.432
  413    HG1  THR  55           1HG      THR  55  -0.141   0.142  11.919
  414   1HG2  THR  55          1HG2      THR  55  -3.085  -1.733  12.833
  415   2HG2  THR  55          2HG2      THR  55  -1.835  -1.081  13.893
  416   3HG2  THR  55          3HG2      THR  55  -1.383  -1.985  12.446
  417    H    GLU  56           H        GLU  56  -2.782  -2.442   9.412
  418    HA   GLU  56           HA       GLU  56  -5.541  -2.046   8.875
  419   1HB   GLU  56          2HB       GLU  56  -4.000  -3.544   7.581
  420   2HB   GLU  56          1HB       GLU  56  -4.016  -4.657   8.941
  421   1HG   GLU  56          2HG       GLU  56  -6.451  -3.820   7.385
  422   2HG   GLU  56          1HG       GLU  56  -5.539  -5.302   7.107
  423   1H    MET   1          1HT       MET   1   7.993  18.226  -3.885
  424   2H    MET   1          2HT       MET   1   7.168  19.489  -3.122
  425   3H    MET   1          3HT       MET   1   6.332  18.097  -3.593
  426    HA   MET   1           HA       MET   1   8.571  17.923  -1.687
  427   1HB   MET   1          2HB       MET   1   6.817  19.660  -1.014
  428   2HB   MET   1          1HB       MET   1   5.685  18.321  -0.894
  429   1HG   MET   1          2HG       MET   1   6.543  18.852   1.281
  430   2HG   MET   1          1HG       MET   1   7.140  17.269   0.782
  431   1HE   MET   1          1HE       MET   1   9.933  17.982   2.819
  432   2HE   MET   1          2HE       MET   1   8.180  18.057   2.994
  433   3HE   MET   1          3HE       MET   1   9.145  19.524   3.155
  434    H    GLN   2           H        GLN   2   8.879  15.847  -1.097
  435    HA   GLN   2           HA       GLN   2   6.821  13.895  -1.896
  436   1HB   GLN   2          2HB       GLN   2   8.935  13.641  -3.105
  437   2HB   GLN   2          1HB       GLN   2   9.804  13.509  -1.583
  438   1HG   GLN   2          2HG       GLN   2   8.602  11.449  -1.069
  439   2HG   GLN   2          1HG       GLN   2   7.724  11.583  -2.592
  440   1HE2  GLN   2          1HE2      GLN   2  10.169  10.025  -1.142
  441   2HE2  GLN   2          2HE2      GLN   2  11.160   9.659  -2.510
  442    H    TYR   3           H        TYR   3   6.262  12.218  -0.519
  443    HA   TYR   3           HA       TYR   3   7.302  12.351   2.227
  444   1HB   TYR   3          2HB       TYR   3   4.387  12.156   1.435
  445   2HB   TYR   3          1HB       TYR   3   4.999  11.982   3.078
  446    HD1  TYR   3           1HD      TYR   3   4.981  13.843   4.446
  447    HD2  TYR   3           2HD      TYR   3   5.121  14.401   0.232
  448    HE1  TYR   3           1HE      TYR   3   4.813  16.275   4.768
  449    HE2  TYR   3           2HE      TYR   3   4.957  16.835   0.542
  450    HH   TYR   3           HH       TYR   3   4.219  18.254   3.604
  451    H    LYS   4           H        LYS   4   7.189  10.369   3.402
  452    HA   LYS   4           HA       LYS   4   6.930   8.030   1.629
  453   1HB   LYS   4          2HB       LYS   4   9.188   8.385   2.510
  454   2HB   LYS   4          1HB       LYS   4   8.564   8.342   4.153
  455   1HG   LYS   4          2HG       LYS   4   7.892   6.023   3.855
  456   2HG   LYS   4          1HG       LYS   4   8.469   6.061   2.188
  457   1HD   LYS   4          2HD       LYS   4  10.741   6.517   2.995
  458   2HD   LYS   4          1HD       LYS   4  10.157   6.457   4.659
  459   1HE   LYS   4          2HE       LYS   4   9.470   4.128   4.327
  460   2HE   LYS   4          1HE       LYS   4  10.064   4.191   2.668
  461   1HZ   LYS   4          1HZ       LYS   4  11.782   4.672   5.038
  462   2HZ   LYS   4          2HZ       LYS   4  12.280   4.454   3.437
  463   3HZ   LYS   4          3HZ       LYS   4  11.616   3.159   4.297
  464    H    VAL   5           H        VAL   5   5.049   7.041   1.898
  465    HA   VAL   5           HA       VAL   5   3.798   6.988   4.538
  466    HB   VAL   5           HB       VAL   5   2.711   6.087   1.863
  467   1HG1  VAL   5          1HG1      VAL   5   1.505   4.836   3.392
  468   2HG1  VAL   5          2HG1      VAL   5   0.513   6.285   3.224
  469   3HG1  VAL   5          3HG1      VAL   5   1.568   6.096   4.625
  470   1HG2  VAL   5          1HG2      VAL   5   1.180   8.186   2.623
  471   2HG2  VAL   5          2HG2      VAL   5   2.568   8.308   1.544
  472   3HG2  VAL   5          3HG2      VAL   5   2.753   8.671   3.259
  473    H    ILE   6           H        ILE   6   3.577   5.180   5.720
  474    HA   ILE   6           HA       ILE   6   4.761   2.706   4.646
  475    HB   ILE   6           HB       ILE   6   4.722   3.770   7.472
  476   1HG1  ILE   6          2HG1      ILE   6   7.003   3.161   5.584
  477   2HG1  ILE   6          1HG1      ILE   6   6.391   4.767   5.956
  478   1HG2  ILE   6          1HG2      ILE   6   5.402   1.799   8.319
  479   2HG2  ILE   6          2HG2      ILE   6   6.266   1.336   6.853
  480   3HG2  ILE   6          3HG2      ILE   6   4.516   1.147   6.943
  481   1HD1  ILE   6          1HD1      ILE   6   8.295   4.534   7.274
  482   2HD1  ILE   6          2HD1      ILE   6   7.895   2.877   7.723
  483   3HD1  ILE   6          3HD1      ILE   6   6.961   4.219   8.384
  484    H    LEU   7           H        LEU   7   3.616   0.858   4.723
  485    HA   LEU   7           HA       LEU   7   0.938   0.979   5.944
  486   1HB   LEU   7          2HB       LEU   7   1.746  -0.905   3.745
  487   2HB   LEU   7          1HB       LEU   7   0.134  -0.409   4.224
  488    HG   LEU   7           HG       LEU   7   2.157   1.345   2.851
  489   1HD1  LEU   7          1HD1      LEU   7  -0.446   0.415   1.706
  490   2HD1  LEU   7          2HD1      LEU   7   0.993  -0.596   1.597
  491   3HD1  LEU   7          3HD1      LEU   7   0.992   1.011   0.876
  492   1HD2  LEU   7          1HD2      LEU   7  -0.742   1.971   3.279
  493   2HD2  LEU   7          2HD2      LEU   7   0.590   3.063   2.894
  494   3HD2  LEU   7          3HD2      LEU   7   0.460   2.365   4.507
  495    H    ASN   8           H        ASN   8   1.081   0.000   7.891
  496    HA   ASN   8           HA       ASN   8   2.550  -2.546   8.061
  497   1HB   ASN   8          2HB       ASN   8   1.737  -0.646  10.268
  498   2HB   ASN   8          1HB       ASN   8   2.598  -2.163  10.501
  499   1HD2  ASN   8          1HD2      ASN   8   4.691  -1.964  10.732
  500   2HD2  ASN   8          2HD2      ASN   8   5.678  -0.707  10.076
  501    H    GLY   9           H        GLY   9   1.194  -4.221   7.755
  502   1HA   GLY   9          2HA       GLY   9  -1.430  -4.104   9.115
  503   2HA   GLY   9          1HA       GLY   9  -1.141  -4.992   7.629
  504    H    LYS  10           H        LYS  10  -2.154  -6.726   8.934
  505    HA   LYS  10           HA       LYS  10  -0.658  -7.842  11.097
  506   1HB   LYS  10          2HB       LYS  10  -2.887  -9.059   9.457
  507   2HB   LYS  10          1HB       LYS  10  -2.258  -9.707  10.966
  508   1HG   LYS  10          2HG       LYS  10  -2.985  -7.648  12.115
  509   2HG   LYS  10          1HG       LYS  10  -3.687  -7.082  10.598
  510   1HD   LYS  10          2HD       LYS  10  -4.465  -9.583  12.098
  511   2HD   LYS  10          1HD       LYS  10  -5.393  -8.085  12.022
  512   1HE   LYS  10          2HE       LYS  10  -5.618  -8.364   9.592
  513   2HE   LYS  10          1HE       LYS  10  -4.709  -9.872   9.689
  514   1HZ   LYS  10          1HZ       LYS  10  -6.607 -10.368  11.461
  515   2HZ   LYS  10          2HZ       LYS  10  -6.778 -10.726   9.816
  516   3HZ   LYS  10          3HZ       LYS  10  -7.462  -9.314  10.448
  517    H    THR  11           H        THR  11  -1.348  -8.968   7.782
  518    HA   THR  11           HA       THR  11   1.009 -10.707   7.934
  519    HB   THR  11           HB       THR  11  -0.149 -11.787   5.919
  520    HG1  THR  11           1HG      THR  11  -2.557 -11.338   6.250
  521   1HG2  THR  11          1HG2      THR  11  -0.189 -12.712   8.264
  522   2HG2  THR  11          2HG2      THR  11  -1.529 -13.182   7.218
  523   3HG2  THR  11          3HG2      THR  11  -1.762 -11.935   8.442
  524    H    LEU  12           H        LEU  12   0.421  -7.714   6.946
  525    HA   LEU  12           HA       LEU  12   2.244  -7.983   4.680
  526   1HB   LEU  12          2HB       LEU  12   0.019  -7.876   3.714
  527   2HB   LEU  12          1HB       LEU  12  -0.328  -6.417   4.619
  528    HG   LEU  12           HG       LEU  12   1.272  -5.169   3.336
  529   1HD1  LEU  12          1HD1      LEU  12   3.071  -6.261   2.624
  530   2HD1  LEU  12          2HD1      LEU  12   2.080  -6.821   1.274
  531   3HD1  LEU  12          3HD1      LEU  12   2.253  -7.815   2.717
  532   1HD2  LEU  12          1HD2      LEU  12  -0.167  -4.866   1.668
  533   2HD2  LEU  12          2HD2      LEU  12  -1.070  -6.234   2.322
  534   3HD2  LEU  12          3HD2      LEU  12   0.113  -6.491   1.039
  535    H    LYS  13           H        LYS  13   3.718  -6.410   4.472
  536    HA   LYS  13           HA       LYS  13   3.448  -3.923   5.967
  537   1HB   LYS  13          2HB       LYS  13   5.779  -5.808   6.372
  538   2HB   LYS  13          1HB       LYS  13   5.693  -4.164   6.986
  539   1HG   LYS  13          2HG       LYS  13   3.737  -4.785   8.335
  540   2HG   LYS  13          1HG       LYS  13   3.878  -6.442   7.747
  541   1HD   LYS  13          2HD       LYS  13   5.964  -4.941   9.327
  542   2HD   LYS  13          1HD       LYS  13   4.888  -6.188   9.960
  543   1HE   LYS  13          2HE       LYS  13   5.870  -7.814   8.417
  544   2HE   LYS  13          1HE       LYS  13   6.945  -6.567   7.785
  545   1HZ   LYS  13          1HZ       LYS  13   6.972  -7.861  10.436
  546   2HZ   LYS  13          2HZ       LYS  13   7.688  -6.345  10.214
  547   3HZ   LYS  13          3HZ       LYS  13   8.239  -7.678   9.329
  548    H    GLY  14           H        GLY  14   4.770  -2.225   5.135
  549   1HA   GLY  14          2HA       GLY  14   6.778  -2.660   3.187
  550   2HA   GLY  14          1HA       GLY  14   5.254  -2.335   2.385
  551    H    GLU  15           H        GLU  15   6.786  -0.589   1.595
  552    HA   GLU  15           HA       GLU  15   6.244   1.823   3.153
  553   1HB   GLU  15          2HB       GLU  15   8.946   1.151   1.967
  554   2HB   GLU  15          1HB       GLU  15   8.509   2.698   2.675
  555   1HG   GLU  15          2HG       GLU  15   9.724   1.577   4.327
  556   2HG   GLU  15          1HG       GLU  15   8.037   1.432   4.814
  557    H    THR  16           H        THR  16   5.678   3.551   1.935
  558    HA   THR  16           HA       THR  16   6.059   3.430  -0.960
  559    HB   THR  16           HB       THR  16   3.904   2.590  -0.927
  560    HG1  THR  16           1HG      THR  16   3.402   5.351  -0.801
  561   1HG2  THR  16          1HG2      THR  16   3.425   2.642   1.420
  562   2HG2  THR  16          2HG2      THR  16   2.094   3.389   0.537
  563   3HG2  THR  16          3HG2      THR  16   3.264   4.396   1.384
  564    H    THR  17           H        THR  17   5.371   5.589  -1.997
  565    HA   THR  17           HA       THR  17   5.739   7.841  -0.165
  566    HB   THR  17           HB       THR  17   7.472   8.802  -1.684
  567    HG1  THR  17           1HG      THR  17   7.301   6.225  -2.826
  568   1HG2  THR  17          1HG2      THR  17   8.040   6.238  -0.248
  569   2HG2  THR  17          2HG2      THR  17   8.380   7.892   0.263
  570   3HG2  THR  17          3HG2      THR  17   9.309   7.164  -1.048
  571    H    THR  18           H        THR  18   4.270   9.320  -0.559
  572    HA   THR  18           HA       THR  18   3.174   9.623  -3.289
  573    HB   THR  18           HB       THR  18   1.557   9.020  -1.472
  574    HG1  THR  18           1HG      THR  18   0.937  10.278  -3.311
  575   1HG2  THR  18          1HG2      THR  18   0.857  10.871   0.054
  576   2HG2  THR  18          2HG2      THR  18   2.367  11.687  -0.350
  577   3HG2  THR  18          3HG2      THR  18   2.401  10.117   0.452
  578    H    GLU  19           H        GLU  19   3.151  11.670  -4.229
  579    HA   GLU  19           HA       GLU  19   4.808  13.682  -2.866
  580   1HB   GLU  19          2HB       GLU  19   5.660  12.915  -5.033
  581   2HB   GLU  19          1HB       GLU  19   4.147  13.377  -5.802
  582   1HG   GLU  19          2HG       GLU  19   4.572  15.714  -5.240
  583   2HG   GLU  19          1HG       GLU  19   6.086  15.253  -4.465
  584    H    ALA  20           H        ALA  20   3.709  15.313  -1.927
  585    HA   ALA  20           HA       ALA  20   1.525  16.549  -3.392
  586   1HB   ALA  20          1HB       ALA  20   0.535  16.389  -0.778
  587   2HB   ALA  20          2HB       ALA  20   1.094  14.768  -1.189
  588   3HB   ALA  20          3HB       ALA  20  -0.085  15.580  -2.218
  589    H    VAL  21           H        VAL  21   0.948  18.593  -2.645
  590    HA   VAL  21           HA       VAL  21   2.972  20.334  -2.025
  591    HB   VAL  21           HB       VAL  21   0.096  20.793  -1.247
  592   1HG1  VAL  21          1HG1      VAL  21   0.800  23.164  -1.993
  593   2HG1  VAL  21          2HG1      VAL  21   2.444  22.577  -1.744
  594   3HG1  VAL  21          3HG1      VAL  21   1.297  22.582  -0.405
  595   1HG2  VAL  21          1HG2      VAL  21  -0.095  20.116  -3.456
  596   2HG2  VAL  21          2HG2      VAL  21   1.449  20.837  -3.916
  597   3HG2  VAL  21          3HG2      VAL  21   0.056  21.870  -3.594
  598    H    ASP  22           H        ASP  22   1.156  18.390   0.202
  599    HA   ASP  22           HA       ASP  22   2.917  19.174   2.344
  600   1HB   ASP  22          2HB       ASP  22   1.021  19.757   3.910
  601   2HB   ASP  22          1HB       ASP  22   1.376  20.954   2.669
  602    H    ALA  23           H        ALA  23   2.295  18.005   4.440
  603    HA   ALA  23           HA       ALA  23   2.229  15.259   3.936
  604   1HB   ALA  23          1HB       ALA  23   3.163  15.563   5.968
  605   2HB   ALA  23          2HB       ALA  23   1.506  15.369   6.538
  606   3HB   ALA  23          3HB       ALA  23   2.181  16.984   6.321
  607    H    ALA  24           H        ALA  24  -0.307  17.507   4.904
  608    HA   ALA  24           HA       ALA  24  -2.324  15.562   5.290
  609   1HB   ALA  24          1HB       ALA  24  -3.820  17.338   5.490
  610   2HB   ALA  24          2HB       ALA  24  -2.920  18.354   4.363
  611   3HB   ALA  24          3HB       ALA  24  -2.288  18.060   5.983
  612    H    THR  25           H        THR  25  -1.687  17.738   2.503
  613    HA   THR  25           HA       THR  25  -3.594  16.650   0.810
  614    HB   THR  25           HB       THR  25  -1.968  17.383  -1.040
  615    HG1  THR  25           1HG      THR  25  -0.453  18.984   0.059
  616   1HG2  THR  25          1HG2      THR  25  -2.888  19.366   1.016
  617   2HG2  THR  25          2HG2      THR  25  -3.759  18.838  -0.424
  618   3HG2  THR  25          3HG2      THR  25  -2.281  19.786  -0.585
  619    H    ALA  26           H        ALA  26  -0.276  15.661   1.477
  620    HA   ALA  26           HA       ALA  26  -0.144  13.550  -0.385
  621   1HB   ALA  26          1HB       ALA  26   1.334  14.244   2.116
  622   2HB   ALA  26          2HB       ALA  26   1.932  14.086   0.465
  623   3HB   ALA  26          3HB       ALA  26   1.550  12.645   1.406
  624    H    GLU  27           H        GLU  27  -1.035  13.610   3.076
  625    HA   GLU  27           HA       GLU  27  -1.602  10.907   3.365
  626   1HB   GLU  27          2HB       GLU  27  -1.439  12.471   5.251
  627   2HB   GLU  27          1HB       GLU  27  -2.935  13.239   4.739
  628   1HG   GLU  27          2HG       GLU  27  -4.146  11.168   5.139
  629   2HG   GLU  27          1HG       GLU  27  -2.647  10.383   5.637
  630    H    LYS  28           H        LYS  28  -3.694  13.585   2.367
  631    HA   LYS  28           HA       LYS  28  -6.064  12.072   2.134
  632   1HB   LYS  28          2HB       LYS  28  -5.251  14.615   0.714
  633   2HB   LYS  28          1HB       LYS  28  -6.880  13.956   0.750
  634   1HG   LYS  28          2HG       LYS  28  -5.294  14.957   3.102
  635   2HG   LYS  28          1HG       LYS  28  -6.689  15.735   2.352
  636   1HD   LYS  28          2HD       LYS  28  -8.092  13.842   2.988
  637   2HD   LYS  28          1HD       LYS  28  -6.697  13.045   3.720
  638   1HE   LYS  28          2HE       LYS  28  -8.104  14.157   5.398
  639   2HE   LYS  28          1HE       LYS  28  -6.483  14.847   5.334
  640   1HZ   LYS  28          1HZ       LYS  28  -8.621  16.355   5.358
  641   2HZ   LYS  28          2HZ       LYS  28  -8.562  16.087   3.689
  642   3HZ   LYS  28          3HZ       LYS  28  -7.245  16.796   4.478
  643    H    VAL  29           H        VAL  29  -3.535  12.942  -0.178
  644    HA   VAL  29           HA       VAL  29  -4.714  11.813  -2.460
  645    HB   VAL  29           HB       VAL  29  -1.781  12.121  -1.787
  646   1HG1  VAL  29          1HG1      VAL  29  -3.190  11.318  -4.305
  647   2HG1  VAL  29          2HG1      VAL  29  -1.788  10.581  -3.529
  648   3HG1  VAL  29          3HG1      VAL  29  -1.624  12.127  -4.359
  649   1HG2  VAL  29          1HG2      VAL  29  -3.025  13.888  -3.772
  650   2HG2  VAL  29          2HG2      VAL  29  -1.897  14.260  -2.466
  651   3HG2  VAL  29          3HG2      VAL  29  -3.619  14.097  -2.124
  652    H    VAL  30           H        VAL  30  -2.657  10.454   0.054
  653    HA   VAL  30           HA       VAL  30  -2.262   7.915  -1.096
  654    HB   VAL  30           HB       VAL  30  -2.476   8.572   1.847
  655   1HG1  VAL  30          1HG1      VAL  30  -0.707   6.452   0.737
  656   2HG1  VAL  30          2HG1      VAL  30  -2.430   6.118   0.877
  657   3HG1  VAL  30          3HG1      VAL  30  -1.496   6.546   2.309
  658   1HG2  VAL  30          1HG2      VAL  30   0.215   8.323   0.870
  659   2HG2  VAL  30          2HG2      VAL  30  -0.540   9.657   1.742
  660   3HG2  VAL  30          3HG2      VAL  30  -0.647   9.581  -0.017
  661    H    LYS  31           H        LYS  31  -4.812   9.216   1.042
  662    HA   LYS  31           HA       LYS  31  -6.274   6.964   1.588
  663   1HB   LYS  31          2HB       LYS  31  -7.472   9.611   0.755
  664   2HB   LYS  31          1HB       LYS  31  -8.270   8.359   1.693
  665   1HG   LYS  31          2HG       LYS  31  -6.019  10.152   2.537
  666   2HG   LYS  31          1HG       LYS  31  -7.650  10.060   3.196
  667   1HD   LYS  31          2HD       LYS  31  -7.055   7.649   3.824
  668   2HD   LYS  31          1HD       LYS  31  -5.387   8.122   3.501
  669   1HE   LYS  31          2HE       LYS  31  -5.923   8.327   5.873
  670   2HE   LYS  31          1HE       LYS  31  -5.542   9.891   5.155
  671   1HZ   LYS  31          1HZ       LYS  31  -7.739   9.325   6.638
  672   2HZ   LYS  31          2HZ       LYS  31  -8.339   9.260   5.059
  673   3HZ   LYS  31          3HZ       LYS  31  -7.566  10.660   5.612
  674    H    GLN  32           H        GLN  32  -6.554   9.036  -1.255
  675    HA   GLN  32           HA       GLN  32  -8.502   7.587  -2.635
  676   1HB   GLN  32          2HB       GLN  32  -7.695   9.864  -3.264
  677   2HB   GLN  32          1HB       GLN  32  -6.206   9.137  -3.851
  678   1HG   GLN  32          2HG       GLN  32  -7.645   9.584  -5.705
  679   2HG   GLN  32          1HG       GLN  32  -7.512   7.842  -5.485
  680   1HE2  GLN  32          1HE2      GLN  32  -9.477   9.183  -3.094
  681   2HE2  GLN  32          2HE2      GLN  32 -11.005   8.856  -3.823
  682    H    PHE  33           H        PHE  33  -5.033   7.179  -2.443
  683    HA   PHE  33           HA       PHE  33  -4.555   5.361  -4.473
  684   1HB   PHE  33          2HB       PHE  33  -2.880   6.474  -2.922
  685   2HB   PHE  33          1HB       PHE  33  -3.301   5.265  -1.717
  686    HD1  PHE  33           1HD      PHE  33  -2.070   5.597  -5.200
  687    HD2  PHE  33           2HD      PHE  33  -2.110   3.271  -1.624
  688    HE1  PHE  33           1HE      PHE  33  -0.380   4.084  -6.153
  689    HE2  PHE  33           2HE      PHE  33  -0.422   1.765  -2.588
  690    HZ   PHE  33           HZ       PHE  33   0.442   2.179  -4.862
  691    H    PHE  34           H        PHE  34  -4.983   4.494  -1.072
  692    HA   PHE  34           HA       PHE  34  -5.549   1.756  -1.587
  693   1HB   PHE  34          2HB       PHE  34  -6.088   3.382   0.900
  694   2HB   PHE  34          1HB       PHE  34  -6.071   1.618   0.799
  695    HD1  PHE  34           1HD      PHE  34  -3.838   0.869  -0.675
  696    HD2  PHE  34           2HD      PHE  34  -4.214   4.185   1.950
  697    HE1  PHE  34           1HE      PHE  34  -1.401   0.891  -0.363
  698    HE2  PHE  34           2HE      PHE  34  -1.779   4.210   2.281
  699    HZ   PHE  34           HZ       PHE  34  -0.375   2.561   1.111
  700    H    ASN  35           H        ASN  35  -7.586   4.568  -1.025
  701    HA   ASN  35           HA       ASN  35 -10.076   3.370  -0.746
  702   1HB   ASN  35          2HB       ASN  35  -9.693   5.789  -0.540
  703   2HB   ASN  35          1HB       ASN  35  -9.348   5.891  -2.262
  704   1HD2  ASN  35          1HD2      ASN  35 -11.511   6.812  -0.233
  705   2HD2  ASN  35          2HD2      ASN  35 -12.976   6.574  -1.117
  706    H    ASP  36           H        ASP  36  -8.147   4.028  -3.579
  707    HA   ASP  36           HA       ASP  36 -10.150   2.901  -5.379
  708   1HB   ASP  36          2HB       ASP  36  -7.505   4.249  -5.938
  709   2HB   ASP  36          1HB       ASP  36  -8.602   3.654  -7.182
  710    H    ASN  37           H        ASN  37  -7.091   2.001  -3.935
  711    HA   ASN  37           HA       ASN  37  -6.586  -0.130  -5.820
  712   1HB   ASN  37          2HB       ASN  37  -5.359   0.438  -3.110
  713   2HB   ASN  37          1HB       ASN  37  -4.822  -0.830  -4.205
  714   1HD2  ASN  37          1HD2      ASN  37  -3.696   1.804  -3.084
  715   2HD2  ASN  37          2HD2      ASN  37  -3.017   2.557  -4.484
  716    H    GLY  38           H        GLY  38  -7.850   0.217  -2.589
  717   1HA   GLY  38          2HA       GLY  38  -8.278  -1.809  -1.211
  718   2HA   GLY  38          1HA       GLY  38  -9.735  -1.100  -1.871
  719    H    VAL  39           H        VAL  39 -11.089  -2.452  -2.752
  720    HA   VAL  39           HA       VAL  39 -10.320  -5.179  -3.146
  721    HB   VAL  39           HB       VAL  39 -12.993  -3.847  -3.420
  722   1HG1  VAL  39          1HG1      VAL  39 -13.261  -5.763  -4.700
  723   2HG1  VAL  39          2HG1      VAL  39 -13.751  -6.307  -3.096
  724   3HG1  VAL  39          3HG1      VAL  39 -12.145  -6.702  -3.709
  725   1HG2  VAL  39          1HG2      VAL  39 -11.458  -4.946  -1.177
  726   2HG2  VAL  39          2HG2      VAL  39 -13.136  -5.483  -1.262
  727   3HG2  VAL  39          3HG2      VAL  39 -12.764  -3.761  -1.190
  728    H    ASP  40           H        ASP  40 -11.953  -2.870  -5.406
  729    HA   ASP  40           HA       ASP  40 -11.530  -4.786  -7.522
  730   1HB   ASP  40          2HB       ASP  40 -12.889  -2.093  -7.520
  731   2HB   ASP  40          1HB       ASP  40 -12.853  -3.203  -8.886
  732    H    GLY  41           H        GLY  41  -9.145  -3.297  -6.423
  733   1HA   GLY  41          2HA       GLY  41  -8.348  -1.430  -8.430
  734   2HA   GLY  41          1HA       GLY  41  -7.284  -2.208  -7.264
  735    H    GLU  42           H        GLU  42  -6.516  -1.755  -9.943
  736    HA   GLU  42           HA       GLU  42  -6.821  -4.283 -11.348
  737   1HB   GLU  42          2HB       GLU  42  -5.212  -1.823 -12.068
  738   2HB   GLU  42          1HB       GLU  42  -5.485  -3.209 -13.115
  739   1HG   GLU  42          2HG       GLU  42  -7.872  -2.735 -13.136
  740   2HG   GLU  42          1HG       GLU  42  -7.612  -1.356 -12.066
  741    H    TRP  43           H        TRP  43  -5.704  -5.835 -10.185
  742    HA   TRP  43           HA       TRP  43  -2.924  -5.288  -9.473
  743   1HB   TRP  43          2HB       TRP  43  -4.695  -7.631  -8.778
  744   2HB   TRP  43          1HB       TRP  43  -3.067  -7.366  -8.171
  745    HD1  TRP  43           HD       TRP  43  -5.874  -4.715  -8.336
  746    HE1  TRP  43           1HE      TRP  43  -6.343  -3.900  -5.940
  747    HE3  TRP  43           3HE      TRP  43  -2.751  -7.853  -5.832
  748    HZ2  TRP  43           2HZ      TRP  43  -5.484  -4.529  -3.322
  749    HZ3  TRP  43           3HZ      TRP  43  -2.617  -7.684  -3.392
  750    HH2  TRP  43           HH       TRP  43  -3.957  -6.056  -2.157
  751    H    THR  44           H        THR  44  -1.342  -5.882 -10.777
  752    HA   THR  44           HA       THR  44  -1.740  -8.219 -12.525
  753    HB   THR  44           HB       THR  44   0.063  -7.248 -13.941
  754    HG1  THR  44           1HG      THR  44   1.206  -5.934 -12.663
  755   1HG2  THR  44          1HG2      THR  44  -1.214  -5.687 -15.067
  756   2HG2  THR  44          2HG2      THR  44  -1.972  -5.091 -13.590
  757   3HG2  THR  44          3HG2      THR  44  -2.423  -6.669 -14.240
  758    H    TYR  45           H        TYR  45  -0.252  -9.893 -12.402
  759    HA   TYR  45           HA       TYR  45   1.731  -9.634 -10.239
  760   1HB   TYR  45          2HB       TYR  45  -0.084 -11.303  -9.899
  761   2HB   TYR  45          1HB       TYR  45   0.477 -12.160 -11.329
  762    HD1  TYR  45           1HD      TYR  45   2.658 -10.597  -8.777
  763    HD2  TYR  45           2HD      TYR  45   1.060 -14.224 -10.323
  764    HE1  TYR  45           1HE      TYR  45   4.225 -11.876  -7.379
  765    HE2  TYR  45           2HE      TYR  45   2.622 -15.513  -8.929
  766    HH   TYR  45           HH       TYR  45   4.746 -15.227  -7.794
  767    H    ASP  46           H        ASP  46   3.821 -10.334 -10.506
  768    HA   ASP  46           HA       ASP  46   4.617 -11.075 -13.242
  769   1HB   ASP  46          2HB       ASP  46   5.264  -8.754 -12.760
  770   2HB   ASP  46          1HB       ASP  46   6.116  -9.286 -11.313
  771    H    ASP  47           H        ASP  47   4.490 -13.282 -12.540
  772    HA   ASP  47           HA       ASP  47   5.636 -14.504 -10.394
  773   1HB   ASP  47          2HB       ASP  47   5.664 -15.521 -13.245
  774   2HB   ASP  47          1HB       ASP  47   5.899 -16.511 -11.809
  775    H    ALA  48           H        ALA  48   7.277 -13.300 -13.248
  776    HA   ALA  48           HA       ALA  48   9.729 -14.503 -13.085
  777   1HB   ALA  48          1HB       ALA  48   9.948 -13.191 -14.859
  778   2HB   ALA  48          2HB       ALA  48  10.312 -11.861 -13.760
  779   3HB   ALA  48          3HB       ALA  48   8.655 -12.128 -14.300
  780    H    THR  49           H        THR  49   8.505 -11.903 -11.054
  781    HA   THR  49           HA       THR  49  10.993 -12.094  -9.488
  782    HB   THR  49           HB       THR  49  10.738  -9.700  -8.923
  783    HG1  THR  49           1HG      THR  49   9.004  -8.685  -9.467
  784   1HG2  THR  49          1HG2      THR  49  11.573 -10.733 -11.423
  785   2HG2  THR  49          2HG2      THR  49  12.122  -9.281 -10.587
  786   3HG2  THR  49          3HG2      THR  49  10.759  -9.194 -11.703
  787    H    LYS  50           H        LYS  50   8.057 -13.172  -9.300
  788    HA   LYS  50           HA       LYS  50   6.521 -13.580  -7.634
  789   1HB   LYS  50          2HB       LYS  50   9.038 -13.148  -6.014
  790   2HB   LYS  50          1HB       LYS  50   7.539 -13.762  -5.334
  791   1HG   LYS  50          2HG       LYS  50   8.663 -15.163  -7.693
  792   2HG   LYS  50          1HG       LYS  50   9.480 -15.361  -6.142
  793   1HD   LYS  50          2HD       LYS  50   6.551 -15.880  -6.659
  794   2HD   LYS  50          1HD       LYS  50   7.803 -17.118  -6.541
  795   1HE   LYS  50          2HE       LYS  50   6.855 -15.251  -4.374
  796   2HE   LYS  50          1HE       LYS  50   6.684 -17.004  -4.429
  797   1HZ   LYS  50          1HZ       LYS  50   9.094 -17.199  -4.286
  798   2HZ   LYS  50          2HZ       LYS  50   8.475 -16.350  -2.959
  799   3HZ   LYS  50          3HZ       LYS  50   9.246 -15.513  -4.209
  800    H    THR  51           H        THR  51   6.646 -10.864  -8.559
  801    HA   THR  51           HA       THR  51   5.778  -9.482  -6.111
  802    HB   THR  51           HB       THR  51   7.363  -8.314  -8.402
  803    HG1  THR  51           1HG      THR  51   8.495  -9.569  -6.770
  804   1HG2  THR  51          1HG2      THR  51   5.644  -6.995  -6.548
  805   2HG2  THR  51          2HG2      THR  51   6.648  -6.310  -7.828
  806   3HG2  THR  51          3HG2      THR  51   7.322  -6.558  -6.216
  807    H    PHE  52           H        PHE  52   4.012  -8.183  -6.237
  808    HA   PHE  52           HA       PHE  52   2.464  -8.310  -8.745
  809   1HB   PHE  52          2HB       PHE  52   1.392  -7.778  -5.968
  810   2HB   PHE  52          1HB       PHE  52   0.464  -8.131  -7.418
  811    HD1  PHE  52           1HD      PHE  52  -0.371 -10.251  -7.655
  812    HD2  PHE  52           2HD      PHE  52   3.146  -9.674  -5.330
  813    HE1  PHE  52           1HE      PHE  52  -0.383 -12.637  -7.047
  814    HE2  PHE  52           2HE      PHE  52   3.143 -12.058  -4.724
  815    HZ   PHE  52           HZ       PHE  52   1.378 -13.543  -5.586
  816    H    THR  53           H        THR  53   1.376  -6.406  -9.460
  817    HA   THR  53           HA       THR  53   2.304  -3.925  -8.186
  818    HB   THR  53           HB       THR  53   2.045  -2.964 -10.583
  819    HG1  THR  53           1HG      THR  53   2.546  -5.677 -11.212
  820   1HG2  THR  53          1HG2      THR  53   4.302  -4.550  -9.509
  821   2HG2  THR  53          2HG2      THR  53   4.203  -2.835  -9.913
  822   3HG2  THR  53          3HG2      THR  53   4.365  -4.036 -11.195
  823    H    VAL  54           H        VAL  54   0.793  -2.559  -7.564
  824    HA   VAL  54           HA       VAL  54  -1.968  -3.019  -8.470
  825    HB   VAL  54           HB       VAL  54  -0.992  -1.606  -5.971
  826   1HG1  VAL  54          1HG1      VAL  54  -3.745  -2.101  -7.077
  827   2HG1  VAL  54          2HG1      VAL  54  -3.028  -0.579  -6.548
  828   3HG1  VAL  54          3HG1      VAL  54  -3.462  -1.808  -5.361
  829   1HG2  VAL  54          1HG2      VAL  54  -1.405  -3.506  -4.776
  830   2HG2  VAL  54          2HG2      VAL  54  -0.900  -4.228  -6.303
  831   3HG2  VAL  54          3HG2      VAL  54  -2.615  -4.095  -5.915
  832    H    THR  55           H        THR  55  -2.407  -1.723 -10.145
  833    HA   THR  55           HA       THR  55  -1.351   1.003 -10.154
  834    HB   THR  55           HB       THR  55  -2.727  -0.495 -12.383
  835    HG1  THR  55           1HG      THR  55   0.023  -0.089 -11.832
  836   1HG2  THR  55          1HG2      THR  55  -2.860   1.857 -12.786
  837   2HG2  THR  55          2HG2      THR  55  -1.611   1.176 -13.829
  838   3HG2  THR  55          3HG2      THR  55  -1.158   2.069 -12.376
  839    H    GLU  56           H        GLU  56  -2.589   2.559  -9.361
  840    HA   GLU  56           HA       GLU  56  -5.364   2.231  -8.862
  841   1HB   GLU  56          2HB       GLU  56  -3.805   3.691  -7.548
  842   2HB   GLU  56          1HB       GLU  56  -3.775   4.804  -8.907
  843   1HG   GLU  56          2HG       GLU  56  -6.251   4.027  -7.385
  844   2HG   GLU  56          1HG       GLU  56  -5.308   5.486  -7.096
  Start of MODEL   32
    1   1H    MET   1          1HT       MET   1   7.123 -18.335   3.354
    2   2H    MET   1          2HT       MET   1   6.484 -19.504   2.310
    3   3H    MET   1          3HT       MET   1   5.540 -18.178   2.773
    4    HA   MET   1           HA       MET   1   8.084 -17.805   1.336
    5   1HB   MET   1          2HB       MET   1   5.355 -18.409   0.196
    6   2HB   MET   1          1HB       MET   1   6.638 -17.658  -0.741
    7   1HG   MET   1          2HG       MET   1   6.779 -20.365   0.564
    8   2HG   MET   1          1HG       MET   1   6.483 -20.057  -1.147
    9   1HE   MET   1          1HE       MET   1   8.446 -17.558  -1.625
   10   2HE   MET   1          2HE       MET   1   8.271 -18.896  -2.761
   11   3HE   MET   1          3HE       MET   1   9.876 -18.393  -2.233
   12    H    GLN   2           H        GLN   2   8.431 -15.721   0.766
   13    HA   GLN   2           HA       GLN   2   6.434 -13.759   1.663
   14   1HB   GLN   2          2HB       GLN   2   8.610 -13.607   2.794
   15   2HB   GLN   2          1HB       GLN   2   9.414 -13.434   1.240
   16   1HG   GLN   2          2HG       GLN   2   8.242 -11.327   0.864
   17   2HG   GLN   2          1HG       GLN   2   7.430 -11.500   2.418
   18   1HE2  GLN   2          1HE2      GLN   2   8.281 -10.292   3.938
   19   2HE2  GLN   2          2HE2      GLN   2   9.949  -9.873   4.103
   20    H    TYR   3           H        TYR   3   5.778 -12.113   0.291
   21    HA   TYR   3           HA       TYR   3   6.696 -12.350  -2.497
   22   1HB   TYR   3          2HB       TYR   3   3.903 -11.803  -1.488
   23   2HB   TYR   3          1HB       TYR   3   4.391 -11.673  -3.174
   24    HD1  TYR   3           1HD      TYR   3   4.650 -13.613  -4.537
   25    HD2  TYR   3           2HD      TYR   3   3.897 -14.020  -0.368
   26    HE1  TYR   3           1HE      TYR   3   4.203 -16.011  -4.856
   27    HE2  TYR   3           2HE      TYR   3   3.450 -16.418  -0.677
   28    HH   TYR   3           HH       TYR   3   4.119 -18.212  -2.381
   29    H    LYS   4           H        LYS   4   6.911 -10.496  -3.710
   30    HA   LYS   4           HA       LYS   4   7.198  -8.035  -2.153
   31   1HB   LYS   4          2HB       LYS   4   9.141  -8.740  -3.448
   32   2HB   LYS   4          1HB       LYS   4   8.174  -8.806  -4.914
   33   1HG   LYS   4          2HG       LYS   4   9.089  -6.782  -5.256
   34   2HG   LYS   4          1HG       LYS   4   7.756  -6.253  -4.229
   35   1HD   LYS   4          2HD       LYS   4  10.556  -6.873  -3.296
   36   2HD   LYS   4          1HD       LYS   4   9.887  -5.260  -3.541
   37   1HE   LYS   4          2HE       LYS   4   8.163  -5.762  -1.844
   38   2HE   LYS   4          1HE       LYS   4   8.935  -7.321  -1.560
   39   1HZ   LYS   4          1HZ       LYS   4  10.591  -6.387  -0.392
   40   2HZ   LYS   4          2HZ       LYS   4   9.499  -5.114  -0.179
   41   3HZ   LYS   4          3HZ       LYS   4  10.685  -5.018  -1.380
   42    H    VAL   5           H        VAL   5   5.284  -6.964  -2.073
   43    HA   VAL   5           HA       VAL   5   3.629  -6.834  -4.476
   44    HB   VAL   5           HB       VAL   5   3.043  -5.837  -1.685
   45   1HG1  VAL   5          1HG1      VAL   5   1.165  -6.192  -4.017
   46   2HG1  VAL   5          2HG1      VAL   5   1.838  -4.646  -3.504
   47   3HG1  VAL   5          3HG1      VAL   5   0.772  -5.545  -2.424
   48   1HG2  VAL   5          1HG2      VAL   5   2.755  -8.454  -2.982
   49   2HG2  VAL   5          2HG2      VAL   5   1.316  -7.878  -2.138
   50   3HG2  VAL   5          3HG2      VAL   5   2.844  -8.036  -1.271
   51    H    ILE   6           H        ILE   6   4.010  -5.256  -5.843
   52    HA   ILE   6           HA       ILE   6   5.192  -2.749  -4.921
   53    HB   ILE   6           HB       ILE   6   4.753  -3.822  -7.709
   54   1HG1  ILE   6          2HG1      ILE   6   7.274  -3.399  -6.091
   55   2HG1  ILE   6          1HG1      ILE   6   6.516  -4.953  -6.414
   56   1HG2  ILE   6          1HG2      ILE   6   4.787  -1.655  -8.295
   57   2HG2  ILE   6          2HG2      ILE   6   6.520  -1.784  -7.993
   58   3HG2  ILE   6          3HG2      ILE   6   5.454  -1.141  -6.745
   59   1HD1  ILE   6          1HD1      ILE   6   6.912  -4.608  -8.820
   60   2HD1  ILE   6          2HD1      ILE   6   8.400  -4.636  -7.874
   61   3HD1  ILE   6          3HD1      ILE   6   7.744  -3.099  -8.441
   62    H    LEU   7           H        LEU   7   3.944  -1.081  -4.478
   63    HA   LEU   7           HA       LEU   7   1.232  -0.972  -5.587
   64   1HB   LEU   7          2HB       LEU   7   2.315   0.862  -3.467
   65   2HB   LEU   7          1HB       LEU   7   0.651   0.394  -3.768
   66    HG   LEU   7           HG       LEU   7   2.805  -1.331  -2.564
   67   1HD1  LEU   7          1HD1      LEU   7   1.329  -1.300  -0.599
   68   2HD1  LEU   7          2HD1      LEU   7   0.271  -0.163  -1.430
   69   3HD1  LEU   7          3HD1      LEU   7   1.920   0.304  -1.023
   70   1HD2  LEU   7          1HD2      LEU   7   1.066  -3.034  -2.324
   71   2HD2  LEU   7          2HD2      LEU   7   1.370  -2.657  -4.019
   72   3HD2  LEU   7          3HD2      LEU   7  -0.060  -2.010  -3.217
   73    H    ASN   8           H        ASN   8   1.871  -0.272  -7.674
   74    HA   ASN   8           HA       ASN   8   3.260   2.275  -7.894
   75   1HB   ASN   8          2HB       ASN   8   3.853   0.310  -9.324
   76   2HB   ASN   8          1HB       ASN   8   2.271   0.437 -10.082
   77   1HD2  ASN   8          1HD2      ASN   8   5.328   0.991 -10.667
   78   2HD2  ASN   8          2HD2      ASN   8   5.243   2.419 -11.638
   79    H    GLY   9           H        GLY   9   2.040   4.051  -7.670
   80   1HA   GLY   9          2HA       GLY   9  -0.568   4.071  -9.047
   81   2HA   GLY   9          1HA       GLY   9  -0.249   4.959  -7.566
   82    H    LYS  10           H        LYS  10  -1.179   6.667  -8.983
   83    HA   LYS  10           HA       LYS  10   0.539   7.748 -11.027
   84   1HB   LYS  10          2HB       LYS  10  -1.935   8.936  -9.757
   85   2HB   LYS  10          1HB       LYS  10  -1.181   9.454 -11.258
   86   1HG   LYS  10          2HG       LYS  10  -1.779   7.408 -12.343
   87   2HG   LYS  10          1HG       LYS  10  -2.348   6.715 -10.825
   88   1HD   LYS  10          2HD       LYS  10  -4.212   7.470 -12.221
   89   2HD   LYS  10          1HD       LYS  10  -4.124   8.385 -10.715
   90   1HE   LYS  10          2HE       LYS  10  -3.008  10.210 -11.878
   91   2HE   LYS  10          1HE       LYS  10  -3.062   9.296 -13.384
   92   1HZ   LYS  10          1HZ       LYS  10  -4.839  10.937 -13.256
   93   2HZ   LYS  10          2HZ       LYS  10  -5.433  10.213 -11.848
   94   3HZ   LYS  10          3HZ       LYS  10  -5.468   9.367 -13.313
   95    H    THR  11           H        THR  11  -0.757   8.969  -7.942
   96    HA   THR  11           HA       THR  11   1.463  10.855  -7.749
   97    HB   THR  11           HB       THR  11  -0.020  11.642  -5.756
   98    HG1  THR  11           1HG      THR  11  -1.370   9.730  -5.936
   99   1HG2  THR  11          1HG2      THR  11  -1.110  11.990  -8.536
  100   2HG2  THR  11          2HG2      THR  11   0.227  12.915  -7.855
  101   3HG2  THR  11          3HG2      THR  11  -1.383  13.043  -7.148
  102    H    LEU  12           H        LEU  12   0.801   7.781  -6.838
  103    HA   LEU  12           HA       LEU  12   2.549   7.999  -4.505
  104   1HB   LEU  12          2HB       LEU  12   0.284   7.831  -3.654
  105   2HB   LEU  12          1HB       LEU  12  -0.010   6.408  -4.638
  106    HG   LEU  12           HG       LEU  12   1.498   5.104  -3.323
  107   1HD1  LEU  12          1HD1      LEU  12   3.298   6.155  -2.546
  108   2HD1  LEU  12          2HD1      LEU  12   2.285   6.655  -1.189
  109   3HD1  LEU  12          3HD1      LEU  12   2.496   7.719  -2.575
  110   1HD2  LEU  12          1HD2      LEU  12   0.251   6.451  -1.060
  111   2HD2  LEU  12          2HD2      LEU  12   0.045   4.804  -1.655
  112   3HD2  LEU  12          3HD2      LEU  12  -0.864   6.126  -2.387
  113    H    LYS  13           H        LYS  13   4.075   6.472  -4.352
  114    HA   LYS  13           HA       LYS  13   3.887   4.041  -5.957
  115   1HB   LYS  13          2HB       LYS  13   6.209   5.970  -6.182
  116   2HB   LYS  13          1HB       LYS  13   6.123   4.382  -6.933
  117   1HG   LYS  13          2HG       LYS  13   4.212   5.121  -8.269
  118   2HG   LYS  13          1HG       LYS  13   4.315   6.716  -7.522
  119   1HD   LYS  13          2HD       LYS  13   6.569   6.997  -8.433
  120   2HD   LYS  13          1HD       LYS  13   6.469   5.401  -9.176
  121   1HE   LYS  13          2HE       LYS  13   6.004   7.179 -10.792
  122   2HE   LYS  13          1HE       LYS  13   4.604   6.136 -10.552
  123   1HZ   LYS  13          1HZ       LYS  13   4.525   8.303  -8.736
  124   2HZ   LYS  13          2HZ       LYS  13   3.408   7.879  -9.933
  125   3HZ   LYS  13          3HZ       LYS  13   4.709   8.891 -10.312
  126    H    GLY  14           H        GLY  14   5.130   2.324  -5.138
  127   1HA   GLY  14          2HA       GLY  14   7.183   2.583  -3.251
  128   2HA   GLY  14          1HA       GLY  14   5.671   2.426  -2.377
  129    H    GLU  15           H        GLU  15   6.794   0.516  -1.532
  130    HA   GLU  15           HA       GLU  15   5.998  -1.823  -3.054
  131   1HB   GLU  15          2HB       GLU  15   8.832  -1.453  -2.065
  132   2HB   GLU  15          1HB       GLU  15   8.176  -2.939  -2.740
  133   1HG   GLU  15          2HG       GLU  15   7.798  -1.809  -4.870
  134   2HG   GLU  15          1HG       GLU  15   8.454  -0.318  -4.194
  135    H    THR  16           H        THR  16   5.468  -3.547  -1.807
  136    HA   THR  16           HA       THR  16   5.988  -3.437   1.059
  137    HB   THR  16           HB       THR  16   3.873  -2.502   1.161
  138    HG1  THR  16           1HG      THR  16   3.234  -5.232   1.059
  139   1HG2  THR  16          1HG2      THR  16   3.292  -4.026  -1.310
  140   2HG2  THR  16          2HG2      THR  16   2.961  -2.343  -0.910
  141   3HG2  THR  16          3HG2      THR  16   1.955  -3.625  -0.236
  142    H    THR  17           H        THR  17   5.248  -5.568   2.140
  143    HA   THR  17           HA       THR  17   5.453  -7.820   0.276
  144    HB   THR  17           HB       THR  17   7.204  -8.881   1.595
  145    HG1  THR  17           1HG      THR  17   7.805  -8.123   3.454
  146   1HG2  THR  17          1HG2      THR  17   8.743  -7.914   0.361
  147   2HG2  THR  17          2HG2      THR  17   8.675  -6.457   1.351
  148   3HG2  THR  17          3HG2      THR  17   7.589  -6.642  -0.023
  149    H    THR  18           H        THR  18   4.037  -9.307   0.686
  150    HA   THR  18           HA       THR  18   2.911  -9.589   3.415
  151    HB   THR  18           HB       THR  18   1.291  -8.902   1.647
  152    HG1  THR  18           1HG      THR  18   0.674 -10.253   3.437
  153   1HG2  THR  18          1HG2      THR  18   2.156 -11.460   0.361
  154   2HG2  THR  18          2HG2      THR  18   1.970  -9.860  -0.354
  155   3HG2  THR  18          3HG2      THR  18   0.545 -10.793   0.102
  156    H    GLU  19           H        GLU  19   2.763 -11.665   4.299
  157    HA   GLU  19           HA       GLU  19   4.370 -13.715   2.920
  158   1HB   GLU  19          2HB       GLU  19   5.236 -13.017   5.105
  159   2HB   GLU  19          1HB       GLU  19   3.699 -13.420   5.856
  160   1HG   GLU  19          2HG       GLU  19   4.026 -15.767   5.270
  161   2HG   GLU  19          1HG       GLU  19   5.567 -15.362   4.516
  162    H    ALA  20           H        ALA  20   3.249 -15.339   1.994
  163    HA   ALA  20           HA       ALA  20   0.963 -16.453   3.403
  164   1HB   ALA  20          1HB       ALA  20  -0.620 -15.617   2.097
  165   2HB   ALA  20          2HB       ALA  20   0.216 -16.185   0.650
  166   3HB   ALA  20          3HB       ALA  20   0.605 -14.607   1.330
  167    H    VAL  21           H        VAL  21   0.364 -18.508   2.742
  168    HA   VAL  21           HA       VAL  21   2.350 -20.304   2.137
  169    HB   VAL  21           HB       VAL  21  -0.550 -20.737   1.427
  170   1HG1  VAL  21          1HG1      VAL  21   1.495 -22.725   2.390
  171   2HG1  VAL  21          2HG1      VAL  21   1.138 -22.435   0.687
  172   3HG1  VAL  21          3HG1      VAL  21  -0.119 -23.053   1.759
  173   1HG2  VAL  21          1HG2      VAL  21   0.836 -20.664   4.074
  174   2HG2  VAL  21          2HG2      VAL  21  -0.528 -21.753   3.824
  175   3HG2  VAL  21          3HG2      VAL  21  -0.737 -20.013   3.610
  176    H    ASP  22           H        ASP  22   0.415 -18.451  -0.087
  177    HA   ASP  22           HA       ASP  22   2.135 -19.279  -2.266
  178   1HB   ASP  22          2HB       ASP  22   0.144 -19.810  -3.754
  179   2HB   ASP  22          1HB       ASP  22   0.557 -21.017  -2.541
  180    H    ALA  23           H        ALA  23   1.450 -18.127  -4.368
  181    HA   ALA  23           HA       ALA  23   1.521 -15.378  -3.911
  182   1HB   ALA  23          1HB       ALA  23   2.111 -15.398  -6.051
  183   2HB   ALA  23          2HB       ALA  23   0.476 -15.865  -6.516
  184   3HB   ALA  23          3HB       ALA  23   1.674 -17.104  -6.145
  185    H    ALA  24           H        ALA  24  -1.192 -17.486  -4.731
  186    HA   ALA  24           HA       ALA  24  -3.102 -15.427  -5.043
  187   1HB   ALA  24          1HB       ALA  24  -3.256 -18.370  -4.532
  188   2HB   ALA  24          2HB       ALA  24  -3.851 -17.434  -5.904
  189   3HB   ALA  24          3HB       ALA  24  -4.711 -17.388  -4.366
  190    H    THR  25           H        THR  25  -2.458 -17.578  -2.250
  191    HA   THR  25           HA       THR  25  -4.186 -16.383  -0.455
  192    HB   THR  25           HB       THR  25  -2.543 -17.171   1.305
  193    HG1  THR  25           1HG      THR  25  -1.008 -17.491  -0.955
  194   1HG2  THR  25          1HG2      THR  25  -2.735 -19.590   0.738
  195   2HG2  THR  25          2HG2      THR  25  -3.444 -19.104  -0.800
  196   3HG2  THR  25          3HG2      THR  25  -4.254 -18.693   0.711
  197    H    ALA  26           H        ALA  26  -0.847 -15.543  -1.293
  198    HA   ALA  26           HA       ALA  26  -0.552 -13.394   0.498
  199   1HB   ALA  26          1HB       ALA  26   0.716 -13.771  -2.219
  200   2HB   ALA  26          2HB       ALA  26   1.342 -14.395  -0.694
  201   3HB   ALA  26          3HB       ALA  26   1.264 -12.656  -0.968
  202    H    GLU  27           H        GLU  27  -1.540 -13.467  -2.932
  203    HA   GLU  27           HA       GLU  27  -2.053 -10.774  -3.277
  204   1HB   GLU  27          2HB       GLU  27  -2.039 -12.451  -5.088
  205   2HB   GLU  27          1HB       GLU  27  -3.552 -13.103  -4.479
  206   1HG   GLU  27          2HG       GLU  27  -3.406 -10.223  -5.223
  207   2HG   GLU  27          1HG       GLU  27  -3.513 -11.440  -6.492
  208    H    LYS  28           H        LYS  28  -4.179 -13.341  -2.079
  209    HA   LYS  28           HA       LYS  28  -6.473 -11.733  -1.741
  210   1HB   LYS  28          2HB       LYS  28  -5.659 -14.289  -0.352
  211   2HB   LYS  28          1HB       LYS  28  -7.255 -13.562  -0.246
  212   1HG   LYS  28          2HG       LYS  28  -5.933 -14.622  -2.733
  213   2HG   LYS  28          1HG       LYS  28  -7.271 -15.360  -1.849
  214   1HD   LYS  28          2HD       LYS  28  -8.666 -13.410  -2.345
  215   2HD   LYS  28          1HD       LYS  28  -7.327 -12.675  -3.227
  216   1HE   LYS  28          2HE       LYS  28  -8.705 -15.268  -3.921
  217   2HE   LYS  28          1HE       LYS  28  -8.917 -13.728  -4.752
  218   1HZ   LYS  28          1HZ       LYS  28  -6.374 -15.252  -4.575
  219   2HZ   LYS  28          2HZ       LYS  28  -6.591 -13.785  -5.387
  220   3HZ   LYS  28          3HZ       LYS  28  -7.383 -15.177  -5.931
  221    H    VAL  29           H        VAL  29  -3.906 -12.712   0.505
  222    HA   VAL  29           HA       VAL  29  -4.921 -11.491   2.803
  223    HB   VAL  29           HB       VAL  29  -2.017 -11.836   2.024
  224   1HG1  VAL  29          1HG1      VAL  29  -2.569 -11.975   4.848
  225   2HG1  VAL  29          2HG1      VAL  29  -3.098 -10.432   4.183
  226   3HG1  VAL  29          3HG1      VAL  29  -1.427 -10.953   3.976
  227   1HG2  VAL  29          1HG2      VAL  29  -3.128 -13.669   3.998
  228   2HG2  VAL  29          2HG2      VAL  29  -2.158 -14.000   2.563
  229   3HG2  VAL  29          3HG2      VAL  29  -3.903 -13.801   2.419
  230    H    VAL  30           H        VAL  30  -2.972 -10.211   0.166
  231    HA   VAL  30           HA       VAL  30  -2.462  -7.670   1.275
  232    HB   VAL  30           HB       VAL  30  -2.836  -8.284  -1.662
  233   1HG1  VAL  30          1HG1      VAL  30  -1.665  -6.333  -2.111
  234   2HG1  VAL  30          2HG1      VAL  30  -0.965  -6.262  -0.495
  235   3HG1  VAL  30          3HG1      VAL  30  -2.665  -5.871  -0.734
  236   1HG2  VAL  30          1HG2      VAL  30  -0.996  -9.464   0.076
  237   2HG2  VAL  30          2HG2      VAL  30  -0.092  -8.207  -0.770
  238   3HG2  VAL  30          3HG2      VAL  30  -0.940  -9.452  -1.686
  239    H    LYS  31           H        LYS  31  -5.133  -8.901  -0.753
  240    HA   LYS  31           HA       LYS  31  -6.527  -6.583  -1.216
  241   1HB   LYS  31          2HB       LYS  31  -7.883  -9.155  -0.417
  242   2HB   LYS  31          1HB       LYS  31  -8.519  -7.892  -1.458
  243   1HG   LYS  31          2HG       LYS  31  -6.319  -9.836  -2.060
  244   2HG   LYS  31          1HG       LYS  31  -7.892  -9.700  -2.838
  245   1HD   LYS  31          2HD       LYS  31  -5.896  -7.463  -2.883
  246   2HD   LYS  31          1HD       LYS  31  -5.871  -8.753  -4.084
  247   1HE   LYS  31          2HE       LYS  31  -7.101  -6.908  -4.989
  248   2HE   LYS  31          1HE       LYS  31  -8.234  -8.208  -4.627
  249   1HZ   LYS  31          1HZ       LYS  31  -7.858  -6.322  -2.476
  250   2HZ   LYS  31          2HZ       LYS  31  -9.285  -6.966  -3.112
  251   3HZ   LYS  31          3HZ       LYS  31  -8.540  -5.651  -3.870
  252    H    GLN  32           H        GLN  32  -6.733  -8.689   1.608
  253    HA   GLN  32           HA       GLN  32  -8.629  -7.215   3.041
  254   1HB   GLN  32          2HB       GLN  32  -8.200  -9.362   3.861
  255   2HB   GLN  32          1HB       GLN  32  -6.463  -9.138   3.846
  256   1HG   GLN  32          2HG       GLN  32  -8.251  -7.605   5.704
  257   2HG   GLN  32          1HG       GLN  32  -7.661  -9.215   6.097
  258   1HE2  GLN  32          1HE2      GLN  32  -5.173  -8.057   4.385
  259   2HE2  GLN  32          2HE2      GLN  32  -4.265  -7.291   5.632
  260    H    PHE  33           H        PHE  33  -5.160  -6.854   2.722
  261    HA   PHE  33           HA       PHE  33  -4.626  -5.019   4.732
  262   1HB   PHE  33          2HB       PHE  33  -2.972  -6.165   3.190
  263   2HB   PHE  33          1HB       PHE  33  -3.400  -4.977   1.966
  264    HD1  PHE  33           1HD      PHE  33  -2.254  -5.153   5.502
  265    HD2  PHE  33           2HD      PHE  33  -2.122  -3.081   1.781
  266    HE1  PHE  33           1HE      PHE  33  -0.592  -3.584   6.421
  267    HE2  PHE  33           2HE      PHE  33  -0.455  -1.525   2.701
  268    HZ   PHE  33           HZ       PHE  33   0.308  -1.784   5.029
  269    H    PHE  34           H        PHE  34  -5.130  -4.232   1.321
  270    HA   PHE  34           HA       PHE  34  -5.604  -1.469   1.781
  271   1HB   PHE  34          2HB       PHE  34  -6.271  -3.155  -0.634
  272   2HB   PHE  34          1HB       PHE  34  -6.258  -1.390  -0.589
  273    HD1  PHE  34           1HD      PHE  34  -3.916  -0.773   0.960
  274    HD2  PHE  34           2HD      PHE  34  -4.483  -3.801  -1.971
  275    HE1  PHE  34           1HE      PHE  34  -1.500  -0.790   0.520
  276    HE2  PHE  34           2HE      PHE  34  -2.065  -3.815  -2.424
  277    HZ   PHE  34           HZ       PHE  34  -0.579  -2.310  -1.163
  278    H    ASN  35           H        ASN  35  -7.717  -4.242   1.376
  279    HA   ASN  35           HA       ASN  35 -10.189  -3.027   1.154
  280   1HB   ASN  35          2HB       ASN  35  -9.813  -5.465   1.057
  281   2HB   ASN  35          1HB       ASN  35  -9.470  -5.476   2.784
  282   1HD2  ASN  35          1HD2      ASN  35 -11.652  -6.414   0.748
  283   2HD2  ASN  35          2HD2      ASN  35 -13.110  -6.135   1.630
  284    H    ASP  36           H        ASP  36  -8.183  -3.579   3.950
  285    HA   ASP  36           HA       ASP  36 -10.109  -2.314   5.741
  286   1HB   ASP  36          2HB       ASP  36  -7.485  -3.706   6.291
  287   2HB   ASP  36          1HB       ASP  36  -8.494  -2.974   7.535
  288    H    ASN  37           H        ASN  37  -7.171  -1.518   4.062
  289    HA   ASN  37           HA       ASN  37  -6.546   0.697   5.829
  290   1HB   ASN  37          2HB       ASN  37  -5.381  -0.070   3.142
  291   2HB   ASN  37          1HB       ASN  37  -4.793   1.248   4.148
  292   1HD2  ASN  37          1HD2      ASN  37  -3.689  -1.421   3.164
  293   2HD2  ASN  37          2HD2      ASN  37  -3.028  -2.126   4.598
  294    H    GLY  38           H        GLY  38  -7.743   0.239   2.545
  295   1HA   GLY  38          2HA       GLY  38  -8.084   2.308   1.173
  296   2HA   GLY  38          1HA       GLY  38  -9.563   1.517   1.672
  297    H    VAL  39           H        VAL  39 -11.049   2.734   2.579
  298    HA   VAL  39           HA       VAL  39 -10.301   5.451   3.414
  299    HB   VAL  39           HB       VAL  39 -13.011   4.393   2.682
  300   1HG1  VAL  39          1HG1      VAL  39 -11.977   7.018   3.529
  301   2HG1  VAL  39          2HG1      VAL  39 -13.593   6.330   3.684
  302   3HG1  VAL  39          3HG1      VAL  39 -13.081   7.044   2.155
  303   1HG2  VAL  39          1HG2      VAL  39 -11.493   4.181   0.788
  304   2HG2  VAL  39          2HG2      VAL  39 -11.026   5.873   0.958
  305   3HG2  VAL  39          3HG2      VAL  39 -12.677   5.456   0.498
  306    H    ASP  40           H        ASP  40 -10.903   2.621   5.046
  307    HA   ASP  40           HA       ASP  40 -12.240   4.103   7.202
  308   1HB   ASP  40          2HB       ASP  40 -12.644   1.196   6.469
  309   2HB   ASP  40          1HB       ASP  40 -13.341   1.996   7.875
  310    H    GLY  41           H        GLY  41  -9.339   3.077   6.409
  311   1HA   GLY  41          2HA       GLY  41  -8.677   1.427   8.685
  312   2HA   GLY  41          1HA       GLY  41  -7.554   2.062   7.494
  313    H    GLU  42           H        GLU  42  -6.682   2.044   9.991
  314    HA   GLU  42           HA       GLU  42  -7.113   4.736  11.092
  315   1HB   GLU  42          2HB       GLU  42  -5.793   2.315  12.339
  316   2HB   GLU  42          1HB       GLU  42  -6.021   3.869  13.129
  317   1HG   GLU  42          2HG       GLU  42  -8.227   2.066  12.162
  318   2HG   GLU  42          1HG       GLU  42  -7.676   2.207  13.830
  319    H    TRP  43           H        TRP  43  -5.733   6.182  10.281
  320    HA   TRP  43           HA       TRP  43  -2.995   5.337   9.652
  321   1HB   TRP  43          2HB       TRP  43  -4.487   7.826   8.812
  322   2HB   TRP  43          1HB       TRP  43  -2.884   7.348   8.267
  323    HD1  TRP  43           HD       TRP  43  -5.952   4.987   8.418
  324    HE1  TRP  43           1HE      TRP  43  -6.443   4.190   6.020
  325    HE3  TRP  43           3HE      TRP  43  -2.527   7.823   5.901
  326    HZ2  TRP  43           2HZ      TRP  43  -5.507   4.697   3.414
  327    HZ3  TRP  43           3HZ      TRP  43  -2.388   7.609   3.458
  328    HH2  TRP  43           HH       TRP  43  -3.848   6.074   2.238
  329    H    THR  44           H        THR  44  -1.370   5.933  10.920
  330    HA   THR  44           HA       THR  44  -1.748   8.237  12.714
  331    HB   THR  44           HB       THR  44   0.087   7.223  14.071
  332    HG1  THR  44           1HG      THR  44  -0.261   4.980  12.379
  333   1HG2  THR  44          1HG2      THR  44  -1.317   5.986  15.286
  334   2HG2  THR  44          2HG2      THR  44  -1.750   4.955  13.924
  335   3HG2  THR  44          3HG2      THR  44  -2.530   6.525  14.126
  336    H    TYR  45           H        TYR  45  -0.275   9.912  12.649
  337    HA   TYR  45           HA       TYR  45   1.703   9.752  10.475
  338   1HB   TYR  45          2HB       TYR  45  -0.060  11.410  10.118
  339   2HB   TYR  45          1HB       TYR  45   0.338  12.181  11.647
  340    HD1  TYR  45           1HD      TYR  45   2.521  10.948   8.881
  341    HD2  TYR  45           2HD      TYR  45   1.184  14.280  11.161
  342    HE1  TYR  45           1HE      TYR  45   4.146  12.384   7.723
  343    HE2  TYR  45           2HE      TYR  45   2.806  15.726  10.010
  344    HH   TYR  45           HH       TYR  45   4.905  15.532   8.785
  345    H    ASP  46           H        ASP  46   3.779  10.462  10.741
  346    HA   ASP  46           HA       ASP  46   4.612  11.133  13.487
  347   1HB   ASP  46          2HB       ASP  46   5.283   8.835  12.926
  348   2HB   ASP  46          1HB       ASP  46   6.099   9.417  11.479
  349    H    ASP  47           H        ASP  47   4.441  13.353  12.849
  350    HA   ASP  47           HA       ASP  47   5.552  14.624  10.702
  351   1HB   ASP  47          2HB       ASP  47   5.488  15.624  13.555
  352   2HB   ASP  47          1HB       ASP  47   5.719  16.632  12.130
  353    H    ALA  48           H        ALA  48   7.221  13.516  13.602
  354    HA   ALA  48           HA       ALA  48   9.618  14.821  13.423
  355   1HB   ALA  48          1HB       ALA  48   9.043  11.990  14.254
  356   2HB   ALA  48          2HB       ALA  48   9.214  13.414  15.280
  357   3HB   ALA  48          3HB       ALA  48  10.621  12.752  14.449
  358    H    THR  49           H        THR  49   8.488  12.186  11.404
  359    HA   THR  49           HA       THR  49  10.946  12.468   9.804
  360    HB   THR  49           HB       THR  49  10.802  10.060   9.257
  361    HG1  THR  49           1HG      THR  49   9.198   8.888   9.933
  362   1HG2  THR  49          1HG2      THR  49  12.315   9.968  10.881
  363   2HG2  THR  49          2HG2      THR  49  11.002   9.368  11.893
  364   3HG2  THR  49          3HG2      THR  49  11.414  11.082  11.909
  365    H    LYS  50           H        LYS  50   7.970  13.404   9.704
  366    HA   LYS  50           HA       LYS  50   6.324  13.692   8.132
  367   1HB   LYS  50          2HB       LYS  50   8.745  13.509   6.335
  368   2HB   LYS  50          1HB       LYS  50   7.162  14.086   5.825
  369   1HG   LYS  50          2HG       LYS  50   7.692  15.612   8.051
  370   2HG   LYS  50          1HG       LYS  50   9.271  15.458   7.278
  371   1HD   LYS  50          2HD       LYS  50   6.732  16.385   5.945
  372   2HD   LYS  50          1HD       LYS  50   8.060  17.424   6.464
  373   1HE   LYS  50          2HE       LYS  50   8.222  15.237   4.392
  374   2HE   LYS  50          1HE       LYS  50   8.166  16.967   4.062
  375   1HZ   LYS  50          1HZ       LYS  50  10.405  15.376   4.610
  376   2HZ   LYS  50          2HZ       LYS  50  10.248  16.496   5.868
  377   3HZ   LYS  50          3HZ       LYS  50  10.354  17.033   4.268
  378    H    THR  51           H        THR  51   6.759  10.990   8.976
  379    HA   THR  51           HA       THR  51   6.042   9.522   6.527
  380    HB   THR  51           HB       THR  51   7.380   8.499   9.037
  381    HG1  THR  51           1HG      THR  51   9.116   8.133   7.564
  382   1HG2  THR  51          1HG2      THR  51   5.831   7.020   7.285
  383   2HG2  THR  51          2HG2      THR  51   7.034   6.404   8.418
  384   3HG2  THR  51          3HG2      THR  51   7.489   6.749   6.750
  385    H    PHE  52           H        PHE  52   4.246   8.267   6.507
  386    HA   PHE  52           HA       PHE  52   2.484   8.447   8.861
  387   1HB   PHE  52          2HB       PHE  52   1.726   7.902   5.979
  388   2HB   PHE  52          1HB       PHE  52   0.615   8.138   7.322
  389    HD1  PHE  52           1HD      PHE  52  -0.399  10.184   7.462
  390    HD2  PHE  52           2HD      PHE  52   3.475   9.931   5.718
  391    HE1  PHE  52           1HE      PHE  52  -0.464  12.593   6.969
  392    HE2  PHE  52           2HE      PHE  52   3.415  12.340   5.229
  393    HZ   PHE  52           HZ       PHE  52   1.444  13.671   5.855
  394    H    THR  53           H        THR  53   1.574   6.581   9.713
  395    HA   THR  53           HA       THR  53   2.490   4.061   8.496
  396    HB   THR  53           HB       THR  53   2.202   3.180  10.932
  397    HG1  THR  53           1HG      THR  53   1.984   4.617  12.424
  398   1HG2  THR  53          1HG2      THR  53   4.465   4.551   9.683
  399   2HG2  THR  53          2HG2      THR  53   4.367   2.962  10.446
  400   3HG2  THR  53          3HG2      THR  53   4.551   4.411  11.439
  401    H    VAL  54           H        VAL  54   0.985   2.773   7.792
  402    HA   VAL  54           HA       VAL  54  -1.785   3.163   8.697
  403    HB   VAL  54           HB       VAL  54  -0.783   1.724   6.226
  404   1HG1  VAL  54          1HG1      VAL  54  -3.186   1.393   7.513
  405   2HG1  VAL  54          2HG1      VAL  54  -2.877   1.060   5.810
  406   3HG1  VAL  54          3HG1      VAL  54  -3.562   2.610   6.294
  407   1HG2  VAL  54          1HG2      VAL  54  -2.367   4.166   5.901
  408   2HG2  VAL  54          2HG2      VAL  54  -0.908   3.637   5.062
  409   3HG2  VAL  54          3HG2      VAL  54  -0.784   4.423   6.635
  410    H    THR  55           H        THR  55  -2.228   1.847  10.363
  411    HA   THR  55           HA       THR  55  -1.118  -0.869  10.326
  412    HB   THR  55           HB       THR  55  -2.446   0.565  12.625
  413    HG1  THR  55           1HG      THR  55  -0.633   1.652  12.548
  414   1HG2  THR  55          1HG2      THR  55  -1.206  -1.081  13.993
  415   2HG2  THR  55          2HG2      THR  55  -0.772  -1.929  12.508
  416   3HG2  THR  55          3HG2      THR  55  -2.466  -1.798  12.986
  417    H    GLU  56           H        GLU  56  -2.370  -2.464   9.620
  418    HA   GLU  56           HA       GLU  56  -5.213  -2.057   9.345
  419   1HB   GLU  56          2HB       GLU  56  -5.287  -4.163   8.236
  420   2HB   GLU  56          1HB       GLU  56  -3.826  -3.351   7.696
  421   1HG   GLU  56          2HG       GLU  56  -2.490  -4.726   9.169
  422   2HG   GLU  56          1HG       GLU  56  -3.943  -5.492   9.806
  423   1H    MET   1          1HT       MET   1   7.613  18.209  -3.159
  424   2H    MET   1          2HT       MET   1   6.988  19.392  -2.124
  425   3H    MET   1          3HT       MET   1   6.019  18.090  -2.602
  426    HA   MET   1           HA       MET   1   8.533  17.656  -1.129
  427   1HB   MET   1          2HB       MET   1   5.802  18.325  -0.028
  428   2HB   MET   1          1HB       MET   1   7.054  17.544   0.927
  429   1HG   MET   1          2HG       MET   1   7.279  20.247  -0.374
  430   2HG   MET   1          1HG       MET   1   6.951  19.945   1.331
  431   1HE   MET   1          1HE       MET   1   8.846  17.401   1.836
  432   2HE   MET   1          2HE       MET   1   8.687  18.743   2.971
  433   3HE   MET   1          3HE       MET   1  10.287  18.200   2.465
  434    H    GLN   2           H        GLN   2   8.821  15.564  -0.555
  435    HA   GLN   2           HA       GLN   2   6.790  13.650  -1.480
  436   1HB   GLN   2          2HB       GLN   2   8.977  13.446  -2.581
  437   2HB   GLN   2          1HB       GLN   2   9.754  13.254  -1.014
  438   1HG   GLN   2          2HG       GLN   2   8.526  11.176  -0.656
  439   2HG   GLN   2          1HG       GLN   2   7.740  11.369  -2.222
  440   1HE2  GLN   2          1HE2      GLN   2   8.584  10.140  -3.730
  441   2HE2  GLN   2          2HE2      GLN   2  10.242   9.681  -3.870
  442    H    TYR   3           H        TYR   3   6.074  12.022  -0.119
  443    HA   TYR   3           HA       TYR   3   6.959  12.237   2.685
  444   1HB   TYR   3          2HB       TYR   3   4.166  11.757   1.634
  445   2HB   TYR   3          1HB       TYR   3   4.628  11.616   3.327
  446    HD1  TYR   3           1HD      TYR   3   4.914  13.550   4.694
  447    HD2  TYR   3           2HD      TYR   3   4.230  13.974   0.515
  448    HE1  TYR   3           1HE      TYR   3   4.522  15.958   5.007
  449    HE2  TYR   3           2HE      TYR   3   3.837  16.382   0.818
  450    HH   TYR   3           HH       TYR   3   4.526  18.159   2.532
  451    H    LYS   4           H        LYS   4   7.110  10.378   3.898
  452    HA   LYS   4           HA       LYS   4   7.360   7.910   2.346
  453   1HB   LYS   4          2HB       LYS   4   9.301   8.569   3.667
  454   2HB   LYS   4          1HB       LYS   4   8.316   8.658   5.119
  455   1HG   LYS   4          2HG       LYS   4   9.175   6.612   5.475
  456   2HG   LYS   4          1HG       LYS   4   7.845   6.116   4.429
  457   1HD   LYS   4          2HD       LYS   4  10.673   6.669   3.535
  458   2HD   LYS   4          1HD       LYS   4   9.961   5.071   3.772
  459   1HE   LYS   4          2HE       LYS   4   8.274   5.613   2.049
  460   2HE   LYS   4          1HE       LYS   4   9.087   7.155   1.777
  461   1HZ   LYS   4          1HZ       LYS   4  10.738   6.181   0.632
  462   2HZ   LYS   4          2HZ       LYS   4   9.618   4.935   0.403
  463   3HZ   LYS   4          3HZ       LYS   4  10.783   4.809   1.620
  464    H    VAL   5           H        VAL   5   5.423   6.888   2.237
  465    HA   VAL   5           HA       VAL   5   3.731   6.797   4.618
  466    HB   VAL   5           HB       VAL   5   3.159   5.815   1.819
  467   1HG1  VAL   5          1HG1      VAL   5   1.257   6.214   4.124
  468   2HG1  VAL   5          2HG1      VAL   5   1.900   4.652   3.619
  469   3HG1  VAL   5          3HG1      VAL   5   0.872   5.576   2.526
  470   1HG2  VAL   5          1HG2      VAL   5   2.917   8.437   3.111
  471   2HG2  VAL   5          2HG2      VAL   5   1.478   7.897   2.247
  472   3HG2  VAL   5          3HG2      VAL   5   3.021   8.017   1.402
  473    H    ILE   6           H        ILE   6   4.054   5.211   5.989
  474    HA   ILE   6           HA       ILE   6   5.188   2.676   5.083
  475    HB   ILE   6           HB       ILE   6   4.736   3.760   7.866
  476   1HG1  ILE   6          2HG1      ILE   6   7.268   3.274   6.284
  477   2HG1  ILE   6          1HG1      ILE   6   6.544   4.848   6.596
  478   1HG2  ILE   6          1HG2      ILE   6   4.708   1.594   8.452
  479   2HG2  ILE   6          2HG2      ILE   6   6.449   1.680   8.175
  480   3HG2  ILE   6          3HG2      ILE   6   5.384   1.062   6.911
  481   1HD1  ILE   6          1HD1      ILE   6   6.896   4.493   9.007
  482   2HD1  ILE   6          2HD1      ILE   6   8.398   4.485   8.082
  483   3HD1  ILE   6          3HD1      ILE   6   7.697   2.965   8.639
  484    H    LEU   7           H        LEU   7   3.906   1.040   4.623
  485    HA   LEU   7           HA       LEU   7   1.175   0.995   5.694
  486   1HB   LEU   7          2HB       LEU   7   2.245  -0.864   3.589
  487   2HB   LEU   7          1HB       LEU   7   0.588  -0.357   3.865
  488    HG   LEU   7           HG       LEU   7   2.800   1.315   2.693
  489   1HD1  LEU   7          1HD1      LEU   7   1.352   1.320   0.707
  490   2HD1  LEU   7          2HD1      LEU   7   0.254   0.209   1.523
  491   3HD1  LEU   7          3HD1      LEU   7   1.897  -0.298   1.138
  492   1HD2  LEU   7          1HD2      LEU   7   1.106   3.060   2.429
  493   2HD2  LEU   7          2HD2      LEU   7   1.377   2.676   4.127
  494   3HD2  LEU   7          3HD2      LEU   7  -0.056   2.065   3.305
  495    H    ASN   8           H        ASN   8   1.768   0.281   7.790
  496    HA   ASN   8           HA       ASN   8   3.090  -2.299   8.029
  497   1HB   ASN   8          2HB       ASN   8   3.712  -0.349   9.466
  498   2HB   ASN   8          1HB       ASN   8   2.117  -0.438  10.203
  499   1HD2  ASN   8          1HD2      ASN   8   5.150  -1.066  10.830
  500   2HD2  ASN   8          2HD2      ASN   8   5.018  -2.491  11.799
  501    H    GLY   9           H        GLY   9   1.833  -4.045   7.785
  502   1HA   GLY   9          2HA       GLY   9  -0.796  -4.002   9.126
  503   2HA   GLY   9          1HA       GLY   9  -0.476  -4.898   7.650
  504    H    LYS  10           H        LYS  10  -1.466  -6.582   9.053
  505    HA   LYS  10           HA       LYS  10   0.195  -7.705  11.123
  506   1HB   LYS  10          2HB       LYS  10  -2.290  -8.833   9.816
  507   2HB   LYS  10          1HB       LYS  10  -1.569  -9.369  11.327
  508   1HG   LYS  10          2HG       LYS  10  -2.133  -7.309  12.406
  509   2HG   LYS  10          1HG       LYS  10  -2.664  -6.602  10.879
  510   1HD   LYS  10          2HD       LYS  10  -4.565  -7.311  12.249
  511   2HD   LYS  10          1HD       LYS  10  -4.476  -8.227  10.743
  512   1HE   LYS  10          2HE       LYS  10  -3.424 -10.079  11.922
  513   2HE   LYS  10          1HE       LYS  10  -3.474  -9.163  13.427
  514   1HZ   LYS  10          1HZ       LYS  10  -5.289 -10.762  13.275
  515   2HZ   LYS  10          2HZ       LYS  10  -5.847 -10.023  11.858
  516   3HZ   LYS  10          3HZ       LYS  10  -5.881  -9.176  13.323
  517    H    THR  11           H        THR  11  -1.087  -8.894   8.017
  518    HA   THR  11           HA       THR  11   1.089 -10.832   7.856
  519    HB   THR  11           HB       THR  11  -0.384 -11.584   5.843
  520    HG1  THR  11           1HG      THR  11  -1.691  -9.641   6.003
  521   1HG2  THR  11          1HG2      THR  11  -1.521 -11.905   8.607
  522   2HG2  THR  11          2HG2      THR  11  -0.197 -12.863   7.944
  523   3HG2  THR  11          3HG2      THR  11  -1.800 -12.952   7.215
  524    H    LEU  12           H        LEU  12   0.516  -7.744   6.937
  525    HA   LEU  12           HA       LEU  12   2.290  -8.005   4.629
  526   1HB   LEU  12          2HB       LEU  12   0.041  -7.781   3.747
  527   2HB   LEU  12          1HB       LEU  12  -0.230  -6.352   4.725
  528    HG   LEU  12           HG       LEU  12   1.326  -5.087   3.433
  529   1HD1  LEU  12          1HD1      LEU  12   3.111  -6.181   2.680
  530   2HD1  LEU  12          2HD1      LEU  12   2.104  -6.656   1.309
  531   3HD1  LEU  12          3HD1      LEU  12   2.270  -7.725   2.698
  532   1HD2  LEU  12          1HD2      LEU  12   0.078  -6.402   1.151
  533   2HD2  LEU  12          2HD2      LEU  12  -0.095  -4.750   1.744
  534   3HD2  LEU  12          3HD2      LEU  12  -1.046  -6.049   2.464
  535    H    LYS  13           H        LYS  13   3.854  -6.516   4.497
  536    HA   LYS  13           HA       LYS  13   3.704  -4.081   6.100
  537   1HB   LYS  13          2HB       LYS  13   5.974  -6.066   6.358
  538   2HB   LYS  13          1HB       LYS  13   5.915  -4.476   7.107
  539   1HG   LYS  13          2HG       LYS  13   3.969  -5.167   8.417
  540   2HG   LYS  13          1HG       LYS  13   4.043  -6.765   7.671
  541   1HD   LYS  13          2HD       LYS  13   6.276  -7.100   8.613
  542   2HD   LYS  13          1HD       LYS  13   6.204  -5.500   9.355
  543   1HE   LYS  13          2HE       LYS  13   5.675  -7.268  10.964
  544   2HE   LYS  13          1HE       LYS  13   4.304  -6.191  10.704
  545   1HZ   LYS  13          1HZ       LYS  13   4.198  -8.357   8.887
  546   2HZ   LYS  13          2HZ       LYS  13   3.075  -7.905  10.068
  547   3HZ   LYS  13          3HZ       LYS  13   4.346  -8.948  10.465
  548    H    GLY  14           H        GLY  14   4.999  -2.396   5.299
  549   1HA   GLY  14          2HA       GLY  14   7.071  -2.704   3.441
  550   2HA   GLY  14          1HA       GLY  14   5.577  -2.510   2.546
  551    H    GLU  15           H        GLU  15   6.757  -0.629   1.717
  552    HA   GLU  15           HA       GLU  15   5.997   1.729   3.228
  553   1HB   GLU  15          2HB       GLU  15   8.834   1.291   2.279
  554   2HB   GLU  15          1HB       GLU  15   8.206   2.792   2.945
  555   1HG   GLU  15          2HG       GLU  15   7.770   1.671   5.070
  556   2HG   GLU  15          1HG       GLU  15   8.399   0.165   4.402
  557    H    THR  16           H        THR  16   5.526   3.466   1.974
  558    HA   THR  16           HA       THR  16   6.084   3.343  -0.884
  559    HB   THR  16           HB       THR  16   3.948   2.459  -1.016
  560    HG1  THR  16           1HG      THR  16   3.376   5.204  -0.923
  561   1HG2  THR  16          1HG2      THR  16   3.370   3.998   1.447
  562   2HG2  THR  16          2HG2      THR  16   3.003   2.324   1.042
  563   3HG2  THR  16          3HG2      THR  16   2.039   3.630   0.353
  564    H    THR  17           H        THR  17   5.411   5.492  -1.977
  565    HA   THR  17           HA       THR  17   5.645   7.737  -0.107
  566    HB   THR  17           HB       THR  17   7.440   8.756  -1.401
  567    HG1  THR  17           1HG      THR  17   8.048   7.983  -3.252
  568   1HG2  THR  17          1HG2      THR  17   8.937   7.752  -0.147
  569   2HG2  THR  17          2HG2      THR  17   8.847   6.297  -1.138
  570   3HG2  THR  17          3HG2      THR  17   7.747   6.508   0.221
  571    H    THR  18           H        THR  18   4.273   9.259  -0.539
  572    HA   THR  18           HA       THR  18   3.191   9.568  -3.281
  573    HB   THR  18           HB       THR  18   1.530   8.921  -1.538
  574    HG1  THR  18           1HG      THR  18   0.971  10.285  -3.336
  575   1HG2  THR  18          1HG2      THR  18   2.438  11.456  -0.240
  576   2HG2  THR  18          2HG2      THR  18   2.203   9.862   0.473
  577   3HG2  THR  18          3HG2      THR  18   0.808  10.829  -0.003
  578    H    GLU  19           H        GLU  19   3.107  11.646  -4.167
  579    HA   GLU  19           HA       GLU  19   4.743  13.657  -2.766
  580   1HB   GLU  19          2HB       GLU  19   5.622  12.937  -4.939
  581   2HB   GLU  19          1HB       GLU  19   4.105  13.378  -5.711
  582   1HG   GLU  19          2HG       GLU  19   4.482  15.717  -5.121
  583   2HG   GLU  19          1HG       GLU  19   6.002  15.274  -4.345
  584    H    ALA  20           H        ALA  20   3.650  15.307  -1.856
  585    HA   ALA  20           HA       ALA  20   1.409  16.478  -3.297
  586   1HB   ALA  20          1HB       ALA  20  -0.211  15.680  -2.014
  587   2HB   ALA  20          2HB       ALA  20   0.617  16.227  -0.554
  588   3HB   ALA  20          3HB       ALA  20   0.979  14.640  -1.230
  589    H    VAL  21           H        VAL  21   0.851  18.545  -2.644
  590    HA   VAL  21           HA       VAL  21   2.873  20.294  -2.011
  591    HB   VAL  21           HB       VAL  21  -0.025  20.796  -1.341
  592   1HG1  VAL  21          1HG1      VAL  21   2.081  22.735  -2.275
  593   2HG1  VAL  21          2HG1      VAL  21   1.692  22.454  -0.578
  594   3HG1  VAL  21          3HG1      VAL  21   0.465  23.101  -1.668
  595   1HG2  VAL  21          1HG2      VAL  21   1.394  20.689  -3.969
  596   2HG2  VAL  21          2HG2      VAL  21   0.053  21.811  -3.737
  597   3HG2  VAL  21          3HG2      VAL  21  -0.200  20.078  -3.527
  598    H    ASP  22           H        ASP  22   0.861  18.489   0.185
  599    HA   ASP  22           HA       ASP  22   2.571  19.274   2.388
  600   1HB   ASP  22          2HB       ASP  22   0.572  19.853   3.848
  601   2HB   ASP  22          1HB       ASP  22   1.031  21.051   2.641
  602    H    ALA  23           H        ALA  23   1.828  18.140   4.480
  603    HA   ALA  23           HA       ALA  23   1.840  15.390   4.024
  604   1HB   ALA  23          1HB       ALA  23   2.399  15.396   6.172
  605   2HB   ALA  23          2HB       ALA  23   0.769  15.902   6.614
  606   3HB   ALA  23          3HB       ALA  23   2.003  17.112   6.260
  607    H    ALA  24           H        ALA  24  -0.834  17.563   4.805
  608    HA   ALA  24           HA       ALA  24  -2.798  15.551   5.091
  609   1HB   ALA  24          1HB       ALA  24  -2.873  18.497   4.578
  610   2HB   ALA  24          2HB       ALA  24  -3.509  17.577   5.942
  611   3HB   ALA  24          3HB       ALA  24  -4.349  17.550   4.391
  612    H    THR  25           H        THR  25  -2.061  17.687   2.307
  613    HA   THR  25           HA       THR  25  -3.792  16.533   0.489
  614    HB   THR  25           HB       THR  25  -2.106  17.280  -1.248
  615    HG1  THR  25           1HG      THR  25  -0.596  17.563   1.034
  616   1HG2  THR  25          1HG2      THR  25  -2.247  19.703  -0.684
  617   2HG2  THR  25          2HG2      THR  25  -2.989  19.235   0.845
  618   3HG2  THR  25          3HG2      THR  25  -3.786  18.844  -0.679
  619    H    ALA  26           H        ALA  26  -0.488  15.614   1.374
  620    HA   ALA  26           HA       ALA  26  -0.219  13.457  -0.413
  621   1HB   ALA  26          1HB       ALA  26   1.017  13.803   2.321
  622   2HB   ALA  26          2HB       ALA  26   1.683  14.411   0.804
  623   3HB   ALA  26          3HB       ALA  26   1.557  12.673   1.079
  624    H    GLU  27           H        GLU  27  -1.253  13.553   3.002
  625    HA   GLU  27           HA       GLU  27  -1.837  10.874   3.338
  626   1HB   GLU  27          2HB       GLU  27  -1.807  12.551   5.150
  627   2HB   GLU  27          1HB       GLU  27  -3.295  13.239   4.520
  628   1HG   GLU  27          2HG       GLU  27  -3.230  10.356   5.264
  629   2HG   GLU  27          1HG       GLU  27  -3.324  11.575   6.532
  630    H    LYS  28           H        LYS  28  -3.884  13.492   2.110
  631    HA   LYS  28           HA       LYS  28  -6.209  11.940   1.741
  632   1HB   LYS  28          2HB       LYS  28  -5.314  14.476   0.364
  633   2HB   LYS  28          1HB       LYS  28  -6.926  13.786   0.235
  634   1HG   LYS  28          2HG       LYS  28  -5.614  14.816   2.739
  635   2HG   LYS  28          1HG       LYS  28  -6.922  15.585   1.838
  636   1HD   LYS  28          2HD       LYS  28  -8.370  13.670   2.313
  637   2HD   LYS  28          1HD       LYS  28  -7.062  12.903   3.215
  638   1HE   LYS  28          2HE       LYS  28  -8.386  15.529   3.891
  639   2HE   LYS  28          1HE       LYS  28  -8.648  13.994   4.718
  640   1HZ   LYS  28          1HZ       LYS  28  -6.065  15.456   4.577
  641   2HZ   LYS  28          2HZ       LYS  28  -6.329  13.995   5.385
  642   3HZ   LYS  28          3HZ       LYS  28  -7.096  15.405   5.918
  643    H    VAL  29           H        VAL  29  -3.588  12.856  -0.469
  644    HA   VAL  29           HA       VAL  29  -4.600  11.660  -2.782
  645    HB   VAL  29           HB       VAL  29  -1.700  11.934  -1.961
  646   1HG1  VAL  29          1HG1      VAL  29  -2.208  12.086  -4.792
  647   2HG1  VAL  29          2HG1      VAL  29  -2.785  10.556  -4.135
  648   3HG1  VAL  29          3HG1      VAL  29  -1.104  11.037  -3.905
  649   1HG2  VAL  29          1HG2      VAL  29  -2.738  13.793  -3.950
  650   2HG2  VAL  29          2HG2      VAL  29  -1.780  14.100  -2.500
  651   3HG2  VAL  29          3HG2      VAL  29  -3.533  13.944  -2.384
  652    H    VAL  30           H        VAL  30  -2.721  10.332  -0.117
  653    HA   VAL  30           HA       VAL  30  -2.257   7.780  -1.219
  654    HB   VAL  30           HB       VAL  30  -2.657   8.404   1.711
  655   1HG1  VAL  30          1HG1      VAL  30  -1.540   6.424   2.178
  656   2HG1  VAL  30          2HG1      VAL  30  -0.819   6.337   0.571
  657   3HG1  VAL  30          3HG1      VAL  30  -2.533   5.987   0.787
  658   1HG2  VAL  30          1HG2      VAL  30  -0.764   9.537   0.001
  659   2HG2  VAL  30          2HG2      VAL  30   0.096   8.260   0.860
  660   3HG2  VAL  30          3HG2      VAL  30  -0.734   9.525   1.765
  661    H    LYS  31           H        LYS  31  -4.925   9.077   0.771
  662    HA   LYS  31           HA       LYS  31  -6.382   6.792   1.213
  663   1HB   LYS  31          2HB       LYS  31  -7.663   9.397   0.396
  664   2HB   LYS  31          1HB       LYS  31  -8.344   8.149   1.428
  665   1HG   LYS  31          2HG       LYS  31  -6.106  10.039   2.062
  666   2HG   LYS  31          1HG       LYS  31  -7.693   9.942   2.819
  667   1HD   LYS  31          2HD       LYS  31  -5.753   7.657   2.891
  668   2HD   LYS  31          1HD       LYS  31  -5.713   8.946   4.091
  669   1HE   LYS  31          2HE       LYS  31  -7.002   7.133   4.979
  670   2HE   LYS  31          1HE       LYS  31  -8.099   8.458   4.602
  671   1HZ   LYS  31          1HZ       LYS  31  -7.736   6.565   2.456
  672   2HZ   LYS  31          2HZ       LYS  31  -9.156   7.244   3.070
  673   3HZ   LYS  31          3HZ       LYS  31  -8.455   5.911   3.840
  674    H    GLN  32           H        GLN  32  -6.496   8.902  -1.613
  675    HA   GLN  32           HA       GLN  32  -8.408   7.475  -3.072
  676   1HB   GLN  32          2HB       GLN  32  -7.915   9.610  -3.885
  677   2HB   GLN  32          1HB       GLN  32  -6.184   9.344  -3.847
  678   1HG   GLN  32          2HG       GLN  32  -7.982   7.855  -5.730
  679   2HG   GLN  32          1HG       GLN  32  -7.347   9.450  -6.114
  680   1HE2  GLN  32          1HE2      GLN  32  -4.913   8.232  -4.366
  681   2HE2  GLN  32          2HE2      GLN  32  -4.007   7.445  -5.602
  682    H    PHE  33           H        PHE  33  -4.952   7.030  -2.703
  683    HA   PHE  33           HA       PHE  33  -4.436   5.183  -4.706
  684   1HB   PHE  33          2HB       PHE  33  -2.775   6.288  -3.141
  685   2HB   PHE  33          1HB       PHE  33  -3.249   5.111  -1.922
  686    HD1  PHE  33           1HD      PHE  33  -2.051   5.257  -5.444
  687    HD2  PHE  33           2HD      PHE  33  -2.021   3.185  -1.721
  688    HE1  PHE  33           1HE      PHE  33  -0.414   3.649  -6.339
  689    HE2  PHE  33           2HE      PHE  33  -0.379   1.589  -2.618
  690    HZ   PHE  33           HZ       PHE  33   0.422   1.828  -4.936
  691    H    PHE  34           H        PHE  34  -5.006   4.407  -1.303
  692    HA   PHE  34           HA       PHE  34  -5.541   1.656  -1.770
  693   1HB   PHE  34          2HB       PHE  34  -6.200   3.360   0.635
  694   2HB   PHE  34          1HB       PHE  34  -6.230   1.595   0.589
  695    HD1  PHE  34           1HD      PHE  34  -3.881   0.920  -0.925
  696    HD2  PHE  34           2HD      PHE  34  -4.416   3.961   1.998
  697    HE1  PHE  34           1HE      PHE  34  -1.473   0.878  -0.451
  698    HE2  PHE  34           2HE      PHE  34  -2.005   3.918   2.484
  699    HZ   PHE  34           HZ       PHE  34  -0.539   2.376   1.245
  700    H    ASN  35           H        ASN  35  -7.592   4.481  -1.394
  701    HA   ASN  35           HA       ASN  35 -10.096   3.326  -1.208
  702   1HB   ASN  35          2HB       ASN  35  -9.661   5.754  -1.106
  703   2HB   ASN  35          1HB       ASN  35  -9.294   5.757  -2.827
  704   1HD2  ASN  35          1HD2      ASN  35 -11.481   6.748  -0.823
  705   2HD2  ASN  35          2HD2      ASN  35 -12.934   6.505  -1.725
  706    H    ASP  36           H        ASP  36  -8.036   3.829  -3.975
  707    HA   ASP  36           HA       ASP  36  -9.968   2.611  -5.793
  708   1HB   ASP  36          2HB       ASP  36  -7.303   3.939  -6.307
  709   2HB   ASP  36          1HB       ASP  36  -8.312   3.230  -7.565
  710    H    ASN  37           H        ASN  37  -7.073   1.744  -4.073
  711    HA   ASN  37           HA       ASN  37  -6.478  -0.486  -5.831
  712   1HB   ASN  37          2HB       ASN  37  -5.334   0.252  -3.128
  713   2HB   ASN  37          1HB       ASN  37  -4.764  -1.080  -4.126
  714   1HD2  ASN  37          1HD2      ASN  37  -3.609   1.562  -3.126
  715   2HD2  ASN  37          2HD2      ASN  37  -2.911   2.252  -4.550
  716    H    GLY  38           H        GLY  38  -7.709   0.001  -2.565
  717   1HA   GLY  38          2HA       GLY  38  -8.120  -2.059  -1.198
  718   2HA   GLY  38          1HA       GLY  38  -9.572  -1.233  -1.718
  719    H    VAL  39           H        VAL  39 -11.075  -2.414  -2.645
  720    HA   VAL  39           HA       VAL  39 -10.380  -5.147  -3.472
  721    HB   VAL  39           HB       VAL  39 -13.074  -4.023  -2.778
  722   1HG1  VAL  39          1HG1      VAL  39 -12.093  -6.672  -3.609
  723   2HG1  VAL  39          2HG1      VAL  39 -13.690  -5.946  -3.787
  724   3HG1  VAL  39          3HG1      VAL  39 -13.218  -6.671  -2.252
  725   1HG2  VAL  39          1HG2      VAL  39 -11.578  -3.847  -0.861
  726   2HG2  VAL  39          2HG2      VAL  39 -11.151  -5.551  -1.026
  727   3HG2  VAL  39          3HG2      VAL  39 -12.797  -5.094  -0.589
  728    H    ASP  40           H        ASP  40 -10.892  -2.304  -5.111
  729    HA   ASP  40           HA       ASP  40 -12.232  -3.752  -7.286
  730   1HB   ASP  40          2HB       ASP  40 -12.577  -0.836  -6.558
  731   2HB   ASP  40          1HB       ASP  40 -13.273  -1.619  -7.973
  732    H    GLY  41           H        GLY  41  -9.319  -2.798  -6.453
  733   1HA   GLY  41          2HA       GLY  41  -8.587  -1.166  -8.717
  734   2HA   GLY  41          1HA       GLY  41  -7.495  -1.826  -7.511
  735    H    GLU  42           H        GLU  42  -6.588  -1.831  -9.995
  736    HA   GLU  42           HA       GLU  42  -7.069  -4.511 -11.103
  737   1HB   GLU  42          2HB       GLU  42  -5.673  -2.123 -12.331
  738   2HB   GLU  42          1HB       GLU  42  -5.927  -3.672 -13.124
  739   1HG   GLU  42          2HG       GLU  42  -8.103  -1.814 -12.188
  740   2HG   GLU  42          1HG       GLU  42  -7.530  -1.970 -13.848
  741    H    TRP  43           H        TRP  43  -5.736  -5.990 -10.273
  742    HA   TRP  43           HA       TRP  43  -2.988  -5.211  -9.603
  743   1HB   TRP  43          2HB       TRP  43  -4.551  -7.664  -8.786
  744   2HB   TRP  43          1HB       TRP  43  -2.946  -7.225  -8.219
  745    HD1  TRP  43           HD       TRP  43  -5.953  -4.790  -8.411
  746    HE1  TRP  43           1HE      TRP  43  -6.458  -3.981  -6.022
  747    HE3  TRP  43           3HE      TRP  43  -2.633  -7.707  -5.848
  748    HZ2  TRP  43           2HZ      TRP  43  -5.570  -4.510  -3.403
  749    HZ3  TRP  43           3HZ      TRP  43  -2.523  -7.498  -3.403
  750    HH2  TRP  43           HH       TRP  43  -3.963  -5.927  -2.204
  751    H    THR  44           H        THR  44  -1.360  -5.847 -10.849
  752    HA   THR  44           HA       THR  44  -1.768  -8.141 -12.650
  753    HB   THR  44           HB       THR  44   0.111  -7.173 -13.981
  754    HG1  THR  44           1HG      THR  44  -0.207  -4.921 -12.295
  755   1HG2  THR  44          1HG2      THR  44  -1.245  -5.902 -15.216
  756   2HG2  THR  44          2HG2      THR  44  -1.674  -4.861 -13.859
  757   3HG2  THR  44          3HG2      THR  44  -2.487  -6.410 -14.072
  758    H    TYR  45           H        TYR  45  -0.337  -9.853 -12.566
  759    HA   TYR  45           HA       TYR  45   1.614  -9.740 -10.363
  760   1HB   TYR  45          2HB       TYR  45  -0.195 -11.353 -10.029
  761   2HB   TYR  45          1HB       TYR  45   0.208 -12.134 -11.554
  762    HD1  TYR  45           1HD      TYR  45   2.379 -10.954  -8.756
  763    HD2  TYR  45           2HD      TYR  45   0.995 -14.254 -11.057
  764    HE1  TYR  45           1HE      TYR  45   3.953 -12.429  -7.576
  765    HE2  TYR  45           2HE      TYR  45   2.564 -15.738  -9.882
  766    HH   TYR  45           HH       TYR  45   4.650 -15.595  -8.629
  767    H    ASP  46           H        ASP  46   3.675 -10.500 -10.599
  768    HA   ASP  46           HA       ASP  46   4.530 -11.192 -13.331
  769   1HB   ASP  46          2HB       ASP  46   5.249  -8.911 -12.762
  770   2HB   ASP  46          1HB       ASP  46   6.030  -9.513 -11.303
  771    H    ASP  47           H        ASP  47   4.295 -13.408 -12.698
  772    HA   ASP  47           HA       ASP  47   5.347 -14.704 -10.535
  773   1HB   ASP  47          2HB       ASP  47   5.298 -15.704 -13.388
  774   2HB   ASP  47          1HB       ASP  47   5.485 -16.716 -11.960
  775    H    ALA  48           H        ALA  48   7.081 -13.637 -13.411
  776    HA   ALA  48           HA       ALA  48   9.444 -15.000 -13.199
  777   1HB   ALA  48          1HB       ALA  48   8.949 -12.157 -14.036
  778   2HB   ALA  48          2HB       ALA  48   9.099 -13.584 -15.061
  779   3HB   ALA  48          3HB       ALA  48  10.511 -12.956 -14.210
  780    H    THR  49           H        THR  49   8.349 -12.339 -11.195
  781    HA   THR  49           HA       THR  49  10.777 -12.680  -9.562
  782    HB   THR  49           HB       THR  49  10.683 -10.270  -9.017
  783    HG1  THR  49           1HG      THR  49   9.119  -9.058  -9.716
  784   1HG2  THR  49          1HG2      THR  49  12.222 -10.214 -10.619
  785   2HG2  THR  49          2HG2      THR  49  10.937  -9.581 -11.648
  786   3HG2  THR  49          3HG2      THR  49  11.309 -11.305 -11.660
  787    H    LYS  50           H        LYS  50   7.777 -13.544  -9.503
  788    HA   LYS  50           HA       LYS  50   6.104 -13.791  -7.955
  789   1HB   LYS  50          2HB       LYS  50   8.502 -13.667  -6.123
  790   2HB   LYS  50          1HB       LYS  50   6.900 -14.206  -5.636
  791   1HG   LYS  50          2HG       LYS  50   7.423 -15.743  -7.855
  792   2HG   LYS  50          1HG       LYS  50   8.995 -15.627  -7.059
  793   1HD   LYS  50          2HD       LYS  50   6.414 -16.491  -5.762
  794   2HD   LYS  50          1HD       LYS  50   7.725 -17.563  -6.263
  795   1HE   LYS  50          2HE       LYS  50   7.911 -15.380  -4.188
  796   2HE   LYS  50          1HE       LYS  50   7.808 -17.109  -3.861
  797   1HZ   LYS  50          1HZ       LYS  50  10.091 -15.573  -4.376
  798   2HZ   LYS  50          2HZ       LYS  50   9.926 -16.688  -5.636
  799   3HZ   LYS  50          3HZ       LYS  50   9.997 -17.227  -4.035
  800    H    THR  51           H        THR  51   6.616 -11.101  -8.792
  801    HA   THR  51           HA       THR  51   5.900  -9.615  -6.354
  802    HB   THR  51           HB       THR  51   7.298  -8.624  -8.844
  803    HG1  THR  51           1HG      THR  51   9.022  -8.301  -7.348
  804   1HG2  THR  51          1HG2      THR  51   5.762  -7.109  -7.114
  805   2HG2  THR  51          2HG2      THR  51   6.995  -6.522  -8.230
  806   3HG2  THR  51          3HG2      THR  51   7.418  -6.877  -6.555
  807    H    PHE  52           H        PHE  52   4.136  -8.316  -6.358
  808    HA   PHE  52           HA       PHE  52   2.402  -8.454  -8.737
  809   1HB   PHE  52          2HB       PHE  52   1.618  -7.890  -5.867
  810   2HB   PHE  52          1HB       PHE  52   0.521  -8.100  -7.225
  811    HD1  PHE  52           1HD      PHE  52  -0.541 -10.120  -7.379
  812    HD2  PHE  52           2HD      PHE  52   3.314  -9.961  -5.582
  813    HE1  PHE  52           1HE      PHE  52  -0.671 -12.528  -6.888
  814    HE2  PHE  52           2HE      PHE  52   3.187 -12.368  -5.093
  815    HZ   PHE  52           HZ       PHE  52   1.193 -13.652  -5.747
  816    H    THR  53           H        THR  53   1.551  -6.565  -9.600
  817    HA   THR  53           HA       THR  53   2.510  -4.068  -8.371
  818    HB   THR  53           HB       THR  53   2.278  -3.183 -10.810
  819    HG1  THR  53           1HG      THR  53   2.048  -4.613 -12.306
  820   1HG2  THR  53          1HG2      THR  53   4.489  -4.608  -9.530
  821   2HG2  THR  53          2HG2      THR  53   4.441  -3.016 -10.295
  822   3HG2  THR  53          3HG2      THR  53   4.603  -4.470 -11.286
  823    H    VAL  54           H        VAL  54   1.028  -2.746  -7.688
  824    HA   VAL  54           HA       VAL  54  -1.738  -3.068  -8.632
  825    HB   VAL  54           HB       VAL  54  -0.737  -1.653  -6.147
  826   1HG1  VAL  54          1HG1      VAL  54  -3.114  -1.264  -7.468
  827   2HG1  VAL  54          2HG1      VAL  54  -2.819  -0.938  -5.760
  828   3HG1  VAL  54          3HG1      VAL  54  -3.535  -2.472  -6.254
  829   1HG2  VAL  54          1HG2      VAL  54  -2.383  -4.055  -5.845
  830   2HG2  VAL  54          2HG2      VAL  54  -0.925  -3.563  -4.987
  831   3HG2  VAL  54          3HG2      VAL  54  -0.797  -4.352  -6.558
  832    H    THR  55           H        THR  55  -2.126  -1.742 -10.305
  833    HA   THR  55           HA       THR  55  -0.950   0.947 -10.252
  834    HB   THR  55           HB       THR  55  -2.280  -0.455 -12.569
  835    HG1  THR  55           1HG      THR  55  -0.495  -1.587 -12.466
  836   1HG2  THR  55          1HG2      THR  55  -0.982   1.161 -13.919
  837   2HG2  THR  55          2HG2      THR  55  -0.549   1.998 -12.427
  838   3HG2  THR  55          3HG2      THR  55  -2.237   1.908 -12.930
  839    H    GLU  56           H        GLU  56  -2.174   2.573  -9.562
  840    HA   GLU  56           HA       GLU  56  -5.028   2.234  -9.328
  841   1HB   GLU  56          2HB       GLU  56  -5.069   4.341  -8.220
  842   2HB   GLU  56          1HB       GLU  56  -3.634   3.494  -7.659
  843   1HG   GLU  56          2HG       GLU  56  -2.245   4.837  -9.112
  844   2HG   GLU  56          1HG       GLU  56  -3.668   5.637  -9.771
  Start of MODEL   33
    1   1H    MET   1          1HT       MET   1   4.980 -18.989   1.414
    2   2H    MET   1          2HT       MET   1   5.503 -18.305   2.870
    3   3H    MET   1          3HT       MET   1   6.201 -19.742   2.314
    4    HA   MET   1           HA       MET   1   7.798 -18.229   1.736
    5   1HB   MET   1          2HB       MET   1   7.008 -19.586  -0.182
    6   2HB   MET   1          1HB       MET   1   5.900 -18.298  -0.620
    7   1HG   MET   1          2HG       MET   1   7.614 -16.882  -1.302
    8   2HG   MET   1          1HG       MET   1   8.844 -17.796  -0.427
    9   1HE   MET   1          1HE       MET   1   6.279 -17.811  -3.268
   10   2HE   MET   1          2HE       MET   1   6.046 -19.500  -2.815
   11   3HE   MET   1          3HE       MET   1   6.817 -19.096  -4.349
   12    H    GLN   2           H        GLN   2   8.371 -16.111   0.696
   13    HA   GLN   2           HA       GLN   2   6.437 -14.065   1.546
   14   1HB   GLN   2          2HB       GLN   2   8.531 -14.013   2.790
   15   2HB   GLN   2          1HB       GLN   2   9.450 -13.910   1.299
   16   1HG   GLN   2          2HG       GLN   2   7.441 -11.828   2.092
   17   2HG   GLN   2          1HG       GLN   2   9.113 -11.775   2.634
   18   1HE2  GLN   2          1HE2      GLN   2   9.638 -13.068  -0.205
   19   2HE2  GLN   2          2HE2      GLN   2   9.715 -11.674  -1.214
   20    H    TYR   3           H        TYR   3   5.948 -12.336   0.213
   21    HA   TYR   3           HA       TYR   3   6.998 -12.470  -2.533
   22   1HB   TYR   3          2HB       TYR   3   4.113 -12.025  -1.731
   23   2HB   TYR   3          1HB       TYR   3   4.738 -11.925  -3.373
   24    HD1  TYR   3           1HD      TYR   3   4.314 -13.753  -4.703
   25    HD2  TYR   3           2HD      TYR   3   4.859 -14.361  -0.526
   26    HE1  TYR   3           1HE      TYR   3   3.906 -16.159  -5.004
   27    HE2  TYR   3           2HE      TYR   3   4.461 -16.771  -0.818
   28    HH   TYR   3           HH       TYR   3   4.401 -18.450  -2.421
   29    H    LYS   4           H        LYS   4   7.155 -10.504  -3.639
   30    HA   LYS   4           HA       LYS   4   7.091  -8.148  -1.881
   31   1HB   LYS   4          2HB       LYS   4   9.275  -8.683  -2.870
   32   2HB   LYS   4          1HB       LYS   4   8.571  -8.592  -4.477
   33   1HG   LYS   4          2HG       LYS   4   8.135  -6.238  -4.204
   34   2HG   LYS   4          1HG       LYS   4   8.702  -6.297  -2.536
   35   1HD   LYS   4          2HD       LYS   4  10.442  -5.375  -3.915
   36   2HD   LYS   4          1HD       LYS   4  10.937  -6.979  -3.373
   37   1HE   LYS   4          2HE       LYS   4   9.657  -6.455  -6.048
   38   2HE   LYS   4          1HE       LYS   4  11.400  -6.442  -5.793
   39   1HZ   LYS   4          1HZ       LYS   4  10.569  -8.797  -4.685
   40   2HZ   LYS   4          2HZ       LYS   4  11.317  -8.611  -6.188
   41   3HZ   LYS   4          3HZ       LYS   4   9.631  -8.662  -6.087
   42    H    VAL   5           H        VAL   5   5.245  -7.050  -2.077
   43    HA   VAL   5           HA       VAL   5   3.902  -6.940  -4.666
   44    HB   VAL   5           HB       VAL   5   2.965  -5.924  -1.978
   45   1HG1  VAL   5          1HG1      VAL   5   1.464  -6.280  -4.572
   46   2HG1  VAL   5          2HG1      VAL   5   1.929  -4.740  -3.844
   47   3HG1  VAL   5          3HG1      VAL   5   0.763  -5.785  -3.031
   48   1HG2  VAL   5          1HG2      VAL   5   2.797  -8.138  -1.576
   49   2HG2  VAL   5          2HG2      VAL   5   2.838  -8.561  -3.288
   50   3HG2  VAL   5          3HG2      VAL   5   1.337  -7.991  -2.556
   51    H    ILE   6           H        ILE   6   3.870  -5.206  -5.928
   52    HA   ILE   6           HA       ILE   6   5.155  -2.753  -4.951
   53    HB   ILE   6           HB       ILE   6   4.810  -3.839  -7.745
   54   1HG1  ILE   6          2HG1      ILE   6   7.275  -3.148  -6.134
   55   2HG1  ILE   6          1HG1      ILE   6   6.649  -4.772  -6.383
   56   1HG2  ILE   6          1HG2      ILE   6   5.284  -1.084  -6.838
   57   2HG2  ILE   6          2HG2      ILE   6   4.648  -1.687  -8.370
   58   3HG2  ILE   6          3HG2      ILE   6   6.389  -1.670  -8.083
   59   1HD1  ILE   6          1HD1      ILE   6   8.448  -4.474  -7.886
   60   2HD1  ILE   6          2HD1      ILE   6   7.821  -2.919  -8.431
   61   3HD1  ILE   6          3HD1      ILE   6   6.968  -4.406  -8.843
   62    H    LEU   7           H        LEU   7   3.910  -1.072  -4.544
   63    HA   LEU   7           HA       LEU   7   1.185  -1.013  -5.625
   64   1HB   LEU   7          2HB       LEU   7   2.259   0.833  -3.512
   65   2HB   LEU   7          1HB       LEU   7   0.598   0.343  -3.798
   66    HG   LEU   7           HG       LEU   7   2.798  -1.330  -2.600
   67   1HD1  LEU   7          1HD1      LEU   7   1.781   0.310  -1.097
   68   2HD1  LEU   7          2HD1      LEU   7   1.379  -1.342  -0.631
   69   3HD1  LEU   7          3HD1      LEU   7   0.186  -0.347  -1.465
   70   1HD2  LEU   7          1HD2      LEU   7  -0.035  -2.126  -3.261
   71   2HD2  LEU   7          2HD2      LEU   7   1.154  -3.112  -2.408
   72   3HD2  LEU   7          3HD2      LEU   7   1.413  -2.683  -4.097
   73    H    ASN   8           H        ASN   8   1.560  -0.214  -7.689
   74    HA   ASN   8           HA       ASN   8   2.975   2.332  -7.951
   75   1HB   ASN   8          2HB       ASN   8   3.552   0.382  -9.409
   76   2HB   ASN   8          1HB       ASN   8   1.944   0.494 -10.115
   77   1HD2  ASN   8          1HD2      ASN   8   4.968   1.092 -10.796
   78   2HD2  ASN   8          2HD2      ASN   8   4.835   2.527 -11.751
   79    H    GLY   9           H        GLY   9   1.700   4.077  -7.645
   80   1HA   GLY   9          2HA       GLY   9  -0.952   4.031  -8.936
   81   2HA   GLY   9          1HA       GLY   9  -0.594   4.939  -7.474
   82    H    LYS  10           H        LYS  10  -1.625   6.634  -8.885
   83    HA   LYS  10           HA       LYS  10  -0.102   7.671 -11.067
   84   1HB   LYS  10          2HB       LYS  10  -2.349   8.914  -9.479
   85   2HB   LYS  10          1HB       LYS  10  -1.693   9.567 -10.973
   86   1HG   LYS  10          2HG       LYS  10  -2.362   7.463 -12.114
   87   2HG   LYS  10          1HG       LYS  10  -3.149   6.958 -10.619
   88   1HD   LYS  10          2HD       LYS  10  -3.808   9.467 -12.161
   89   2HD   LYS  10          1HD       LYS  10  -4.714   7.959 -12.255
   90   1HE   LYS  10          2HE       LYS  10  -5.894   9.357 -10.756
   91   2HE   LYS  10          1HE       LYS  10  -5.072   8.151  -9.769
   92   1HZ   LYS  10          1HZ       LYS  10  -3.924   9.724  -8.724
   93   2HZ   LYS  10          2HZ       LYS  10  -4.965  10.854  -9.431
   94   3HZ   LYS  10          3HZ       LYS  10  -3.484  10.496 -10.165
   95    H    THR  11           H        THR  11  -0.776   8.919  -7.781
   96    HA   THR  11           HA       THR  11   1.601  10.618  -8.015
   97    HB   THR  11           HB       THR  11   0.433  11.783  -6.024
   98    HG1  THR  11           1HG      THR  11  -1.881  11.491  -6.160
   99   1HG2  THR  11          1HG2      THR  11   0.530  12.899  -8.144
  100   2HG2  THR  11          2HG2      THR  11  -1.097  13.055  -7.483
  101   3HG2  THR  11          3HG2      THR  11  -0.777  11.895  -8.771
  102    H    LEU  12           H        LEU  12   0.988   7.692  -6.951
  103    HA   LEU  12           HA       LEU  12   2.748   7.998  -4.639
  104   1HB   LEU  12          2HB       LEU  12   0.503   7.877  -3.741
  105   2HB   LEU  12          1HB       LEU  12   0.179   6.427  -4.670
  106    HG   LEU  12           HG       LEU  12   1.749   5.164  -3.346
  107   1HD1  LEU  12          1HD1      LEU  12   3.499   6.233  -2.502
  108   2HD1  LEU  12          2HD1      LEU  12   2.432   6.844  -1.235
  109   3HD1  LEU  12          3HD1      LEU  12   2.712   7.794  -2.691
  110   1HD2  LEU  12          1HD2      LEU  12   0.205   4.829  -1.783
  111   2HD2  LEU  12          2HD2      LEU  12  -0.635   6.254  -2.396
  112   3HD2  LEU  12          3HD2      LEU  12   0.507   6.408  -1.059
  113    H    LYS  13           H        LYS  13   4.226   6.430  -4.375
  114    HA   LYS  13           HA       LYS  13   4.032   3.963  -5.916
  115   1HB   LYS  13          2HB       LYS  13   6.482   5.724  -6.081
  116   2HB   LYS  13          1HB       LYS  13   6.219   4.201  -6.914
  117   1HG   LYS  13          2HG       LYS  13   5.789   5.685  -8.594
  118   2HG   LYS  13          1HG       LYS  13   4.169   5.455  -7.936
  119   1HD   LYS  13          2HD       LYS  13   4.541   7.805  -8.302
  120   2HD   LYS  13          1HD       LYS  13   4.483   7.501  -6.568
  121   1HE   LYS  13          2HE       LYS  13   6.289   9.041  -7.147
  122   2HE   LYS  13          1HE       LYS  13   6.915   7.543  -6.461
  123   1HZ   LYS  13          1HZ       LYS  13   7.761   8.672  -8.760
  124   2HZ   LYS  13          2HZ       LYS  13   6.681   7.501  -9.331
  125   3HZ   LYS  13          3HZ       LYS  13   7.977   7.044  -8.344
  126    H    GLY  14           H        GLY  14   5.186   2.246  -5.012
  127   1HA   GLY  14          2HA       GLY  14   7.163   2.555  -3.016
  128   2HA   GLY  14          1HA       GLY  14   5.601   2.313  -2.253
  129    H    GLU  15           H        GLU  15   6.990   0.454  -1.452
  130    HA   GLU  15           HA       GLU  15   6.299  -1.889  -3.044
  131   1HB   GLU  15          2HB       GLU  15   9.062  -1.406  -1.914
  132   2HB   GLU  15          1HB       GLU  15   8.516  -2.906  -2.650
  133   1HG   GLU  15          2HG       GLU  15   8.180  -1.744  -4.773
  134   2HG   GLU  15          1HG       GLU  15   8.733  -0.242  -4.035
  135    H    THR  16           H        THR  16   5.639  -3.583  -1.854
  136    HA   THR  16           HA       THR  16   6.060  -3.508   1.041
  137    HB   THR  16           HB       THR  16   3.917  -2.636   1.006
  138    HG1  THR  16           1HG      THR  16   3.375  -5.392   0.892
  139   1HG2  THR  16          1HG2      THR  16   2.135  -3.898  -0.493
  140   2HG2  THR  16          2HG2      THR  16   3.562  -4.162  -1.495
  141   3HG2  THR  16          3HG2      THR  16   3.068  -2.521  -1.082
  142    H    THR  17           H        THR  17   5.382  -5.637   2.088
  143    HA   THR  17           HA       THR  17   5.671  -7.913   0.273
  144    HB   THR  17           HB       THR  17   7.425  -8.892   1.752
  145    HG1  THR  17           1HG      THR  17   8.500  -7.485   3.157
  146   1HG2  THR  17          1HG2      THR  17   8.240  -7.955  -0.255
  147   2HG2  THR  17          2HG2      THR  17   9.287  -7.373   1.040
  148   3HG2  THR  17          3HG2      THR  17   8.055  -6.311   0.356
  149    H    THR  18           H        THR  18   4.173  -9.340   0.708
  150    HA   THR  18           HA       THR  18   3.129  -9.612   3.466
  151    HB   THR  18           HB       THR  18   1.478  -8.983   1.704
  152    HG1  THR  18           1HG      THR  18   0.898 -10.295   3.531
  153   1HG2  THR  18          1HG2      THR  18   2.468 -10.179  -0.198
  154   2HG2  THR  18          2HG2      THR  18   0.767 -10.574   0.046
  155   3HG2  THR  18          3HG2      THR  18   2.017 -11.708   0.555
  156    H    GLU  19           H        GLU  19   3.020 -11.685   4.382
  157    HA   GLU  19           HA       GLU  19   4.612 -13.728   2.979
  158   1HB   GLU  19          2HB       GLU  19   5.585 -13.013   5.097
  159   2HB   GLU  19          1HB       GLU  19   4.083 -13.373   5.936
  160   1HG   GLU  19          2HG       GLU  19   4.349 -15.739   5.402
  161   2HG   GLU  19          1HG       GLU  19   5.853 -15.378   4.555
  162    H    ALA  20           H        ALA  20   3.418 -15.273   2.051
  163    HA   ALA  20           HA       ALA  20   1.213 -16.435   3.566
  164   1HB   ALA  20          1HB       ALA  20  -0.330 -15.383   2.365
  165   2HB   ALA  20          2HB       ALA  20   0.207 -16.328   0.976
  166   3HB   ALA  20          3HB       ALA  20   0.883 -14.727   1.268
  167    H    VAL  21           H        VAL  21   0.607 -18.498   2.926
  168    HA   VAL  21           HA       VAL  21   2.598 -20.281   2.302
  169    HB   VAL  21           HB       VAL  21  -0.315 -20.732   1.657
  170   1HG1  VAL  21          1HG1      VAL  21   0.184 -22.880   1.350
  171   2HG1  VAL  21          2HG1      VAL  21   1.193 -22.935   2.795
  172   3HG1  VAL  21          3HG1      VAL  21   1.870 -22.373   1.268
  173   1HG2  VAL  21          1HG2      VAL  21  -0.294 -21.715   4.033
  174   2HG2  VAL  21          2HG2      VAL  21  -0.385 -19.962   3.851
  175   3HG2  VAL  21          3HG2      VAL  21   1.148 -20.727   4.272
  176    H    ASP  22           H        ASP  22   0.671 -18.412   0.090
  177    HA   ASP  22           HA       ASP  22   2.348 -19.247  -2.099
  178   1HB   ASP  22          2HB       ASP  22   0.479 -19.977  -3.565
  179   2HB   ASP  22          1HB       ASP  22   0.756 -21.057  -2.204
  180    H    ALA  23           H        ALA  23   1.547 -18.184  -4.218
  181    HA   ALA  23           HA       ALA  23   1.540 -15.423  -3.843
  182   1HB   ALA  23          1HB       ALA  23   0.386 -16.214  -6.387
  183   2HB   ALA  23          2HB       ALA  23   1.838 -17.133  -5.990
  184   3HB   ALA  23          3HB       ALA  23   1.896 -15.372  -6.044
  185    H    ALA  24           H        ALA  24  -1.130 -17.643  -4.499
  186    HA   ALA  24           HA       ALA  24  -3.117 -15.659  -4.802
  187   1HB   ALA  24          1HB       ALA  24  -4.554 -17.385  -5.062
  188   2HB   ALA  24          2HB       ALA  24  -3.975 -18.222  -3.622
  189   3HB   ALA  24          3HB       ALA  24  -3.079 -18.349  -5.137
  190    H    THR  25           H        THR  25  -2.263 -17.675  -1.962
  191    HA   THR  25           HA       THR  25  -4.011 -16.460  -0.176
  192    HB   THR  25           HB       THR  25  -2.251 -17.155   1.564
  193    HG1  THR  25           1HG      THR  25  -0.970 -18.902   0.171
  194   1HG2  THR  25          1HG2      THR  25  -2.702 -19.536   1.318
  195   2HG2  THR  25          2HG2      THR  25  -3.323 -19.249  -0.307
  196   3HG2  THR  25          3HG2      THR  25  -4.159 -18.570   1.090
  197    H    ALA  26           H        ALA  26  -0.716 -15.619  -1.134
  198    HA   ALA  26           HA       ALA  26  -0.379 -13.419   0.586
  199   1HB   ALA  26          1HB       ALA  26   1.635 -13.842  -0.347
  200   2HB   ALA  26          2HB       ALA  26   1.090 -12.707  -1.581
  201   3HB   ALA  26          3HB       ALA  26   0.928 -14.444  -1.846
  202    H    GLU  27           H        GLU  27  -1.470 -13.585  -2.813
  203    HA   GLU  27           HA       GLU  27  -2.010 -10.937  -3.271
  204   1HB   GLU  27          2HB       GLU  27  -2.166 -12.669  -4.991
  205   2HB   GLU  27          1HB       GLU  27  -3.595 -13.327  -4.210
  206   1HG   GLU  27          2HG       GLU  27  -4.798 -11.250  -4.656
  207   2HG   GLU  27          1HG       GLU  27  -3.364 -10.591  -5.440
  208    H    LYS  28           H        LYS  28  -4.137 -13.381  -1.836
  209    HA   LYS  28           HA       LYS  28  -6.351 -11.691  -1.419
  210   1HB   LYS  28          2HB       LYS  28  -5.495 -14.189   0.056
  211   2HB   LYS  28          1HB       LYS  28  -7.068 -13.419   0.227
  212   1HG   LYS  28          2HG       LYS  28  -5.938 -14.620  -2.291
  213   2HG   LYS  28          1HG       LYS  28  -7.205 -15.310  -1.272
  214   1HD   LYS  28          2HD       LYS  28  -7.383 -12.666  -2.716
  215   2HD   LYS  28          1HD       LYS  28  -8.103 -14.181  -3.274
  216   1HE   LYS  28          2HE       LYS  28  -8.744 -12.751  -0.696
  217   2HE   LYS  28          1HE       LYS  28  -9.750 -12.775  -2.142
  218   1HZ   LYS  28          1HZ       LYS  28  -9.074 -15.069  -0.389
  219   2HZ   LYS  28          2HZ       LYS  28  -9.838 -15.237  -1.890
  220   3HZ   LYS  28          3HZ       LYS  28 -10.600 -14.382  -0.644
  221    H    VAL  29           H        VAL  29  -3.639 -12.614   0.667
  222    HA   VAL  29           HA       VAL  29  -4.381 -11.296   2.990
  223    HB   VAL  29           HB       VAL  29  -1.602 -11.641   1.841
  224   1HG1  VAL  29          1HG1      VAL  29  -2.570 -10.543   4.421
  225   2HG1  VAL  29          2HG1      VAL  29  -1.150 -10.114   3.466
  226   3HG1  VAL  29          3HG1      VAL  29  -1.141 -11.577   4.451
  227   1HG2  VAL  29          1HG2      VAL  29  -3.372 -13.580   2.649
  228   2HG2  VAL  29          2HG2      VAL  29  -2.398 -13.313   4.094
  229   3HG2  VAL  29          3HG2      VAL  29  -1.618 -13.752   2.575
  230    H    VAL  30           H        VAL  30  -2.695 -10.075   0.141
  231    HA   VAL  30           HA       VAL  30  -2.250  -7.459   1.119
  232    HB   VAL  30           HB       VAL  30  -2.627  -8.323  -1.753
  233   1HG1  VAL  30          1HG1      VAL  30  -2.616  -5.801  -0.954
  234   2HG1  VAL  30          2HG1      VAL  30  -1.789  -6.305  -2.426
  235   3HG1  VAL  30          3HG1      VAL  30  -0.873  -6.066  -0.940
  236   1HG2  VAL  30          1HG2      VAL  30  -0.536  -9.141  -1.807
  237   2HG2  VAL  30          2HG2      VAL  30  -0.743  -9.298  -0.063
  238   3HG2  VAL  30          3HG2      VAL  30   0.088  -7.892  -0.728
  239    H    LYS  31           H        LYS  31  -4.868  -8.896  -0.846
  240    HA   LYS  31           HA       LYS  31  -6.390  -6.647  -1.292
  241   1HB   LYS  31          2HB       LYS  31  -7.251  -9.486  -0.786
  242   2HB   LYS  31          1HB       LYS  31  -8.386  -8.215  -1.227
  243   1HG   LYS  31          2HG       LYS  31  -7.041  -7.820  -3.278
  244   2HG   LYS  31          1HG       LYS  31  -6.072  -9.232  -2.856
  245   1HD   LYS  31          2HD       LYS  31  -7.752  -9.889  -4.447
  246   2HD   LYS  31          1HD       LYS  31  -8.153 -10.591  -2.877
  247   1HE   LYS  31          2HE       LYS  31  -9.776  -8.818  -2.485
  248   2HE   LYS  31          1HE       LYS  31  -9.351  -8.071  -4.026
  249   1HZ   LYS  31          1HZ       LYS  31 -11.224  -9.276  -4.550
  250   2HZ   LYS  31          2HZ       LYS  31 -10.841 -10.561  -3.518
  251   3HZ   LYS  31          3HZ       LYS  31 -10.004 -10.369  -4.976
  252    H    GLN  32           H        GLN  32  -6.444  -8.782   1.533
  253    HA   GLN  32           HA       GLN  32  -8.458  -7.409   2.950
  254   1HB   GLN  32          2HB       GLN  32  -7.649  -9.669   3.564
  255   2HB   GLN  32          1HB       GLN  32  -6.112  -8.974   4.055
  256   1HG   GLN  32          2HG       GLN  32  -7.438  -9.398   5.998
  257   2HG   GLN  32          1HG       GLN  32  -7.282  -7.659   5.774
  258   1HE2  GLN  32          1HE2      GLN  32  -9.430  -8.962   3.519
  259   2HE2  GLN  32          2HE2      GLN  32 -10.900  -8.600   4.344
  260    H    PHE  33           H        PHE  33  -4.997  -7.002   2.709
  261    HA   PHE  33           HA       PHE  33  -4.484  -5.160   4.710
  262   1HB   PHE  33          2HB       PHE  33  -2.831  -6.324   3.203
  263   2HB   PHE  33          1HB       PHE  33  -3.262  -5.182   1.940
  264    HD1  PHE  33           1HD      PHE  33  -1.888  -5.396   5.368
  265    HD2  PHE  33           2HD      PHE  33  -2.167  -3.141   1.763
  266    HE1  PHE  33           1HE      PHE  33  -0.168  -3.844   6.194
  267    HE2  PHE  33           2HE      PHE  33  -0.450  -1.592   2.598
  268    HZ   PHE  33           HZ       PHE  33   0.548  -1.952   4.820
  269    H    PHE  34           H        PHE  34  -5.041  -4.404   1.297
  270    HA   PHE  34           HA       PHE  34  -5.492  -1.621   1.742
  271   1HB   PHE  34          2HB       PHE  34  -6.179  -3.316  -0.660
  272   2HB   PHE  34          1HB       PHE  34  -6.159  -1.550  -0.618
  273    HD1  PHE  34           1HD      PHE  34  -3.828  -0.840   0.807
  274    HD2  PHE  34           2HD      PHE  34  -4.392  -4.065  -1.900
  275    HE1  PHE  34           1HE      PHE  34  -1.415  -0.870   0.353
  276    HE2  PHE  34           2HE      PHE  34  -1.982  -4.100  -2.372
  277    HZ   PHE  34           HZ       PHE  34  -0.494  -2.501  -1.226
  278    H    ASN  35           H        ASN  35  -7.599  -4.398   1.356
  279    HA   ASN  35           HA       ASN  35 -10.074  -3.195   1.124
  280   1HB   ASN  35          2HB       ASN  35  -9.676  -5.634   1.066
  281   2HB   ASN  35          1HB       ASN  35  -9.351  -5.617   2.796
  282   1HD2  ASN  35          1HD2      ASN  35 -11.497  -6.588   0.737
  283   2HD2  ASN  35          2HD2      ASN  35 -12.972  -6.314   1.598
  284    H    ASP  36           H        ASP  36  -8.071  -3.708   3.931
  285    HA   ASP  36           HA       ASP  36  -9.998  -2.403   5.693
  286   1HB   ASP  36          2HB       ASP  36  -7.369  -3.756   6.325
  287   2HB   ASP  36          1HB       ASP  36  -8.475  -3.084   7.519
  288    H    ASN  37           H        ASN  37  -7.026  -1.654   4.038
  289    HA   ASN  37           HA       ASN  37  -6.400   0.571   5.786
  290   1HB   ASN  37          2HB       ASN  37  -5.248  -0.219   3.099
  291   2HB   ASN  37          1HB       ASN  37  -4.662   1.120   4.077
  292   1HD2  ASN  37          1HD2      ASN  37  -3.551  -1.558   3.132
  293   2HD2  ASN  37          2HD2      ASN  37  -2.872  -2.237   4.570
  294    H    GLY  38           H        GLY  38  -7.614   0.101   2.515
  295   1HA   GLY  38          2HA       GLY  38  -7.994   2.128   1.114
  296   2HA   GLY  38          1HA       GLY  38  -9.469   1.386   1.693
  297    H    VAL  39           H        VAL  39 -10.894   2.690   2.550
  298    HA   VAL  39           HA       VAL  39 -10.024   5.378   3.382
  299    HB   VAL  39           HB       VAL  39 -12.770   4.483   2.577
  300   1HG1  VAL  39          1HG1      VAL  39 -11.556   7.080   3.329
  301   2HG1  VAL  39          2HG1      VAL  39 -13.186   6.465   3.610
  302   3HG1  VAL  39          3HG1      VAL  39 -12.742   7.091   2.023
  303   1HG2  VAL  39          1HG2      VAL  39 -12.362   5.302   0.377
  304   2HG2  VAL  39          2HG2      VAL  39 -11.053   4.190   0.775
  305   3HG2  VAL  39          3HG2      VAL  39 -10.781   5.931   0.841
  306    H    ASP  40           H        ASP  40 -10.801   2.603   4.990
  307    HA   ASP  40           HA       ASP  40 -12.167   4.134   7.094
  308   1HB   ASP  40          2HB       ASP  40 -12.625   1.237   6.361
  309   2HB   ASP  40          1HB       ASP  40 -13.355   2.066   7.732
  310    H    GLY  41           H        GLY  41  -9.274   3.013   6.409
  311   1HA   GLY  41          2HA       GLY  41  -8.735   1.367   8.715
  312   2HA   GLY  41          1HA       GLY  41  -7.554   1.977   7.570
  313    H    GLU  42           H        GLU  42  -6.758   1.973  10.081
  314    HA   GLU  42           HA       GLU  42  -7.291   4.603  11.250
  315   1HB   GLU  42          2HB       GLU  42  -5.682   2.279  12.331
  316   2HB   GLU  42          1HB       GLU  42  -6.016   3.774  13.192
  317   1HG   GLU  42          2HG       GLU  42  -7.527   2.196  14.039
  318   2HG   GLU  42          1HG       GLU  42  -8.466   3.217  12.953
  319    H    TRP  43           H        TRP  43  -6.145   6.117  10.168
  320    HA   TRP  43           HA       TRP  43  -3.380   5.574   9.426
  321   1HB   TRP  43          2HB       TRP  43  -5.210   7.890   8.795
  322   2HB   TRP  43          1HB       TRP  43  -3.562   7.724   8.200
  323    HD1  TRP  43           HD       TRP  43  -6.392   5.064   8.256
  324    HE1  TRP  43           1HE      TRP  43  -6.700   4.207   5.854
  325    HE3  TRP  43           3HE      TRP  43  -3.037   8.096   5.901
  326    HZ2  TRP  43           2HZ      TRP  43  -5.640   4.754   3.278
  327    HZ3  TRP  43           3HZ      TRP  43  -2.741   7.874   3.477
  328    HH2  TRP  43           HH       TRP  43  -4.019   6.239   2.189
  329    H    THR  44           H        THR  44  -1.804   6.068  10.785
  330    HA   THR  44           HA       THR  44  -2.131   8.393  12.559
  331    HB   THR  44           HB       THR  44  -0.356   7.349  13.950
  332    HG1  THR  44           1HG      THR  44   0.392   5.343  13.471
  333   1HG2  THR  44          1HG2      THR  44  -2.276   5.130  13.682
  334   2HG2  THR  44          2HG2      THR  44  -2.947   6.722  14.032
  335   3HG2  THR  44          3HG2      THR  44  -1.746   6.013  15.113
  336    H    TYR  45           H        TYR  45  -0.624  10.031  12.475
  337    HA   TYR  45           HA       TYR  45   1.422   9.769  10.369
  338   1HB   TYR  45          2HB       TYR  45  -0.379  11.422   9.924
  339   2HB   TYR  45          1HB       TYR  45   0.092  12.294  11.378
  340    HD1  TYR  45           1HD      TYR  45   2.508  10.757   9.043
  341    HD2  TYR  45           2HD      TYR  45   0.623  14.358  10.307
  342    HE1  TYR  45           1HE      TYR  45   4.125  12.060   7.729
  343    HE2  TYR  45           2HE      TYR  45   2.239  15.669   8.997
  344    HH   TYR  45           HH       TYR  45   4.434  15.463   8.039
  345    H    ASP  46           H        ASP  46   3.510  10.437  10.745
  346    HA   ASP  46           HA       ASP  46   4.152  11.240  13.505
  347   1HB   ASP  46          2HB       ASP  46   4.797   8.901  13.119
  348   2HB   ASP  46          1HB       ASP  46   5.743   9.387  11.716
  349    H    ASP  47           H        ASP  47   4.147  13.435  12.810
  350    HA   ASP  47           HA       ASP  47   5.454  14.567  10.679
  351   1HB   ASP  47          2HB       ASP  47   5.303  15.710  13.477
  352   2HB   ASP  47          1HB       ASP  47   5.589  16.626  12.000
  353    H    ALA  48           H        ALA  48   6.827  13.462  13.714
  354    HA   ALA  48           HA       ALA  48   9.313  14.617  13.693
  355   1HB   ALA  48          1HB       ALA  48   8.324  13.105  15.447
  356   2HB   ALA  48          2HB       ALA  48  10.042  12.881  15.118
  357   3HB   ALA  48          3HB       ALA  48   8.863  11.748  14.458
  358    H    THR  49           H        THR  49   8.207  11.882  11.769
  359    HA   THR  49           HA       THR  49  10.811  11.917  10.388
  360    HB   THR  49           HB       THR  49  10.477   9.520   9.901
  361    HG1  THR  49           1HG      THR  49   8.266   9.741  11.660
  362   1HG2  THR  49          1HG2      THR  49  10.307   8.888  12.540
  363   2HG2  THR  49          2HG2      THR  49  10.840  10.569  12.599
  364   3HG2  THR  49          3HG2      THR  49  11.780   9.377  11.702
  365    H    LYS  50           H        LYS  50   7.953  13.123   9.920
  366    HA   LYS  50           HA       LYS  50   6.568  13.533   8.120
  367   1HB   LYS  50          2HB       LYS  50   9.218  13.017   6.765
  368   2HB   LYS  50          1HB       LYS  50   7.803  13.597   5.902
  369   1HG   LYS  50          2HG       LYS  50   8.911  15.056   8.273
  370   2HG   LYS  50          1HG       LYS  50   9.530  15.313   6.641
  371   1HD   LYS  50          2HD       LYS  50   6.674  15.695   7.540
  372   2HD   LYS  50          1HD       LYS  50   7.839  16.977   7.205
  373   1HE   LYS  50          2HE       LYS  50   6.686  14.997   5.249
  374   2HE   LYS  50          1HE       LYS  50   6.401  16.736   5.303
  375   1HZ   LYS  50          1HZ       LYS  50   8.964  15.382   4.665
  376   2HZ   LYS  50          2HZ       LYS  50   8.788  17.053   4.847
  377   3HZ   LYS  50          3HZ       LYS  50   7.983  16.249   3.594
  378    H    THR  51           H        THR  51   6.599  10.800   9.098
  379    HA   THR  51           HA       THR  51   5.917   9.399   6.602
  380    HB   THR  51           HB       THR  51   7.193   8.252   9.089
  381    HG1  THR  51           1HG      THR  51   8.746   9.217   7.883
  382   1HG2  THR  51          1HG2      THR  51   6.686   6.204   8.446
  383   2HG2  THR  51          2HG2      THR  51   7.259   6.520   6.809
  384   3HG2  THR  51          3HG2      THR  51   5.595   6.897   7.247
  385    H    PHE  52           H        PHE  52   4.122   8.120   6.574
  386    HA   PHE  52           HA       PHE  52   2.300   8.392   8.874
  387   1HB   PHE  52          2HB       PHE  52   1.576   7.793   5.997
  388   2HB   PHE  52          1HB       PHE  52   0.464   8.150   7.312
  389    HD1  PHE  52           1HD      PHE  52  -0.406  10.266   7.415
  390    HD2  PHE  52           2HD      PHE  52   3.401   9.690   5.603
  391    HE1  PHE  52           1HE      PHE  52  -0.335  12.652   6.811
  392    HE2  PHE  52           2HE      PHE  52   3.481  12.074   5.001
  393    HZ   PHE  52           HZ       PHE  52   1.612  13.558   5.606
  394    H    THR  53           H        THR  53   1.369   6.563   9.755
  395    HA   THR  53           HA       THR  53   2.224   4.000   8.590
  396    HB   THR  53           HB       THR  53   1.855   3.169  11.031
  397    HG1  THR  53           1HG      THR  53   2.176   4.715  12.580
  398   1HG2  THR  53          1HG2      THR  53   4.226   4.353  11.571
  399   2HG2  THR  53          2HG2      THR  53   4.183   4.443   9.811
  400   3HG2  THR  53          3HG2      THR  53   4.023   2.880  10.616
  401    H    VAL  54           H        VAL  54   0.698   2.739   7.877
  402    HA   VAL  54           HA       VAL  54  -2.068   3.189   8.777
  403    HB   VAL  54           HB       VAL  54  -1.109   1.850   6.236
  404   1HG1  VAL  54          1HG1      VAL  54  -3.423   1.839   5.557
  405   2HG1  VAL  54          2HG1      VAL  54  -3.902   2.648   7.049
  406   3HG1  VAL  54          3HG1      VAL  54  -3.267   1.003   7.102
  407   1HG2  VAL  54          1HG2      VAL  54  -2.167   3.897   5.179
  408   2HG2  VAL  54          2HG2      VAL  54  -0.637   4.152   6.016
  409   3HG2  VAL  54          3HG2      VAL  54  -2.153   4.616   6.789
  410    H    THR  55           H        THR  55  -2.685   1.773  10.275
  411    HA   THR  55           HA       THR  55  -1.537  -0.925  10.217
  412    HB   THR  55           HB       THR  55  -3.116   0.345  12.452
  413    HG1  THR  55           1HG      THR  55  -1.244   1.531  12.187
  414   1HG2  THR  55          1HG2      THR  55  -3.051  -2.020  12.715
  415   2HG2  THR  55          2HG2      THR  55  -1.878  -1.319  13.832
  416   3HG2  THR  55          3HG2      THR  55  -1.330  -2.070  12.331
  417    H    GLU  56           H        GLU  56  -2.694  -2.390   9.158
  418    HA   GLU  56           HA       GLU  56  -5.564  -2.038   8.879
  419   1HB   GLU  56          2HB       GLU  56  -5.501  -3.775   7.265
  420   2HB   GLU  56          1HB       GLU  56  -4.052  -2.815   7.005
  421   1HG   GLU  56          2HG       GLU  56  -3.276  -4.976   6.826
  422   2HG   GLU  56          1HG       GLU  56  -2.898  -4.567   8.496
  423   1H    MET   1          1HT       MET   1   5.460  18.916  -1.251
  424   2H    MET   1          2HT       MET   1   5.986  18.219  -2.699
  425   3H    MET   1          3HT       MET   1   6.710  19.638  -2.133
  426    HA   MET   1           HA       MET   1   8.262  18.087  -1.534
  427   1HB   MET   1          2HB       MET   1   7.479  19.463   0.374
  428   2HB   MET   1          1HB       MET   1   6.334  18.202   0.796
  429   1HG   MET   1          2HG       MET   1   8.003  16.744   1.500
  430   2HG   MET   1          1HG       MET   1   9.266  17.629   0.645
  431   1HE   MET   1          1HE       MET   1   6.663  17.707   3.448
  432   2HE   MET   1          2HE       MET   1   6.477  19.400   2.993
  433   3HE   MET   1          3HE       MET   1   7.217  18.978   4.538
  434    H    GLN   2           H        GLN   2   8.770  15.955  -0.486
  435    HA   GLN   2           HA       GLN   2   6.799  13.956  -1.362
  436   1HB   GLN   2          2HB       GLN   2   8.907  13.854  -2.578
  437   2HB   GLN   2          1HB       GLN   2   9.801  13.729  -1.073
  438   1HG   GLN   2          2HG       GLN   2   7.755  11.695  -1.896
  439   2HG   GLN   2          1HG       GLN   2   9.434  11.602  -2.416
  440   1HE2  GLN   2          1HE2      GLN   2   9.949  12.882   0.432
  441   2HE2  GLN   2          2HE2      GLN   2   9.977  11.487   1.443
  442    H    TYR   3           H        TYR   3   6.249  12.240  -0.039
  443    HA   TYR   3           HA       TYR   3   7.262  12.349   2.723
  444   1HB   TYR   3          2HB       TYR   3   4.379  11.974   1.880
  445   2HB   TYR   3          1HB       TYR   3   4.979  11.860   3.531
  446    HD1  TYR   3           1HD      TYR   3   4.580  13.697   4.855
  447    HD2  TYR   3           2HD      TYR   3   5.198  14.292   0.685
  448    HE1  TYR   3           1HE      TYR   3   4.227  16.113   5.151
  449    HE2  TYR   3           2HE      TYR   3   4.856  16.711   0.973
  450    HH   TYR   3           HH       TYR   3   4.812  18.391   2.576
  451    H    LYS   4           H        LYS   4   7.357  10.380   3.831
  452    HA   LYS   4           HA       LYS   4   7.260   8.026   2.072
  453   1HB   LYS   4          2HB       LYS   4   9.441   8.508   3.091
  454   2HB   LYS   4          1HB       LYS   4   8.713   8.435   4.688
  455   1HG   LYS   4          2HG       LYS   4   8.222   6.092   4.409
  456   2HG   LYS   4          1HG       LYS   4   8.815   6.137   2.749
  457   1HD   LYS   4          2HD       LYS   4  10.513   5.173   4.152
  458   2HD   LYS   4          1HD       LYS   4  11.054   6.764   3.617
  459   1HE   LYS   4          2HE       LYS   4   9.725   6.273   6.273
  460   2HE   LYS   4          1HE       LYS   4  11.471   6.216   6.044
  461   1HZ   LYS   4          1HZ       LYS   4  10.712   8.591   4.925
  462   2HZ   LYS   4          2HZ       LYS   4  11.433   8.386   6.439
  463   3HZ   LYS   4          3HZ       LYS   4   9.751   8.479   6.313
  464    H    VAL   5           H        VAL   5   5.385   6.973   2.242
  465    HA   VAL   5           HA       VAL   5   4.002   6.895   4.812
  466    HB   VAL   5           HB       VAL   5   3.079   5.903   2.110
  467   1HG1  VAL   5          1HG1      VAL   5   1.551   6.296   4.682
  468   2HG1  VAL   5          2HG1      VAL   5   1.989   4.746   3.961
  469   3HG1  VAL   5          3HG1      VAL   5   0.859   5.818   3.131
  470   1HG2  VAL   5          1HG2      VAL   5   2.971   8.120   1.706
  471   2HG2  VAL   5          2HG2      VAL   5   2.998   8.542   3.418
  472   3HG2  VAL   5          3HG2      VAL   5   1.495   8.009   2.665
  473    H    ILE   6           H        ILE   6   3.912   5.164   6.072
  474    HA   ILE   6           HA       ILE   6   5.151   2.679   5.114
  475    HB   ILE   6           HB       ILE   6   4.792   3.776   7.902
  476   1HG1  ILE   6          2HG1      ILE   6   7.261   3.024   6.327
  477   2HG1  ILE   6          1HG1      ILE   6   6.672   4.664   6.565
  478   1HG2  ILE   6          1HG2      ILE   6   5.212   1.010   7.002
  479   2HG2  ILE   6          2HG2      ILE   6   4.569   1.627   8.524
  480   3HG2  ILE   6          3HG2      ILE   6   6.313   1.568   8.261
  481   1HD1  ILE   6          1HD1      ILE   6   8.443   4.321   8.094
  482   2HD1  ILE   6          2HD1      ILE   6   7.770   2.782   8.631
  483   3HD1  ILE   6          3HD1      ILE   6   6.949   4.290   9.031
  484    H    LEU   7           H        LEU   7   3.870   1.030   4.689
  485    HA   LEU   7           HA       LEU   7   1.130   1.037   5.731
  486   1HB   LEU   7          2HB       LEU   7   2.189  -0.835   3.633
  487   2HB   LEU   7          1HB       LEU   7   0.536  -0.304   3.896
  488    HG   LEU   7           HG       LEU   7   2.792   1.314   2.729
  489   1HD1  LEU   7          1HD1      LEU   7   1.756  -0.300   1.211
  490   2HD1  LEU   7          2HD1      LEU   7   1.402   1.362   0.740
  491   3HD1  LEU   7          3HD1      LEU   7   0.174   0.394   1.556
  492   1HD2  LEU   7          1HD2      LEU   7  -0.029   2.179   3.350
  493   2HD2  LEU   7          2HD2      LEU   7   1.194   3.136   2.513
  494   3HD2  LEU   7          3HD2      LEU   7   1.421   2.701   4.207
  495    H    ASN   8           H        ASN   8   1.457   0.230   7.799
  496    HA   ASN   8           HA       ASN   8   2.805  -2.350   8.081
  497   1HB   ASN   8          2HB       ASN   8   3.408  -0.413   9.548
  498   2HB   ASN   8          1HB       ASN   8   1.788  -0.487  10.231
  499   1HD2  ASN   8          1HD2      ASN   8   4.788  -1.158  10.953
  500   2HD2  ASN   8          2HD2      ASN   8   4.606  -2.589  11.908
  501    H    GLY   9           H        GLY   9   1.492  -4.063   7.757
  502   1HA   GLY   9          2HA       GLY   9  -1.176  -3.953   9.011
  503   2HA   GLY   9          1HA       GLY   9  -0.819  -4.868   7.554
  504    H    LYS  10           H        LYS  10  -1.911  -6.537   8.949
  505    HA   LYS  10           HA       LYS  10  -0.445  -7.613  11.153
  506   1HB   LYS  10          2HB       LYS  10  -2.699  -8.800   9.533
  507   2HB   LYS  10          1HB       LYS  10  -2.079  -9.469  11.035
  508   1HG   LYS  10          2HG       LYS  10  -2.714  -7.350  12.167
  509   2HG   LYS  10          1HG       LYS  10  -3.466  -6.826  10.661
  510   1HD   LYS  10          2HD       LYS  10  -4.208  -9.318  12.193
  511   2HD   LYS  10          1HD       LYS  10  -5.078  -7.788  12.276
  512   1HE   LYS  10          2HE       LYS  10  -6.270  -9.157  10.759
  513   2HE   LYS  10          1HE       LYS  10  -5.407  -7.970   9.783
  514   1HZ   LYS  10          1HZ       LYS  10  -4.282  -9.572   8.757
  515   2HZ   LYS  10          2HZ       LYS  10  -5.360 -10.674   9.447
  516   3HZ   LYS  10          3HZ       LYS  10  -3.882 -10.355  10.203
  517    H    THR  11           H        THR  11  -1.102  -8.843   7.857
  518    HA   THR  11           HA       THR  11   1.229 -10.600   8.125
  519    HB   THR  11           HB       THR  11   0.062 -11.737   6.116
  520    HG1  THR  11           1HG      THR  11  -2.246 -11.389   6.220
  521   1HG2  THR  11          1HG2      THR  11   0.102 -12.854   8.238
  522   2HG2  THR  11          2HG2      THR  11  -1.520 -12.971   7.553
  523   3HG2  THR  11          3HG2      THR  11  -1.190 -11.818   8.847
  524    H    LEU  12           H        LEU  12   0.703  -7.660   7.053
  525    HA   LEU  12           HA       LEU  12   2.487  -8.009   4.765
  526   1HB   LEU  12          2HB       LEU  12   0.259  -7.834   3.836
  527   2HB   LEU  12          1HB       LEU  12  -0.043  -6.376   4.761
  528    HG   LEU  12           HG       LEU  12   1.574  -5.152   3.458
  529   1HD1  LEU  12          1HD1      LEU  12   3.311  -6.263   2.640
  530   2HD1  LEU  12          2HD1      LEU  12   2.248  -6.847   1.357
  531   3HD1  LEU  12          3HD1      LEU  12   2.485  -7.804   2.816
  532   1HD2  LEU  12          1HD2      LEU  12   0.062  -4.779   1.874
  533   2HD2  LEU  12          2HD2      LEU  12  -0.820  -6.183   2.474
  534   3HD2  LEU  12          3HD2      LEU  12   0.336  -6.366   1.155
  535    H    LYS  13           H        LYS  13   4.006  -6.477   4.523
  536    HA   LYS  13           HA       LYS  13   3.851  -4.006   6.061
  537   1HB   LYS  13          2HB       LYS  13   6.255  -5.828   6.260
  538   2HB   LYS  13          1HB       LYS  13   6.017  -4.297   7.090
  539   1HG   LYS  13          2HG       LYS  13   5.528  -5.771   8.763
  540   2HG   LYS  13          1HG       LYS  13   3.923  -5.501   8.082
  541   1HD   LYS  13          2HD       LYS  13   4.232  -7.859   8.453
  542   2HD   LYS  13          1HD       LYS  13   4.207  -7.553   6.720
  543   1HE   LYS  13          2HE       LYS  13   5.966  -9.137   7.323
  544   2HE   LYS  13          1HE       LYS  13   6.637  -7.655   6.646
  545   1HZ   LYS  13          1HZ       LYS  13   7.424  -8.803   8.957
  546   2HZ   LYS  13          2HZ       LYS  13   6.365  -7.607   9.512
  547   3HZ   LYS  13          3HZ       LYS  13   7.685  -7.183   8.544
  548    H    GLY  14           H        GLY  14   5.058  -2.317   5.173
  549   1HA   GLY  14          2HA       GLY  14   7.055  -2.676   3.206
  550   2HA   GLY  14          1HA       GLY  14   5.510  -2.396   2.422
  551    H    GLU  15           H        GLU  15   6.955  -0.571   1.639
  552    HA   GLU  15           HA       GLU  15   6.299   1.788   3.223
  553   1HB   GLU  15          2HB       GLU  15   9.066   1.239   2.131
  554   2HB   GLU  15          1HB       GLU  15   8.545   2.751   2.860
  555   1HG   GLU  15          2HG       GLU  15   8.151   1.599   4.977
  556   2HG   GLU  15          1HG       GLU  15   8.679   0.083   4.246
  557    H    THR  16           H        THR  16   5.698   3.498   2.024
  558    HA   THR  16           HA       THR  16   6.158   3.412  -0.866
  559    HB   THR  16           HB       THR  16   3.994   2.592  -0.861
  560    HG1  THR  16           1HG      THR  16   3.518   5.361  -0.755
  561   1HG2  THR  16          1HG2      THR  16   2.222   3.897   0.614
  562   2HG2  THR  16          2HG2      THR  16   3.640   4.125   1.636
  563   3HG2  THR  16          3HG2      THR  16   3.113   2.499   1.215
  564    H    THR  17           H        THR  17   5.547   5.556  -1.921
  565    HA   THR  17           HA       THR  17   5.864   7.825  -0.102
  566    HB   THR  17           HB       THR  17   7.663   8.762  -1.556
  567    HG1  THR  17           1HG      THR  17   8.722   7.329  -2.945
  568   1HG2  THR  17          1HG2      THR  17   8.427   7.805   0.462
  569   2HG2  THR  17          2HG2      THR  17   9.477   7.196  -0.819
  570   3HG2  THR  17          3HG2      THR  17   8.210   6.166  -0.152
  571    H    THR  18           H        THR  18   4.409   9.289  -0.559
  572    HA   THR  18           HA       THR  18   3.411   9.585  -3.330
  573    HB   THR  18           HB       THR  18   1.720   8.997  -1.593
  574    HG1  THR  18           1HG      THR  18   1.198  10.322  -3.428
  575   1HG2  THR  18          1HG2      THR  18   2.712  10.169   0.324
  576   2HG2  THR  18          2HG2      THR  18   1.024  10.605   0.056
  577   3HG2  THR  18          3HG2      THR  18   2.308  11.709  -0.434
  578    H    GLU  19           H        GLU  19   3.365  11.659  -4.248
  579    HA   GLU  19           HA       GLU  19   4.985  13.663  -2.822
  580   1HB   GLU  19          2HB       GLU  19   5.971  12.925  -4.926
  581   2HB   GLU  19          1HB       GLU  19   4.489  13.322  -5.787
  582   1HG   GLU  19          2HG       GLU  19   4.806  15.682  -5.247
  583   2HG   GLU  19          1HG       GLU  19   6.289  15.284  -4.381
  584    H    ALA  20           H        ALA  20   3.818  15.237  -1.910
  585    HA   ALA  20           HA       ALA  20   1.662  16.452  -3.457
  586   1HB   ALA  20          1HB       ALA  20   0.077  15.439  -2.277
  587   2HB   ALA  20          2HB       ALA  20   0.617  16.371  -0.881
  588   3HB   ALA  20          3HB       ALA  20   1.259  14.753  -1.163
  589    H    VAL  21           H        VAL  21   1.098  18.529  -2.824
  590    HA   VAL  21           HA       VAL  21   3.121  20.265  -2.171
  591    HB   VAL  21           HB       VAL  21   0.211  20.785  -1.569
  592   1HG1  VAL  21          1HG1      VAL  21   0.759  22.921  -1.254
  593   2HG1  VAL  21          2HG1      VAL  21   1.789  22.951  -2.685
  594   3HG1  VAL  21          3HG1      VAL  21   2.432  22.373  -1.148
  595   1HG2  VAL  21          1HG2      VAL  21   0.291  21.768  -3.944
  596   2HG2  VAL  21          2HG2      VAL  21   0.154  20.018  -3.764
  597   3HG2  VAL  21          3HG2      VAL  21   1.711  20.745  -4.163
  598    H    ASP  22           H        ASP  22   1.120  18.443   0.011
  599    HA   ASP  22           HA       ASP  22   2.787  19.238   2.224
  600   1HB   ASP  22          2HB       ASP  22   0.914  20.013   3.665
  601   2HB   ASP  22          1HB       ASP  22   1.237  21.087   2.307
  602    H    ALA  23           H        ALA  23   1.928  18.193   4.331
  603    HA   ALA  23           HA       ALA  23   1.859  15.434   3.956
  604   1HB   ALA  23          1HB       ALA  23   0.690  16.254   6.484
  605   2HB   ALA  23          2HB       ALA  23   2.168  17.136   6.108
  606   3HB   ALA  23          3HB       ALA  23   2.183  15.374   6.163
  607    H    ALA  24           H        ALA  24  -0.764  17.718   4.575
  608    HA   ALA  24           HA       ALA  24  -2.803  15.784   4.849
  609   1HB   ALA  24          1HB       ALA  24  -4.202  17.543   5.089
  610   2HB   ALA  24          2HB       ALA  24  -3.581  18.367   3.658
  611   3HB   ALA  24          3HB       ALA  24  -2.705  18.471   5.186
  612    H    THR  25           H        THR  25  -1.861  17.777   2.022
  613    HA   THR  25           HA       THR  25  -3.613  16.605   0.212
  614    HB   THR  25           HB       THR  25  -1.812  17.257  -1.503
  615    HG1  THR  25           1HG      THR  25  -0.508  18.972  -0.093
  616   1HG2  THR  25          1HG2      THR  25  -2.209  19.649  -1.264
  617   2HG2  THR  25          2HG2      THR  25  -2.860  19.376   0.352
  618   3HG2  THR  25          3HG2      THR  25  -3.692  18.716  -1.056
  619    H    ALA  26           H        ALA  26  -0.352  15.686   1.215
  620    HA   ALA  26           HA       ALA  26  -0.044  13.477  -0.500
  621   1HB   ALA  26          1HB       ALA  26   1.966  13.852   0.461
  622   2HB   ALA  26          2HB       ALA  26   1.376  12.730   1.688
  623   3HB   ALA  26          3HB       ALA  26   1.252  14.471   1.950
  624    H    GLU  27           H        GLU  27  -1.179  13.670   2.885
  625    HA   GLU  27           HA       GLU  27  -1.790  11.035   3.333
  626   1HB   GLU  27          2HB       GLU  27  -1.927  12.772   5.052
  627   2HB   GLU  27          1HB       GLU  27  -3.330  13.465   4.250
  628   1HG   GLU  27          2HG       GLU  27  -4.589  11.416   4.679
  629   2HG   GLU  27          1HG       GLU  27  -3.182  10.723   5.485
  630    H    LYS  28           H        LYS  28  -3.837  13.529   1.868
  631    HA   LYS  28           HA       LYS  28  -6.083  11.896   1.420
  632   1HB   LYS  28          2HB       LYS  28  -5.147  14.372  -0.041
  633   2HB   LYS  28          1HB       LYS  28  -6.736  13.638  -0.236
  634   1HG   LYS  28          2HG       LYS  28  -5.614  14.812   2.299
  635   2HG   LYS  28          1HG       LYS  28  -6.847  15.534   1.262
  636   1HD   LYS  28          2HD       LYS  28  -7.111  12.895   2.705
  637   2HD   LYS  28          1HD       LYS  28  -7.801  14.427   3.251
  638   1HE   LYS  28          2HE       LYS  28  -8.440  13.014   0.663
  639   2HE   LYS  28          1HE       LYS  28  -9.465  13.060   2.097
  640   1HZ   LYS  28          1HZ       LYS  28  -8.710  15.338   0.354
  641   2HZ   LYS  28          2HZ       LYS  28  -9.491  15.524   1.843
  642   3HZ   LYS  28          3HZ       LYS  28 -10.256  14.689   0.587
  643    H    VAL  29           H        VAL  29  -3.322  12.752  -0.627
  644    HA   VAL  29           HA       VAL  29  -4.061  11.450  -2.959
  645    HB   VAL  29           HB       VAL  29  -1.293  11.729  -1.773
  646   1HG1  VAL  29          1HG1      VAL  29  -2.250  10.653  -4.365
  647   2HG1  VAL  29          2HG1      VAL  29  -0.854  10.191  -3.391
  648   3HG1  VAL  29          3HG1      VAL  29  -0.796  11.653  -4.376
  649   1HG2  VAL  29          1HG2      VAL  29  -3.003  13.709  -2.605
  650   2HG2  VAL  29          2HG2      VAL  29  -2.016  13.419  -4.037
  651   3HG2  VAL  29          3HG2      VAL  29  -1.246  13.840  -2.507
  652    H    VAL  30           H        VAL  30  -2.447  10.189  -0.089
  653    HA   VAL  30           HA       VAL  30  -2.053   7.564  -1.061
  654    HB   VAL  30           HB       VAL  30  -2.448   8.437   1.806
  655   1HG1  VAL  30          1HG1      VAL  30  -2.487   5.915   1.007
  656   2HG1  VAL  30          2HG1      VAL  30  -1.669   6.400   2.492
  657   3HG1  VAL  30          3HG1      VAL  30  -0.738   6.138   1.017
  658   1HG2  VAL  30          1HG2      VAL  30  -0.339   9.205   1.890
  659   2HG2  VAL  30          2HG2      VAL  30  -0.518   9.366   0.143
  660   3HG2  VAL  30          3HG2      VAL  30   0.270   7.940   0.821
  661    H    LYS  31           H        LYS  31  -4.662   9.064   0.869
  662    HA   LYS  31           HA       LYS  31  -6.244   6.853   1.293
  663   1HB   LYS  31          2HB       LYS  31  -7.029   9.711   0.775
  664   2HB   LYS  31          1HB       LYS  31  -8.201   8.469   1.199
  665   1HG   LYS  31          2HG       LYS  31  -6.895   8.041   3.270
  666   2HG   LYS  31          1HG       LYS  31  -5.886   9.429   2.861
  667   1HD   LYS  31          2HD       LYS  31  -7.573  10.128   4.428
  668   2HD   LYS  31          1HD       LYS  31  -7.934  10.839   2.853
  669   1HE   LYS  31          2HE       LYS  31  -9.593   9.105   2.438
  670   2HE   LYS  31          1HE       LYS  31  -9.209   8.349   3.984
  671   1HZ   LYS  31          1HZ       LYS  31 -11.058   9.599   4.482
  672   2HZ   LYS  31          2HZ       LYS  31 -10.629  10.873   3.457
  673   3HZ   LYS  31          3HZ       LYS  31  -9.819  10.663   4.925
  674    H    GLN  32           H        GLN  32  -6.206   8.990  -1.534
  675    HA   GLN  32           HA       GLN  32  -8.234   7.665  -2.978
  676   1HB   GLN  32          2HB       GLN  32  -7.361   9.905  -3.582
  677   2HB   GLN  32          1HB       GLN  32  -5.835   9.171  -4.050
  678   1HG   GLN  32          2HG       GLN  32  -7.121   9.628  -6.012
  679   2HG   GLN  32          1HG       GLN  32  -7.012   7.886  -5.786
  680   1HE2  GLN  32          1HE2      GLN  32  -9.159   9.240  -3.560
  681   2HE2  GLN  32          2HE2      GLN  32 -10.625   8.915  -4.407
  682    H    PHE  33           H        PHE  33  -4.787   7.174  -2.689
  683    HA   PHE  33           HA       PHE  33  -4.290   5.320  -4.683
  684   1HB   PHE  33          2HB       PHE  33  -2.631   6.443  -3.152
  685   2HB   PHE  33          1HB       PHE  33  -3.109   5.312  -1.895
  686    HD1  PHE  33           1HD      PHE  33  -1.680   5.493  -5.303
  687    HD2  PHE  33           2HD      PHE  33  -2.065   3.244  -1.703
  688    HE1  PHE  33           1HE      PHE  33   0.012   3.898  -6.106
  689    HE2  PHE  33           2HE      PHE  33  -0.373   1.654  -2.514
  690    HZ   PHE  33           HZ       PHE  33   0.663   1.990  -4.722
  691    H    PHE  34           H        PHE  34  -4.913   4.577  -1.279
  692    HA   PHE  34           HA       PHE  34  -5.425   1.806  -1.730
  693   1HB   PHE  34          2HB       PHE  34  -6.105   3.518   0.663
  694   2HB   PHE  34          1HB       PHE  34  -6.128   1.752   0.620
  695    HD1  PHE  34           1HD      PHE  34  -3.794   0.986  -0.772
  696    HD2  PHE  34           2HD      PHE  34  -4.319   4.223   1.927
  697    HE1  PHE  34           1HE      PHE  34  -1.388   0.957  -0.284
  698    HE2  PHE  34           2HE      PHE  34  -1.915   4.199   2.433
  699    HZ   PHE  34           HZ       PHE  34  -0.451   2.564   1.309
  700    H    ASN  35           H        ASN  35  -7.470   4.633  -1.373
  701    HA   ASN  35           HA       ASN  35  -9.976   3.492  -1.176
  702   1HB   ASN  35          2HB       ASN  35  -9.520   5.921  -1.112
  703   2HB   ASN  35          1HB       ASN  35  -9.171   5.894  -2.837
  704   1HD2  ASN  35          1HD2      ASN  35 -11.322   6.917  -0.809
  705   2HD2  ASN  35          2HD2      ASN  35 -12.791   6.680  -1.690
  706    H    ASP  36           H        ASP  36  -7.923   3.955  -3.954
  707    HA   ASP  36           HA       ASP  36  -9.856   2.698  -5.744
  708   1HB   ASP  36          2HB       ASP  36  -7.185   3.985  -6.338
  709   2HB   ASP  36          1HB       ASP  36  -8.289   3.341  -7.549
  710    H    ASN  37           H        ASN  37  -6.926   1.876  -4.047
  711    HA   ASN  37           HA       ASN  37  -6.329  -0.364  -5.787
  712   1HB   ASN  37          2HB       ASN  37  -5.197   0.397  -3.084
  713   2HB   ASN  37          1HB       ASN  37  -4.630  -0.956  -4.055
  714   1HD2  ASN  37          1HD2      ASN  37  -3.468   1.697  -3.093
  715   2HD2  ASN  37          2HD2      ASN  37  -2.753   2.358  -4.521
  716    H    GLY  38           H        GLY  38  -7.577   0.137  -2.533
  717   1HA   GLY  38          2HA       GLY  38  -8.026  -1.881  -1.138
  718   2HA   GLY  38          1HA       GLY  38  -9.475  -1.104  -1.737
  719    H    VAL  39           H        VAL  39 -10.919  -2.372  -2.615
  720    HA   VAL  39           HA       VAL  39 -10.103  -5.082  -3.435
  721    HB   VAL  39           HB       VAL  39 -12.838  -4.119  -2.669
  722   1HG1  VAL  39          1HG1      VAL  39 -11.677  -6.745  -3.404
  723   2HG1  VAL  39          2HG1      VAL  39 -13.287  -6.090  -3.708
  724   3HG1  VAL  39          3HG1      VAL  39 -12.880  -6.726  -2.115
  725   1HG2  VAL  39          1HG2      VAL  39 -12.480  -4.949  -0.464
  726   2HG2  VAL  39          2HG2      VAL  39 -11.139  -3.869  -0.843
  727   3HG2  VAL  39          3HG2      VAL  39 -10.908  -5.616  -0.906
  728    H    ASP  40           H        ASP  40 -10.789  -2.288  -5.054
  729    HA   ASP  40           HA       ASP  40 -12.163  -3.786  -7.176
  730   1HB   ASP  40          2HB       ASP  40 -12.560  -0.879  -6.448
  731   2HB   ASP  40          1HB       ASP  40 -13.290  -1.690  -7.831
  732    H    GLY  41           H        GLY  41  -9.253  -2.735  -6.452
  733   1HA   GLY  41          2HA       GLY  41  -8.642  -1.103  -8.748
  734   2HA   GLY  41          1HA       GLY  41  -7.491  -1.742  -7.586
  735    H    GLU  42           H        GLU  42  -6.661  -1.758 -10.086
  736    HA   GLU  42           HA       GLU  42  -7.241  -4.373 -11.263
  737   1HB   GLU  42          2HB       GLU  42  -5.560  -2.089 -12.321
  738   2HB   GLU  42          1HB       GLU  42  -5.920  -3.577 -13.187
  739   1HG   GLU  42          2HG       GLU  42  -7.379  -1.963 -14.055
  740   2HG   GLU  42          1HG       GLU  42  -8.358  -2.960 -12.981
  741    H    TRP  43           H        TRP  43  -6.147  -5.915 -10.165
  742    HA   TRP  43           HA       TRP  43  -3.382  -5.438  -9.385
  743   1HB   TRP  43          2HB       TRP  43  -5.275  -7.709  -8.780
  744   2HB   TRP  43          1HB       TRP  43  -3.633  -7.584  -8.162
  745    HD1  TRP  43           HD       TRP  43  -6.396  -4.856  -8.257
  746    HE1  TRP  43           1HE      TRP  43  -6.718  -3.990  -5.859
  747    HE3  TRP  43           3HE      TRP  43  -3.149  -7.969  -5.855
  748    HZ2  TRP  43           2HZ      TRP  43  -5.708  -4.564  -3.270
  749    HZ3  TRP  43           3HZ      TRP  43  -2.882  -7.753  -3.428
  750    HH2  TRP  43           HH       TRP  43  -4.138  -6.087  -2.158
  751    H    THR  44           H        THR  44  -1.799  -5.971 -10.720
  752    HA   THR  44           HA       THR  44  -2.157  -8.289 -12.499
  753    HB   THR  44           HB       THR  44  -0.338  -7.287 -13.866
  754    HG1  THR  44           1HG      THR  44   0.453  -5.301 -13.376
  755   1HG2  THR  44          1HG2      THR  44  -2.207  -5.022 -13.624
  756   2HG2  THR  44          2HG2      THR  44  -2.911  -6.599 -13.984
  757   3HG2  THR  44          3HG2      THR  44  -1.678  -5.919 -15.047
  758    H    TYR  45           H        TYR  45  -0.691  -9.963 -12.396
  759    HA   TYR  45           HA       TYR  45   1.330  -9.751 -10.261
  760   1HB   TYR  45          2HB       TYR  45  -0.517 -11.359  -9.841
  761   2HB   TYR  45          1HB       TYR  45  -0.047 -12.241 -11.289
  762    HD1  TYR  45           1HD      TYR  45   2.372 -10.765  -8.919
  763    HD2  TYR  45           2HD      TYR  45   0.421 -14.317 -10.210
  764    HE1  TYR  45           1HE      TYR  45   3.940 -12.106  -7.583
  765    HE2  TYR  45           2HE      TYR  45   1.985 -15.668  -8.877
  766    HH   TYR  45           HH       TYR  45   4.171 -15.514  -7.889
  767    H    ASP  46           H        ASP  46   3.408 -10.469 -10.606
  768    HA   ASP  46           HA       ASP  46   4.068 -11.287 -13.358
  769   1HB   ASP  46          2HB       ASP  46   4.765  -8.964 -12.962
  770   2HB   ASP  46          1HB       ASP  46   5.678  -9.473 -11.546
  771    H    ASP  47           H        ASP  47   4.001 -13.482 -12.664
  772    HA   ASP  47           HA       ASP  47   5.248 -14.644 -10.514
  773   1HB   ASP  47          2HB       ASP  47   5.110 -15.784 -13.314
  774   2HB   ASP  47          1HB       ASP  47   5.352 -16.706 -11.833
  775    H    ALA  48           H        ALA  48   6.690 -13.573 -13.529
  776    HA   ALA  48           HA       ALA  48   9.147 -14.790 -13.472
  777   1HB   ALA  48          1HB       ALA  48   8.221 -13.253 -15.240
  778   2HB   ALA  48          2HB       ALA  48   9.939 -13.071 -14.888
  779   3HB   ALA  48          3HB       ALA  48   8.778 -11.909 -14.245
  780    H    THR  49           H        THR  49   8.081 -12.027 -11.565
  781    HA   THR  49           HA       THR  49  10.664 -12.127 -10.147
  782    HB   THR  49           HB       THR  49  10.381  -9.720  -9.664
  783    HG1  THR  49           1HG      THR  49   8.190  -9.888 -11.455
  784   1HG2  THR  49          1HG2      THR  49  10.264  -9.085 -12.305
  785   2HG2  THR  49          2HG2      THR  49  10.757 -10.779 -12.358
  786   3HG2  THR  49          3HG2      THR  49  11.713  -9.609 -11.448
  787    H    LYS  50           H        LYS  50   7.771 -13.261  -9.720
  788    HA   LYS  50           HA       LYS  50   6.351 -13.637  -7.939
  789   1HB   LYS  50          2HB       LYS  50   8.993 -13.187  -6.547
  790   2HB   LYS  50          1HB       LYS  50   7.552 -13.730  -5.704
  791   1HG   LYS  50          2HG       LYS  50   8.659 -15.217  -8.060
  792   2HG   LYS  50          1HG       LYS  50   9.248 -15.488  -6.419
  793   1HD   LYS  50          2HD       LYS  50   6.397 -15.800  -7.359
  794   2HD   LYS  50          1HD       LYS  50   7.525 -17.110  -7.007
  795   1HE   LYS  50          2HE       LYS  50   6.394 -15.103  -5.067
  796   2HE   LYS  50          1HE       LYS  50   6.067 -16.834  -5.126
  797   1HZ   LYS  50          1HZ       LYS  50   8.653 -15.543  -4.451
  798   2HZ   LYS  50          2HZ       LYS  50   8.439 -17.210  -4.635
  799   3HZ   LYS  50          3HZ       LYS  50   7.636 -16.386  -3.395
  800    H    THR  51           H        THR  51   6.462 -10.907  -8.918
  801    HA   THR  51           HA       THR  51   5.779  -9.490  -6.430
  802    HB   THR  51           HB       THR  51   7.119  -8.373  -8.898
  803    HG1  THR  51           1HG      THR  51   8.630  -9.375  -7.671
  804   1HG2  THR  51          1HG2      THR  51   6.652  -6.312  -8.262
  805   2HG2  THR  51          2HG2      THR  51   7.194  -6.644  -6.617
  806   3HG2  THR  51          3HG2      THR  51   5.527  -6.980  -7.079
  807    H    PHE  52           H        PHE  52   4.016  -8.166  -6.425
  808    HA   PHE  52           HA       PHE  52   2.221  -8.394  -8.754
  809   1HB   PHE  52          2HB       PHE  52   1.472  -7.778  -5.887
  810   2HB   PHE  52          1HB       PHE  52   0.369  -8.107  -7.217
  811    HD1  PHE  52           1HD      PHE  52  -0.550 -10.203  -7.333
  812    HD2  PHE  52           2HD      PHE  52   3.244  -9.718  -5.467
  813    HE1  PHE  52           1HE      PHE  52  -0.546 -12.589  -6.729
  814    HE2  PHE  52           2HE      PHE  52   3.256 -12.103  -4.863
  815    HZ   PHE  52           HZ       PHE  52   1.361 -13.541  -5.496
  816    H    THR  53           H        THR  53   1.347  -6.544  -9.646
  817    HA   THR  53           HA       THR  53   2.248  -4.001  -8.469
  818    HB   THR  53           HB       THR  53   1.933  -3.162 -10.915
  819    HG1  THR  53           1HG      THR  53   2.238  -4.716 -12.459
  820   1HG2  THR  53          1HG2      THR  53   4.281  -4.402 -11.421
  821   2HG2  THR  53          2HG2      THR  53   4.212  -4.492  -9.662
  822   3HG2  THR  53          3HG2      THR  53   4.102  -2.926 -10.471
  823    H    VAL  54           H        VAL  54   0.742  -2.704  -7.776
  824    HA   VAL  54           HA       VAL  54  -2.021  -3.086  -8.716
  825    HB   VAL  54           HB       VAL  54  -1.065  -1.771  -6.162
  826   1HG1  VAL  54          1HG1      VAL  54  -3.389  -1.703  -5.515
  827   2HG1  VAL  54          2HG1      VAL  54  -3.865  -2.500  -7.015
  828   3HG1  VAL  54          3HG1      VAL  54  -3.190  -0.872  -7.058
  829   1HG2  VAL  54          1HG2      VAL  54  -2.189  -3.792  -5.120
  830   2HG2  VAL  54          2HG2      VAL  54  -0.652  -4.084  -5.936
  831   3HG2  VAL  54          3HG2      VAL  54  -2.168  -4.511  -6.730
  832    H    THR  55           H        THR  55  -2.583  -1.657 -10.223
  833    HA   THR  55           HA       THR  55  -1.370   1.012 -10.149
  834    HB   THR  55           HB       THR  55  -2.947  -0.218 -12.406
  835    HG1  THR  55           1HG      THR  55  -1.109  -1.449 -12.114
  836   1HG2  THR  55          1HG2      THR  55  -2.821   2.143 -12.667
  837   2HG2  THR  55          2HG2      THR  55  -1.649   1.414 -13.767
  838   3HG2  THR  55          3HG2      THR  55  -1.104   2.151 -12.258
  839    H    GLU  56           H        GLU  56  -2.506   2.507  -9.106
  840    HA   GLU  56           HA       GLU  56  -5.387   2.224  -8.868
  841   1HB   GLU  56          2HB       GLU  56  -5.304   3.958  -7.253
  842   2HB   GLU  56          1HB       GLU  56  -3.884   2.965  -6.972
  843   1HG   GLU  56          2HG       GLU  56  -3.057   5.106  -6.782
  844   2HG   GLU  56          1HG       GLU  56  -2.665   4.687  -8.445
  Start of MODEL   34
    1   1H    MET   1          1HT       MET   1   4.815 -18.362   1.922
    2   2H    MET   1          2HT       MET   1   6.221 -18.788   2.760
    3   3H    MET   1          3HT       MET   1   5.677 -19.750   1.481
    4    HA   MET   1           HA       MET   1   7.621 -18.148   1.077
    5   1HB   MET   1          2HB       MET   1   6.510 -19.469  -0.652
    6   2HB   MET   1          1HB       MET   1   5.193 -18.307  -0.724
    7   1HG   MET   1          2HG       MET   1   6.688 -18.017  -2.595
    8   2HG   MET   1          1HG       MET   1   6.738 -16.605  -1.541
    9   1HE   MET   1          1HE       MET   1   8.984 -15.815  -2.768
   10   2HE   MET   1          2HE       MET   1   8.900 -17.242  -3.803
   11   3HE   MET   1          3HE       MET   1  10.399 -16.851  -2.958
   12    H    GLN   2           H        GLN   2   8.146 -16.040   0.441
   13    HA   GLN   2           HA       GLN   2   6.258 -13.994   1.373
   14   1HB   GLN   2          2HB       GLN   2   8.422 -14.016   2.529
   15   2HB   GLN   2          1HB       GLN   2   9.257 -13.852   0.993
   16   1HG   GLN   2          2HG       GLN   2   8.236 -11.658   0.667
   17   2HG   GLN   2          1HG       GLN   2   7.394 -11.822   2.207
   18   1HE2  GLN   2          1HE2      GLN   2   9.934 -10.395   0.782
   19   2HE2  GLN   2          2HE2      GLN   2  10.994 -10.222   2.137
   20    H    TYR   3           H        TYR   3   5.691 -12.285   0.065
   21    HA   TYR   3           HA       TYR   3   6.699 -12.365  -2.698
   22   1HB   TYR   3          2HB       TYR   3   3.839 -12.016  -1.786
   23   2HB   TYR   3          1HB       TYR   3   4.388 -11.722  -3.433
   24    HD1  TYR   3           1HD      TYR   3   4.505 -13.481  -4.969
   25    HD2  TYR   3           2HD      TYR   3   4.200 -14.368  -0.820
   26    HE1  TYR   3           1HE      TYR   3   4.214 -15.860  -5.510
   27    HE2  TYR   3           2HE      TYR   3   3.901 -16.752  -1.347
   28    HH   TYR   3           HH       TYR   3   3.221 -17.878  -4.455
   29    H    LYS   4           H        LYS   4   6.945 -10.418  -3.755
   30    HA   LYS   4           HA       LYS   4   6.963  -8.065  -2.009
   31   1HB   LYS   4          2HB       LYS   4   9.078  -8.626  -3.106
   32   2HB   LYS   4          1HB       LYS   4   8.296  -8.561  -4.679
   33   1HG   LYS   4          2HG       LYS   4   9.547  -6.548  -4.348
   34   2HG   LYS   4          1HG       LYS   4   7.826  -6.160  -4.298
   35   1HD   LYS   4          2HD       LYS   4   8.957  -4.969  -2.534
   36   2HD   LYS   4          1HD       LYS   4   7.932  -6.218  -1.823
   37   1HE   LYS   4          2HE       LYS   4  10.118  -6.126  -0.732
   38   2HE   LYS   4          1HE       LYS   4   9.862  -7.672  -1.543
   39   1HZ   LYS   4          1HZ       LYS   4  11.248  -6.958  -3.347
   40   2HZ   LYS   4          2HZ       LYS   4  12.097  -6.743  -1.902
   41   3HZ   LYS   4          3HZ       LYS   4  11.410  -5.409  -2.684
   42    H    VAL   5           H        VAL   5   5.118  -6.931  -2.101
   43    HA   VAL   5           HA       VAL   5   3.658  -6.774  -4.626
   44    HB   VAL   5           HB       VAL   5   2.863  -5.727  -1.906
   45   1HG1  VAL   5          1HG1      VAL   5   0.557  -5.816  -3.000
   46   2HG1  VAL   5          2HG1      VAL   5   1.422  -5.925  -4.533
   47   3HG1  VAL   5          3HG1      VAL   5   1.638  -4.515  -3.498
   48   1HG2  VAL   5          1HG2      VAL   5   2.694  -8.391  -3.120
   49   2HG2  VAL   5          2HG2      VAL   5   1.183  -7.799  -2.428
   50   3HG2  VAL   5          3HG2      VAL   5   2.631  -7.909  -1.425
   51    H    ILE   6           H        ILE   6   3.745  -5.067  -5.900
   52    HA   ILE   6           HA       ILE   6   5.096  -2.645  -4.938
   53    HB   ILE   6           HB       ILE   6   4.626  -3.629  -7.757
   54   1HG1  ILE   6          2HG1      ILE   6   7.158  -3.405  -6.115
   55   2HG1  ILE   6          1HG1      ILE   6   6.328  -4.902  -6.527
   56   1HG2  ILE   6          1HG2      ILE   6   4.813  -1.476  -8.318
   57   2HG2  ILE   6          2HG2      ILE   6   6.518  -1.653  -7.906
   58   3HG2  ILE   6          3HG2      ILE   6   5.386  -1.013  -6.716
   59   1HD1  ILE   6          1HD1      ILE   6   7.757  -3.022  -8.382
   60   2HD1  ILE   6          2HD1      ILE   6   6.727  -4.344  -8.936
   61   3HD1  ILE   6          3HD1      ILE   6   8.173  -4.690  -7.988
   62    H    LEU   7           H        LEU   7   3.867  -0.952  -4.480
   63    HA   LEU   7           HA       LEU   7   1.172  -0.781  -5.622
   64   1HB   LEU   7          2HB       LEU   7   2.255   1.015  -3.470
   65   2HB   LEU   7          1HB       LEU   7   0.587   0.582  -3.801
   66    HG   LEU   7           HG       LEU   7   2.690  -1.151  -2.531
   67   1HD1  LEU   7          1HD1      LEU   7   1.637   0.512  -1.079
   68   2HD1  LEU   7          2HD1      LEU   7   1.176  -1.130  -0.632
   69   3HD1  LEU   7          3HD1      LEU   7   0.050  -0.109  -1.523
   70   1HD2  LEU   7          1HD2      LEU   7   1.285  -2.416  -4.141
   71   2HD2  LEU   7          2HD2      LEU   7  -0.141  -1.907  -3.237
   72   3HD2  LEU   7          3HD2      LEU   7   1.076  -2.925  -2.466
   73    H    ASN   8           H        ASN   8   1.747  -0.052  -7.675
   74    HA   ASN   8           HA       ASN   8   3.272   2.411  -7.910
   75   1HB   ASN   8          2HB       ASN   8   3.747   0.472  -9.379
   76   2HB   ASN   8          1HB       ASN   8   2.136   0.630 -10.070
   77   1HD2  ASN   8          1HD2      ASN   8   5.210   1.178 -10.714
   78   2HD2  ASN   8          2HD2      ASN   8   5.096   2.583 -11.714
   79    H    GLY   9           H        GLY   9   2.090   4.175  -7.466
   80   1HA   GLY   9          2HA       GLY   9  -0.437   4.511  -8.956
   81   2HA   GLY   9          1HA       GLY   9  -0.164   5.190  -7.358
   82    H    LYS  10           H        LYS  10  -0.882   6.578  -9.824
   83    HA   LYS  10           HA       LYS  10   1.186   7.843 -11.098
   84   1HB   LYS  10          2HB       LYS  10  -1.557   8.815 -10.350
   85   2HB   LYS  10          1HB       LYS  10  -0.444   9.831 -11.253
   86   1HG   LYS  10          2HG       LYS  10  -1.979   8.710 -12.747
   87   2HG   LYS  10          1HG       LYS  10  -0.333   8.137 -13.017
   88   1HD   LYS  10          2HD       LYS  10  -0.793   6.132 -11.730
   89   2HD   LYS  10          1HD       LYS  10  -2.420   6.715 -11.369
   90   1HE   LYS  10          2HE       LYS  10  -2.437   5.069 -13.176
   91   2HE   LYS  10          1HE       LYS  10  -2.982   6.649 -13.736
   92   1HZ   LYS  10          1HZ       LYS  10  -1.210   5.232 -15.054
   93   2HZ   LYS  10          2HZ       LYS  10  -0.143   6.034 -14.015
   94   3HZ   LYS  10          3HZ       LYS  10  -1.159   6.924 -15.030
   95    H    THR  11           H        THR  11  -0.446   8.978  -8.140
   96    HA   THR  11           HA       THR  11   1.685  10.920  -7.714
   97    HB   THR  11           HB       THR  11   0.099  11.687  -5.873
   98    HG1  THR  11           1HG      THR  11  -2.094  10.972  -6.258
   99   1HG2  THR  11          1HG2      THR  11  -0.739  13.186  -7.281
  100   2HG2  THR  11          2HG2      THR  11  -1.580  11.950  -8.216
  101   3HG2  THR  11          3HG2      THR  11   0.113  12.310  -8.552
  102    H    LEU  12           H        LEU  12   0.951   7.795  -6.815
  103    HA   LEU  12           HA       LEU  12   2.648   8.045  -4.439
  104   1HB   LEU  12          2HB       LEU  12   0.337   7.858  -3.683
  105   2HB   LEU  12          1HB       LEU  12   0.121   6.408  -4.644
  106    HG   LEU  12           HG       LEU  12   1.545   5.149  -3.229
  107   1HD1  LEU  12          1HD1      LEU  12   2.353   6.721  -1.139
  108   2HD1  LEU  12          2HD1      LEU  12   2.566   7.779  -2.530
  109   3HD1  LEU  12          3HD1      LEU  12   3.361   6.214  -2.495
  110   1HD2  LEU  12          1HD2      LEU  12   0.305   6.588  -1.023
  111   2HD2  LEU  12          2HD2      LEU  12   0.053   4.935  -1.585
  112   3HD2  LEU  12          3HD2      LEU  12  -0.804   6.270  -2.357
  113    H    LYS  13           H        LYS  13   4.203   6.527  -4.246
  114    HA   LYS  13           HA       LYS  13   4.035   4.090  -5.842
  115   1HB   LYS  13          2HB       LYS  13   6.337   6.039  -6.063
  116   2HB   LYS  13          1HB       LYS  13   6.304   4.428  -6.767
  117   1HG   LYS  13          2HG       LYS  13   4.411   5.073  -8.169
  118   2HG   LYS  13          1HG       LYS  13   4.437   6.688  -7.460
  119   1HD   LYS  13          2HD       LYS  13   6.698   7.035  -8.329
  120   2HD   LYS  13          1HD       LYS  13   6.679   5.415  -9.031
  121   1HE   LYS  13          2HE       LYS  13   6.181   7.113 -10.713
  122   2HE   LYS  13          1HE       LYS  13   4.803   6.044 -10.456
  123   1HZ   LYS  13          1HZ       LYS  13   3.558   7.709  -9.642
  124   2HZ   LYS  13          2HZ       LYS  13   4.638   8.704 -10.480
  125   3HZ   LYS  13          3HZ       LYS  13   4.845   8.439  -8.821
  126    H    GLY  14           H        GLY  14   5.194   2.368  -4.997
  127   1HA   GLY  14          2HA       GLY  14   7.241   2.599  -3.075
  128   2HA   GLY  14          1HA       GLY  14   5.707   2.403  -2.245
  129    H    GLU  15           H        GLU  15   6.937   0.479  -1.466
  130    HA   GLU  15           HA       GLU  15   6.146  -1.824  -3.059
  131   1HB   GLU  15          2HB       GLU  15   8.972  -1.436  -2.050
  132   2HB   GLU  15          1HB       GLU  15   8.343  -2.922  -2.748
  133   1HG   GLU  15          2HG       GLU  15   7.939  -1.749  -4.860
  134   2HG   GLU  15          1HG       GLU  15   8.598  -0.273  -4.157
  135    H    THR  16           H        THR  16   5.620  -3.595  -1.858
  136    HA   THR  16           HA       THR  16   6.123  -3.543   1.016
  137    HB   THR  16           HB       THR  16   4.009  -2.597   1.119
  138    HG1  THR  16           1HG      THR  16   3.367  -5.326   0.982
  139   1HG2  THR  16          1HG2      THR  16   3.658  -3.347  -1.490
  140   2HG2  THR  16          2HG2      THR  16   2.457  -2.572  -0.465
  141   3HG2  THR  16          3HG2      THR  16   2.469  -4.326  -0.632
  142    H    THR  17           H        THR  17   5.365  -5.674   2.060
  143    HA   THR  17           HA       THR  17   5.512  -7.917   0.190
  144    HB   THR  17           HB       THR  17   7.279  -9.005   1.554
  145    HG1  THR  17           1HG      THR  17   7.546  -6.449   2.748
  146   1HG2  THR  17          1HG2      THR  17   8.096  -7.995  -0.403
  147   2HG2  THR  17          2HG2      THR  17   9.170  -7.482   0.898
  148   3HG2  THR  17          3HG2      THR  17   7.944  -6.375   0.277
  149    H    THR  18           H        THR  18   4.010  -9.336   0.652
  150    HA   THR  18           HA       THR  18   2.997  -9.590   3.421
  151    HB   THR  18           HB       THR  18   1.324  -8.988   1.677
  152    HG1  THR  18           1HG      THR  18   0.785 -10.336   3.507
  153   1HG2  THR  18          1HG2      THR  18   0.591 -10.845   0.143
  154   2HG2  THR  18          2HG2      THR  18   2.155 -11.596   0.453
  155   3HG2  THR  18          3HG2      THR  18   2.076 -10.005  -0.305
  156    H    GLU  19           H        GLU  19   2.894 -11.639   4.368
  157    HA   GLU  19           HA       GLU  19   4.514 -13.708   3.034
  158   1HB   GLU  19          2HB       GLU  19   5.348 -12.969   5.221
  159   2HB   GLU  19          1HB       GLU  19   3.802 -13.368   5.958
  160   1HG   GLU  19          2HG       GLU  19   5.444 -15.082   6.425
  161   2HG   GLU  19          1HG       GLU  19   4.144 -15.721   5.420
  162    H    ALA  20           H        ALA  20   3.307 -15.211   2.009
  163    HA   ALA  20           HA       ALA  20   1.034 -16.352   3.444
  164   1HB   ALA  20          1HB       ALA  20  -0.536 -15.966   1.809
  165   2HB   ALA  20          2HB       ALA  20   0.678 -15.735   0.549
  166   3HB   ALA  20          3HB       ALA  20   0.402 -14.473   1.749
  167    H    VAL  21           H        VAL  21   0.499 -18.430   2.864
  168    HA   VAL  21           HA       VAL  21   2.508 -20.201   2.262
  169    HB   VAL  21           HB       VAL  21  -0.403 -20.693   1.637
  170   1HG1  VAL  21          1HG1      VAL  21   1.833 -22.562   2.410
  171   2HG1  VAL  21          2HG1      VAL  21   1.080 -22.428   0.819
  172   3HG1  VAL  21          3HG1      VAL  21   0.144 -23.021   2.192
  173   1HG2  VAL  21          1HG2      VAL  21   1.073 -20.640   4.245
  174   2HG2  VAL  21          2HG2      VAL  21  -0.363 -21.641   4.025
  175   3HG2  VAL  21          3HG2      VAL  21  -0.468 -19.892   3.822
  176    H    ASP  22           H        ASP  22   0.558 -18.389   0.033
  177    HA   ASP  22           HA       ASP  22   2.222 -19.266  -2.159
  178   1HB   ASP  22          2HB       ASP  22   0.416 -20.046  -3.598
  179   2HB   ASP  22          1HB       ASP  22   0.492 -21.017  -2.131
  180    H    ALA  23           H        ALA  23   1.262 -18.237  -4.300
  181    HA   ALA  23           HA       ALA  23   1.428 -15.460  -3.966
  182   1HB   ALA  23          1HB       ALA  23   2.043 -16.693  -6.031
  183   2HB   ALA  23          2HB       ALA  23   1.017 -15.289  -6.326
  184   3HB   ALA  23          3HB       ALA  23   0.325 -16.910  -6.363
  185    H    ALA  24           H        ALA  24  -1.373 -17.550  -4.515
  186    HA   ALA  24           HA       ALA  24  -3.273 -15.474  -4.758
  187   1HB   ALA  24          1HB       ALA  24  -4.065 -17.531  -5.490
  188   2HB   ALA  24          2HB       ALA  24  -4.873 -17.358  -3.932
  189   3HB   ALA  24          3HB       ALA  24  -3.449 -18.388  -4.077
  190    H    THR  25           H        THR  25  -2.410 -17.505  -1.935
  191    HA   THR  25           HA       THR  25  -4.002 -16.284  -0.045
  192    HB   THR  25           HB       THR  25  -2.247 -16.984   1.592
  193    HG1  THR  25           1HG      THR  25  -0.806 -17.328  -0.772
  194   1HG2  THR  25          1HG2      THR  25  -3.456 -18.794  -0.362
  195   2HG2  THR  25          2HG2      THR  25  -3.462 -18.848   1.401
  196   3HG2  THR  25          3HG2      THR  25  -2.067 -19.447   0.507
  197    H    ALA  26           H        ALA  26  -0.775 -15.404  -1.195
  198    HA   ALA  26           HA       ALA  26  -0.370 -13.164   0.447
  199   1HB   ALA  26          1HB       ALA  26   1.450 -14.127  -0.825
  200   2HB   ALA  26          2HB       ALA  26   1.241 -12.438  -1.286
  201   3HB   ALA  26          3HB       ALA  26   0.648 -13.719  -2.341
  202    H    GLU  27           H        GLU  27  -1.646 -13.388  -2.892
  203    HA   GLU  27           HA       GLU  27  -2.239 -10.714  -3.263
  204   1HB   GLU  27          2HB       GLU  27  -2.359 -12.438  -5.035
  205   2HB   GLU  27          1HB       GLU  27  -3.832 -13.055  -4.298
  206   1HG   GLU  27          2HG       GLU  27  -4.929 -10.919  -4.696
  207   2HG   GLU  27          1HG       GLU  27  -3.459 -10.302  -5.443
  208    H    LYS  28           H        LYS  28  -4.269 -13.284  -1.872
  209    HA   LYS  28           HA       LYS  28  -6.553 -11.710  -1.433
  210   1HB   LYS  28          2HB       LYS  28  -5.551 -14.134   0.074
  211   2HB   LYS  28          1HB       LYS  28  -7.162 -13.453   0.240
  212   1HG   LYS  28          2HG       LYS  28  -5.981 -14.635  -2.265
  213   2HG   LYS  28          1HG       LYS  28  -7.180 -15.393  -1.217
  214   1HD   LYS  28          2HD       LYS  28  -7.612 -12.780  -2.660
  215   2HD   LYS  28          1HD       LYS  28  -8.108 -14.347  -3.294
  216   1HE   LYS  28          2HE       LYS  28 -10.020 -13.391  -2.273
  217   2HE   LYS  28          1HE       LYS  28  -9.450 -14.658  -1.189
  218   1HZ   LYS  28          1HZ       LYS  28  -9.083 -13.186   0.422
  219   2HZ   LYS  28          2HZ       LYS  28  -9.993 -12.093  -0.489
  220   3HZ   LYS  28          3HZ       LYS  28  -8.307 -12.091  -0.610
  221    H    VAL  29           H        VAL  29  -3.774 -12.459   0.638
  222    HA   VAL  29           HA       VAL  29  -4.620 -11.086   2.920
  223    HB   VAL  29           HB       VAL  29  -1.791 -11.471   1.910
  224   1HG1  VAL  29          1HG1      VAL  29  -1.446  -9.915   3.539
  225   2HG1  VAL  29          2HG1      VAL  29  -1.466 -11.371   4.532
  226   3HG1  VAL  29          3HG1      VAL  29  -2.903 -10.357   4.427
  227   1HG2  VAL  29          1HG2      VAL  29  -2.737 -13.114   4.138
  228   2HG2  VAL  29          2HG2      VAL  29  -1.829 -13.569   2.697
  229   3HG2  VAL  29          3HG2      VAL  29  -3.583 -13.414   2.620
  230    H    VAL  30           H        VAL  30  -2.952  -9.992   0.023
  231    HA   VAL  30           HA       VAL  30  -2.488  -7.334   0.919
  232    HB   VAL  30           HB       VAL  30  -2.799  -8.355  -1.913
  233   1HG1  VAL  30          1HG1      VAL  30  -1.887  -6.369  -2.683
  234   2HG1  VAL  30          2HG1      VAL  30  -1.196  -5.960  -1.113
  235   3HG1  VAL  30          3HG1      VAL  30  -2.933  -5.816  -1.376
  236   1HG2  VAL  30          1HG2      VAL  30  -0.943  -9.226  -0.188
  237   2HG2  VAL  30          2HG2      VAL  30  -0.131  -7.784  -0.794
  238   3HG2  VAL  30          3HG2      VAL  30  -0.647  -9.042  -1.916
  239    H    LYS  31           H        LYS  31  -5.024  -8.861  -1.107
  240    HA   LYS  31           HA       LYS  31  -6.633  -6.714  -1.656
  241   1HB   LYS  31          2HB       LYS  31  -7.538  -9.469  -0.796
  242   2HB   LYS  31          1HB       LYS  31  -8.577  -8.269  -1.540
  243   1HG   LYS  31          2HG       LYS  31  -6.218  -9.633  -2.809
  244   2HG   LYS  31          1HG       LYS  31  -7.920  -9.916  -3.158
  245   1HD   LYS  31          2HD       LYS  31  -7.840  -7.300  -3.635
  246   2HD   LYS  31          1HD       LYS  31  -6.150  -7.689  -3.959
  247   1HE   LYS  31          2HE       LYS  31  -8.517  -9.041  -5.238
  248   2HE   LYS  31          1HE       LYS  31  -7.534  -7.785  -5.987
  249   1HZ   LYS  31          1HZ       LYS  31  -6.725 -10.534  -5.255
  250   2HZ   LYS  31          2HZ       LYS  31  -5.599  -9.325  -5.619
  251   3HZ   LYS  31          3HZ       LYS  31  -6.716  -9.816  -6.787
  252    H    GLN  32           H        GLN  32  -6.741  -8.753   1.234
  253    HA   GLN  32           HA       GLN  32  -8.713  -7.293   2.613
  254   1HB   GLN  32          2HB       GLN  32  -7.971  -9.588   3.231
  255   2HB   GLN  32          1HB       GLN  32  -6.450  -8.916   3.798
  256   1HG   GLN  32          2HG       GLN  32  -7.864  -9.315   5.678
  257   2HG   GLN  32          1HG       GLN  32  -7.695  -7.578   5.452
  258   1HE2  GLN  32          1HE2      GLN  32  -9.733  -8.846   3.092
  259   2HE2  GLN  32          2HE2      GLN  32 -11.240  -8.491   3.849
  260    H    PHE  33           H        PHE  33  -5.226  -6.981   2.445
  261    HA   PHE  33           HA       PHE  33  -4.735  -5.170   4.481
  262   1HB   PHE  33          2HB       PHE  33  -3.050  -6.315   2.970
  263   2HB   PHE  33          1HB       PHE  33  -3.428  -5.106   1.752
  264    HD1  PHE  33           1HD      PHE  33  -2.422  -5.319   5.329
  265    HD2  PHE  33           2HD      PHE  33  -2.080  -3.244   1.618
  266    HE1  PHE  33           1HE      PHE  33  -0.766  -3.795   6.323
  267    HE2  PHE  33           2HE      PHE  33  -0.415  -1.733   2.618
  268    HZ   PHE  33           HZ       PHE  33   0.241  -2.016   4.976
  269    H    PHE  34           H        PHE  34  -5.150  -4.345   1.073
  270    HA   PHE  34           HA       PHE  34  -5.598  -1.574   1.556
  271   1HB   PHE  34          2HB       PHE  34  -6.178  -3.219  -0.909
  272   2HB   PHE  34          1HB       PHE  34  -6.141  -1.455  -0.836
  273    HD1  PHE  34           1HD      PHE  34  -3.875  -0.777   0.695
  274    HD2  PHE  34           2HD      PHE  34  -4.330  -3.997  -2.039
  275    HE1  PHE  34           1HE      PHE  34  -1.442  -0.827   0.359
  276    HE2  PHE  34           2HE      PHE  34  -1.896  -4.045  -2.394
  277    HZ   PHE  34           HZ       PHE  34  -0.458  -2.459  -1.184
  278    H    ASN  35           H        ASN  35  -7.730  -4.315   0.991
  279    HA   ASN  35           HA       ASN  35 -10.178  -3.045   0.691
  280   1HB   ASN  35          2HB       ASN  35  -9.875  -5.475   0.514
  281   2HB   ASN  35          1HB       ASN  35  -9.531  -5.571   2.236
  282   1HD2  ASN  35          1HD2      ASN  35 -11.701  -6.481   0.231
  283   2HD2  ASN  35          2HD2      ASN  35 -13.167  -6.191   1.100
  284    H    ASP  36           H        ASP  36  -8.289  -3.734   3.545
  285    HA   ASP  36           HA       ASP  36 -10.263  -2.522   5.317
  286   1HB   ASP  36          2HB       ASP  36  -7.653  -3.914   5.942
  287   2HB   ASP  36          1HB       ASP  36  -8.795  -3.318   7.143
  288    H    ASN  37           H        ASN  37  -7.169  -1.730   3.880
  289    HA   ASN  37           HA       ASN  37  -6.598   0.396   5.746
  290   1HB   ASN  37          2HB       ASN  37  -5.415  -0.243   3.033
  291   2HB   ASN  37          1HB       ASN  37  -4.854   1.063   4.071
  292   1HD2  ASN  37          1HD2      ASN  37  -3.718  -1.581   3.031
  293   2HD2  ASN  37          2HD2      ASN  37  -3.036  -2.296   4.448
  294    H    GLY  38           H        GLY  38  -7.945   0.059   2.549
  295   1HA   GLY  38          2HA       GLY  38  -8.325   2.086   1.158
  296   2HA   GLY  38          1HA       GLY  38  -9.790   1.423   1.841
  297    H    VAL  39           H        VAL  39 -11.102   2.843   2.654
  298    HA   VAL  39           HA       VAL  39 -10.269   5.547   3.027
  299    HB   VAL  39           HB       VAL  39 -12.955   4.244   3.319
  300   1HG1  VAL  39          1HG1      VAL  39 -13.506   6.867   2.950
  301   2HG1  VAL  39          2HG1      VAL  39 -12.054   6.978   3.945
  302   3HG1  VAL  39          3HG1      VAL  39 -13.457   6.084   4.530
  303   1HG2  VAL  39          1HG2      VAL  39 -13.157   4.488   1.122
  304   2HG2  VAL  39          2HG2      VAL  39 -11.446   4.913   1.071
  305   3HG2  VAL  39          3HG2      VAL  39 -12.664   6.178   1.209
  306    H    ASP  40           H        ASP  40 -11.909   3.296   5.321
  307    HA   ASP  40           HA       ASP  40 -11.394   5.196   7.435
  308   1HB   ASP  40          2HB       ASP  40 -12.811   2.531   7.461
  309   2HB   ASP  40          1HB       ASP  40 -12.717   3.638   8.827
  310    H    GLY  41           H        GLY  41  -9.096   3.655   6.240
  311   1HA   GLY  41          2HA       GLY  41  -8.245   1.711   8.110
  312   2HA   GLY  41          1HA       GLY  41  -7.205   2.583   6.997
  313    H    GLU  42           H        GLU  42  -6.900   1.816   9.881
  314    HA   GLU  42           HA       GLU  42  -6.908   4.310  11.339
  315   1HB   GLU  42          2HB       GLU  42  -5.677   1.633  12.032
  316   2HB   GLU  42          1HB       GLU  42  -5.813   3.001  13.129
  317   1HG   GLU  42          2HG       GLU  42  -8.251   2.872  12.980
  318   2HG   GLU  42          1HG       GLU  42  -8.106   1.489  11.896
  319    H    TRP  43           H        TRP  43  -5.552   5.748  10.298
  320    HA   TRP  43           HA       TRP  43  -2.756   4.917   9.910
  321   1HB   TRP  43          2HB       TRP  43  -4.121   7.377   8.826
  322   2HB   TRP  43          1HB       TRP  43  -2.533   6.774   8.389
  323    HD1  TRP  43           HD       TRP  43  -5.071   4.008   8.472
  324    HE1  TRP  43           1HE      TRP  43  -5.784   3.426   6.067
  325    HE3  TRP  43           3HE      TRP  43  -2.958   7.956   6.039
  326    HZ2  TRP  43           2HZ      TRP  43  -5.484   4.512   3.480
  327    HZ3  TRP  43           3HZ      TRP  43  -3.204   8.111   3.605
  328    HH2  TRP  43           HH       TRP  43  -4.441   6.423   2.347
  329    H    THR  44           H        THR  44  -1.141   5.815  11.042
  330    HA   THR  44           HA       THR  44  -1.760   8.143  12.739
  331    HB   THR  44           HB       THR  44   0.097   7.366  14.200
  332    HG1  THR  44           1HG      THR  44   1.087   6.094  12.458
  333   1HG2  THR  44          1HG2      THR  44  -2.454   6.222  14.031
  334   2HG2  THR  44          2HG2      THR  44  -1.371   6.265  15.423
  335   3HG2  THR  44          3HG2      THR  44  -1.326   4.896  14.313
  336    H    TYR  45           H        TYR  45  -0.333   9.903  12.656
  337    HA   TYR  45           HA       TYR  45   1.623   9.753  10.457
  338   1HB   TYR  45          2HB       TYR  45  -0.229  11.291  10.038
  339   2HB   TYR  45          1HB       TYR  45   0.130  12.153  11.530
  340    HD1  TYR  45           1HD      TYR  45   2.381  10.928   8.814
  341    HD2  TYR  45           2HD      TYR  45   0.835  14.277  10.933
  342    HE1  TYR  45           1HE      TYR  45   3.913  12.406   7.584
  343    HE2  TYR  45           2HE      TYR  45   2.362  15.765   9.708
  344    HH   TYR  45           HH       TYR  45   3.609  15.785   7.591
  345    H    ASP  46           H        ASP  46   3.643  10.632  10.644
  346    HA   ASP  46           HA       ASP  46   4.488  11.476  13.336
  347   1HB   ASP  46          2HB       ASP  46   5.310   9.206  12.864
  348   2HB   ASP  46          1HB       ASP  46   6.047   9.777  11.371
  349    H    ASP  47           H        ASP  47   4.142  13.649  12.593
  350    HA   ASP  47           HA       ASP  47   5.087  14.883  10.353
  351   1HB   ASP  47          2HB       ASP  47   5.076  16.017  13.155
  352   2HB   ASP  47          1HB       ASP  47   5.187  16.966  11.676
  353    H    ALA  48           H        ALA  48   6.945  14.037  13.223
  354    HA   ALA  48           HA       ALA  48   9.244  15.479  12.852
  355   1HB   ALA  48          1HB       ALA  48  10.150  14.166  14.442
  356   2HB   ALA  48          2HB       ALA  48   9.670  12.672  13.637
  357   3HB   ALA  48          3HB       ALA  48   8.495  13.577  14.590
  358    H    THR  49           H        THR  49   8.229  12.609  11.098
  359    HA   THR  49           HA       THR  49  10.574  12.957   9.350
  360    HB   THR  49           HB       THR  49  10.638  10.509   9.024
  361    HG1  THR  49           1HG      THR  49   9.255   9.221   9.987
  362   1HG2  THR  49          1HG2      THR  49  12.194  11.239  10.620
  363   2HG2  THR  49          2HG2      THR  49  11.365   9.865  11.352
  364   3HG2  THR  49          3HG2      THR  49  10.942  11.508  11.833
  365    H    LYS  50           H        LYS  50   7.488  13.561   9.319
  366    HA   LYS  50           HA       LYS  50   5.805  13.580   7.767
  367   1HB   LYS  50          2HB       LYS  50   8.284  13.491   6.081
  368   2HB   LYS  50          1HB       LYS  50   6.703  13.452   5.322
  369   1HG   LYS  50          2HG       LYS  50   7.486  15.702   5.326
  370   2HG   LYS  50          1HG       LYS  50   6.162  15.575   6.482
  371   1HD   LYS  50          2HD       LYS  50   7.649  15.579   8.320
  372   2HD   LYS  50          1HD       LYS  50   9.056  15.409   7.267
  373   1HE   LYS  50          2HE       LYS  50   8.605  17.615   6.312
  374   2HE   LYS  50          1HE       LYS  50   7.192  17.780   7.353
  375   1HZ   LYS  50          1HZ       LYS  50   9.477  18.807   8.031
  376   2HZ   LYS  50          2HZ       LYS  50   9.798  17.244   8.591
  377   3HZ   LYS  50          3HZ       LYS  50   8.475  18.103   9.199
  378    H    THR  51           H        THR  51   6.651  11.000   8.896
  379    HA   THR  51           HA       THR  51   5.966   9.199   6.687
  380    HB   THR  51           HB       THR  51   7.208   8.578   9.370
  381    HG1  THR  51           1HG      THR  51   8.257   8.924   6.779
  382   1HG2  THR  51          1HG2      THR  51   7.512   6.366   8.699
  383   2HG2  THR  51          2HG2      THR  51   7.075   6.718   7.027
  384   3HG2  THR  51          3HG2      THR  51   5.838   6.728   8.283
  385    H    PHE  52           H        PHE  52   4.183   8.008   6.679
  386    HA   PHE  52           HA       PHE  52   2.357   8.216   8.986
  387   1HB   PHE  52          2HB       PHE  52   1.632   7.608   6.108
  388   2HB   PHE  52          1HB       PHE  52   0.519   7.924   7.433
  389    HD1  PHE  52           1HD      PHE  52  -0.463   9.988   7.475
  390    HD2  PHE  52           2HD      PHE  52   3.415   9.596   5.763
  391    HE1  PHE  52           1HE      PHE  52  -0.494  12.373   6.864
  392    HE2  PHE  52           2HE      PHE  52   3.392  11.980   5.159
  393    HZ   PHE  52           HZ       PHE  52   1.437  13.371   5.710
  394    H    THR  53           H        THR  53   1.447   6.303   9.805
  395    HA   THR  53           HA       THR  53   2.465   3.826   8.578
  396    HB   THR  53           HB       THR  53   2.201   2.909  10.998
  397    HG1  THR  53           1HG      THR  53   2.551   4.491  12.569
  398   1HG2  THR  53          1HG2      THR  53   4.404   4.354   9.755
  399   2HG2  THR  53          2HG2      THR  53   4.380   2.791  10.575
  400   3HG2  THR  53          3HG2      THR  53   4.489   4.282  11.515
  401    H    VAL  54           H        VAL  54   1.000   2.528   7.811
  402    HA   VAL  54           HA       VAL  54  -1.781   2.794   8.714
  403    HB   VAL  54           HB       VAL  54  -0.697   1.470   6.210
  404   1HG1  VAL  54          1HG1      VAL  54  -2.762   0.420   6.990
  405   2HG1  VAL  54          2HG1      VAL  54  -3.036   1.337   5.509
  406   3HG1  VAL  54          3HG1      VAL  54  -3.546   1.999   7.061
  407   1HG2  VAL  54          1HG2      VAL  54  -0.424   3.735   5.824
  408   2HG2  VAL  54          2HG2      VAL  54  -1.845   4.175   6.771
  409   3HG2  VAL  54          3HG2      VAL  54  -2.039   3.435   5.183
  410    H    THR  55           H        THR  55  -2.211   1.450  10.337
  411    HA   THR  55           HA       THR  55  -1.065  -1.250  10.296
  412    HB   THR  55           HB       THR  55  -2.406   0.189  12.586
  413    HG1  THR  55           1HG      THR  55  -0.352   1.076  11.864
  414   1HG2  THR  55          1HG2      THR  55  -1.330  -1.494  13.992
  415   2HG2  THR  55          2HG2      THR  55  -0.757  -2.326  12.545
  416   3HG2  THR  55          3HG2      THR  55  -2.487  -2.212  12.872
  417    H    GLU  56           H        GLU  56  -2.306  -2.876   9.616
  418    HA   GLU  56           HA       GLU  56  -5.116  -2.491   9.197
  419   1HB   GLU  56          2HB       GLU  56  -5.130  -4.718   8.291
  420   2HB   GLU  56          1HB       GLU  56  -3.684  -3.897   7.722
  421   1HG   GLU  56          2HG       GLU  56  -2.374  -5.055   9.446
  422   2HG   GLU  56          1HG       GLU  56  -3.829  -5.909   9.953
  423   1H    MET   1          1HT       MET   1   5.286  18.291  -1.761
  424   2H    MET   1          2HT       MET   1   6.714  18.684  -2.579
  425   3H    MET   1          3HT       MET   1   6.175  19.659  -1.307
  426    HA   MET   1           HA       MET   1   8.076  18.009  -0.876
  427   1HB   MET   1          2HB       MET   1   6.972  19.358   0.836
  428   2HB   MET   1          1HB       MET   1   5.625  18.229   0.890
  429   1HG   MET   1          2HG       MET   1   7.087  17.902   2.781
  430   2HG   MET   1          1HG       MET   1   7.118  16.489   1.730
  431   1HE   MET   1          1HE       MET   1   9.325  15.645   2.987
  432   2HE   MET   1          2HE       MET   1   9.262  17.074   4.020
  433   3HE   MET   1          3HE       MET   1  10.763  16.647   3.196
  434    H    GLN   2           H        GLN   2   8.539  15.890  -0.234
  435    HA   GLN   2           HA       GLN   2   6.616  13.891  -1.192
  436   1HB   GLN   2          2HB       GLN   2   8.793  13.859  -2.317
  437   2HB   GLN   2          1HB       GLN   2   9.605  13.675  -0.768
  438   1HG   GLN   2          2HG       GLN   2   8.526  11.507  -0.459
  439   2HG   GLN   2          1HG       GLN   2   7.709  11.692  -2.011
  440   1HE2  GLN   2          1HE2      GLN   2  10.194  10.203  -0.551
  441   2HE2  GLN   2          2HE2      GLN   2  11.268  10.004  -1.889
  442    H    TYR   3           H        TYR   3   5.989  12.195   0.107
  443    HA   TYR   3           HA       TYR   3   6.959  12.251   2.885
  444   1HB   TYR   3          2HB       TYR   3   4.103  11.973   1.931
  445   2HB   TYR   3          1HB       TYR   3   4.622  11.666   3.588
  446    HD1  TYR   3           1HD      TYR   3   4.762  13.421   5.122
  447    HD2  TYR   3           2HD      TYR   3   4.534  14.314   0.971
  448    HE1  TYR   3           1HE      TYR   3   4.519  15.807   5.661
  449    HE2  TYR   3           2HE      TYR   3   4.287  16.706   1.494
  450    HH   TYR   3           HH       TYR   3   3.590  17.847   4.594
  451    H    LYS   4           H        LYS   4   7.143  10.300   3.944
  452    HA   LYS   4           HA       LYS   4   7.129   7.946   2.197
  453   1HB   LYS   4          2HB       LYS   4   9.241   8.455   3.325
  454   2HB   LYS   4          1HB       LYS   4   8.435   8.409   4.887
  455   1HG   LYS   4          2HG       LYS   4   9.641   6.368   4.573
  456   2HG   LYS   4          1HG       LYS   4   7.912   6.020   4.499
  457   1HD   LYS   4          2HD       LYS   4   9.038   4.804   2.750
  458   2HD   LYS   4          1HD       LYS   4   8.054   6.076   2.027
  459   1HE   LYS   4          2HE       LYS   4  10.252   5.932   0.965
  460   2HE   LYS   4          1HE       LYS   4  10.022   7.483   1.772
  461   1HZ   LYS   4          1HZ       LYS   4  11.364   6.736   3.598
  462   2HZ   LYS   4          2HZ       LYS   4  12.229   6.500   2.163
  463   3HZ   LYS   4          3HZ       LYS   4  11.500   5.183   2.936
  464    H    VAL   5           H        VAL   5   5.254   6.857   2.264
  465    HA   VAL   5           HA       VAL   5   3.756   6.736   4.768
  466    HB   VAL   5           HB       VAL   5   2.974   5.709   2.035
  467   1HG1  VAL   5          1HG1      VAL   5   0.656   5.853   3.097
  468   2HG1  VAL   5          2HG1      VAL   5   1.502   5.942   4.642
  469   3HG1  VAL   5          3HG1      VAL   5   1.698   4.527   3.611
  470   1HG2  VAL   5          1HG2      VAL   5   2.854   8.376   3.249
  471   2HG2  VAL   5          2HG2      VAL   5   1.339   7.821   2.536
  472   3HG2  VAL   5          3HG2      VAL   5   2.802   7.896   1.553
  473    H    ILE   6           H        ILE   6   3.783   5.028   6.042
  474    HA   ILE   6           HA       ILE   6   5.087   2.573   5.100
  475    HB   ILE   6           HB       ILE   6   4.602   3.569   7.912
  476   1HG1  ILE   6          2HG1      ILE   6   7.152   3.282   6.306
  477   2HG1  ILE   6          1HG1      ILE   6   6.352   4.800   6.704
  478   1HG2  ILE   6          1HG2      ILE   6   4.728   1.413   8.476
  479   2HG2  ILE   6          2HG2      ILE   6   6.444   1.548   8.088
  480   3HG2  ILE   6          3HG2      ILE   6   5.312   0.935   6.881
  481   1HD1  ILE   6          1HD1      ILE   6   7.708   2.887   8.581
  482   2HD1  ILE   6          2HD1      ILE   6   6.704   4.233   9.120
  483   3HD1  ILE   6          3HD1      ILE   6   8.173   4.545   8.193
  484    H    LEU   7           H        LEU   7   3.825   0.912   4.624
  485    HA   LEU   7           HA       LEU   7   1.110   0.806   5.728
  486   1HB   LEU   7          2HB       LEU   7   2.180  -1.017   3.591
  487   2HB   LEU   7          1HB       LEU   7   0.520  -0.542   3.898
  488    HG   LEU   7           HG       LEU   7   2.682   1.138   2.657
  489   1HD1  LEU   7          1HD1      LEU   7   1.610  -0.498   1.190
  490   2HD1  LEU   7          2HD1      LEU   7   1.196   1.153   0.739
  491   3HD1  LEU   7          3HD1      LEU   7   0.029   0.161   1.612
  492   1HD2  LEU   7          1HD2      LEU   7   1.284   2.437   4.247
  493   2HD2  LEU   7          2HD2      LEU   7  -0.140   1.963   3.324
  494   3HD2  LEU   7          3HD2      LEU   7   1.112   2.951   2.569
  495    H    ASN   8           H        ASN   8   1.640   0.065   7.788
  496    HA   ASN   8           HA       ASN   8   3.101  -2.438   8.044
  497   1HB   ASN   8          2HB       ASN   8   3.603  -0.508   9.521
  498   2HB   ASN   8          1HB       ASN   8   1.978  -0.627  10.187
  499   1HD2  ASN   8          1HD2      ASN   8   5.028  -1.250  10.876
  500   2HD2  ASN   8          2HD2      ASN   8   4.866  -2.651  11.874
  501    H    GLY   9           H        GLY   9   1.883  -4.171   7.584
  502   1HA   GLY   9          2HA       GLY   9  -0.673  -4.445   9.037
  503   2HA   GLY   9          1HA       GLY   9  -0.394  -5.131   7.443
  504    H    LYS  10           H        LYS  10  -1.180  -6.501   9.898
  505    HA   LYS  10           HA       LYS  10   0.838  -7.815  11.201
  506   1HB   LYS  10          2HB       LYS  10  -1.916  -8.721  10.414
  507   2HB   LYS  10          1HB       LYS  10  -0.842  -9.763  11.334
  508   1HG   LYS  10          2HG       LYS  10  -2.371  -8.604  12.805
  509   2HG   LYS  10          1HG       LYS  10  -0.715  -8.074  13.099
  510   1HD   LYS  10          2HD       LYS  10  -1.108  -6.057  11.804
  511   2HD   LYS  10          1HD       LYS  10  -2.743  -6.599  11.420
  512   1HE   LYS  10          2HE       LYS  10  -2.745  -4.954  13.228
  513   2HE   LYS  10          1HE       LYS  10  -3.337  -6.520  13.780
  514   1HZ   LYS  10          1HZ       LYS  10  -1.549  -5.147  15.123
  515   2HZ   LYS  10          2HZ       LYS  10  -0.486  -5.973  14.100
  516   3HZ   LYS  10          3HZ       LYS  10  -1.540  -6.840  15.098
  517    H    THR  11           H        THR  11  -0.780  -8.911   8.221
  518    HA   THR  11           HA       THR  11   1.311 -10.904   7.823
  519    HB   THR  11           HB       THR  11  -0.268 -11.633   5.960
  520    HG1  THR  11           1HG      THR  11  -2.448 -10.864   6.315
  521   1HG2  THR  11          1HG2      THR  11  -1.162 -13.111   7.357
  522   2HG2  THR  11          2HG2      THR  11  -1.986 -11.855   8.281
  523   3HG2  THR  11          3HG2      THR  11  -0.306 -12.255   8.640
  524    H    LEU  12           H        LEU  12   0.666  -7.763   6.916
  525    HA   LEU  12           HA       LEU  12   2.388  -8.054   4.563
  526   1HB   LEU  12          2HB       LEU  12   0.093  -7.811   3.776
  527   2HB   LEU  12          1HB       LEU  12  -0.099  -6.356   4.733
  528    HG   LEU  12           HG       LEU  12   1.374  -5.132   3.339
  529   1HD1  LEU  12          1HD1      LEU  12   2.172  -6.723   1.259
  530   2HD1  LEU  12          2HD1      LEU  12   2.340  -7.786   2.653
  531   3HD1  LEU  12          3HD1      LEU  12   3.173  -6.240   2.630
  532   1HD2  LEU  12          1HD2      LEU  12   0.131  -6.539   1.115
  533   2HD2  LEU  12          2HD2      LEU  12  -0.090  -4.881   1.674
  534   3HD2  LEU  12          3HD2      LEU  12  -0.990  -6.195   2.433
  535    H    LYS  13           H        LYS  13   3.983  -6.574   4.394
  536    HA   LYS  13           HA       LYS  13   3.851  -4.133   5.987
  537   1HB   LYS  13          2HB       LYS  13   6.100  -6.138   6.240
  538   2HB   LYS  13          1HB       LYS  13   6.098  -4.526   6.944
  539   1HG   LYS  13          2HG       LYS  13   4.171  -5.125   8.318
  540   2HG   LYS  13          1HG       LYS  13   4.168  -6.740   7.610
  541   1HD   LYS  13          2HD       LYS  13   6.406  -7.141   8.511
  542   2HD   LYS  13          1HD       LYS  13   6.417  -5.522   9.211
  543   1HE   LYS  13          2HE       LYS  13   5.855  -7.206  10.887
  544   2HE   LYS  13          1HE       LYS  13   4.506  -6.105  10.611
  545   1HZ   LYS  13          1HZ       LYS  13   3.233  -7.738   9.779
  546   2HZ   LYS  13          2HZ       LYS  13   4.277  -8.760  10.632
  547   3HZ   LYS  13          3HZ       LYS  13   4.514  -8.500   8.977
  548    H    GLY  14           H        GLY  14   5.065  -2.439   5.159
  549   1HA   GLY  14          2HA       GLY  14   7.131  -2.721   3.266
  550   2HA   GLY  14          1HA       GLY  14   5.615  -2.488   2.414
  551    H    GLU  15           H        GLU  15   6.902  -0.596   1.653
  552    HA   GLU  15           HA       GLU  15   6.145   1.727   3.235
  553   1HB   GLU  15          2HB       GLU  15   8.975   1.270   2.265
  554   2HB   GLU  15          1HB       GLU  15   8.373   2.772   2.957
  555   1HG   GLU  15          2HG       GLU  15   7.910   1.609   5.061
  556   2HG   GLU  15          1HG       GLU  15   8.543   0.117   4.366
  557    H    THR  16           H        THR  16   5.679   3.511   2.026
  558    HA   THR  16           HA       THR  16   6.221   3.445  -0.840
  559    HB   THR  16           HB       THR  16   4.086   2.552  -0.973
  560    HG1  THR  16           1HG      THR  16   3.508   5.294  -0.843
  561   1HG2  THR  16          1HG2      THR  16   3.717   3.311   1.631
  562   2HG2  THR  16          2HG2      THR  16   2.511   2.564   0.589
  563   3HG2  THR  16          3HG2      THR  16   2.564   4.317   0.756
  564    H    THR  17           H        THR  17   5.531   5.594  -1.893
  565    HA   THR  17           HA       THR  17   5.706   7.833  -0.021
  566    HB   THR  17           HB       THR  17   7.517   8.876  -1.360
  567    HG1  THR  17           1HG      THR  17   7.738   6.316  -2.550
  568   1HG2  THR  17          1HG2      THR  17   8.281   7.849   0.608
  569   2HG2  THR  17          2HG2      THR  17   9.360   7.309  -0.678
  570   3HG2  THR  17          3HG2      THR  17   8.100   6.234  -0.074
  571    H    THR  18           H        THR  18   4.245   9.289  -0.503
  572    HA   THR  18           HA       THR  18   3.277   9.567  -3.287
  573    HB   THR  18           HB       THR  18   1.566   9.005  -1.567
  574    HG1  THR  18           1HG      THR  18   1.086  10.365  -3.405
  575   1HG2  THR  18          1HG2      THR  18   0.856  10.879  -0.043
  576   2HG2  THR  18          2HG2      THR  18   2.443  11.592  -0.330
  577   3HG2  THR  18          3HG2      THR  18   2.313  10.004   0.424
  578    H    GLU  19           H        GLU  19   3.238  11.617  -4.235
  579    HA   GLU  19           HA       GLU  19   4.888  13.646  -2.878
  580   1HB   GLU  19          2HB       GLU  19   5.734  12.887  -5.053
  581   2HB   GLU  19          1HB       GLU  19   4.209  13.323  -5.812
  582   1HG   GLU  19          2HG       GLU  19   5.899  14.997  -6.255
  583   2HG   GLU  19          1HG       GLU  19   4.601  15.668  -5.268
  584    H    ALA  20           H        ALA  20   3.704  15.179  -1.871
  585    HA   ALA  20           HA       ALA  20   1.479  16.374  -3.337
  586   1HB   ALA  20          1HB       ALA  20  -0.121  16.026  -1.724
  587   2HB   ALA  20          2HB       ALA  20   1.068  15.767  -0.447
  588   3HB   ALA  20          3HB       ALA  20   0.779  14.511  -1.652
  589    H    VAL  21           H        VAL  21   0.987  18.465  -2.765
  590    HA   VAL  21           HA       VAL  21   3.029  20.187  -2.133
  591    HB   VAL  21           HB       VAL  21   0.122  20.749  -1.549
  592   1HG1  VAL  21          1HG1      VAL  21   2.414  22.563  -2.289
  593   2HG1  VAL  21          2HG1      VAL  21   1.636  22.448  -0.710
  594   3HG1  VAL  21          3HG1      VAL  21   0.733  23.063  -2.096
  595   1HG2  VAL  21          1HG2      VAL  21   1.634  20.661  -4.136
  596   2HG2  VAL  21          2HG2      VAL  21   0.220  21.696  -3.938
  597   3HG2  VAL  21          3HG2      VAL  21   0.070  19.950  -3.736
  598    H    ASP  22           H        ASP  22   1.005  18.422   0.068
  599    HA   ASP  22           HA       ASP  22   2.659  19.260   2.282
  600   1HB   ASP  22          2HB       ASP  22   0.853  20.084   3.696
  601   2HB   ASP  22          1HB       ASP  22   0.973  21.051   2.230
  602    H    ALA  23           H        ALA  23   1.645  18.254   4.410
  603    HA   ALA  23           HA       ALA  23   1.746  15.474   4.078
  604   1HB   ALA  23          1HB       ALA  23   2.363  16.692   6.151
  605   2HB   ALA  23          2HB       ALA  23   1.298  15.313   6.432
  606   3HB   ALA  23          3HB       ALA  23   0.646  16.951   6.461
  607    H    ALA  24           H        ALA  24  -1.011  17.631   4.588
  608    HA   ALA  24           HA       ALA  24  -2.963  15.603   4.804
  609   1HB   ALA  24          1HB       ALA  24  -3.716  17.678   5.524
  610   2HB   ALA  24          2HB       ALA  24  -4.504  17.524   3.955
  611   3HB   ALA  24          3HB       ALA  24  -3.058  18.520   4.121
  612    H    THR  25           H        THR  25  -2.011  17.611   1.994
  613    HA   THR  25           HA       THR  25  -3.606  16.429   0.081
  614    HB   THR  25           HB       THR  25  -1.810  17.086  -1.531
  615    HG1  THR  25           1HG      THR  25  -0.396  17.395   0.854
  616   1HG2  THR  25          1HG2      THR  25  -3.003  18.924   0.404
  617   2HG2  THR  25          2HG2      THR  25  -2.984  18.980  -1.358
  618   3HG2  THR  25          3HG2      THR  25  -1.586  19.543  -0.443
  619    H    ALA  26           H        ALA  26  -0.417  15.470   1.276
  620    HA   ALA  26           HA       ALA  26  -0.045  13.222  -0.360
  621   1HB   ALA  26          1HB       ALA  26   1.781  14.141   0.936
  622   2HB   ALA  26          2HB       ALA  26   1.526  12.457   1.396
  623   3HB   ALA  26          3HB       ALA  26   0.948  13.755   2.442
  624    H    GLU  27           H        GLU  27  -1.362  13.477   2.961
  625    HA   GLU  27           HA       GLU  27  -2.024  10.818   3.321
  626   1HB   GLU  27          2HB       GLU  27  -2.127  12.544   5.094
  627   2HB   GLU  27          1HB       GLU  27  -3.573  13.197   4.335
  628   1HG   GLU  27          2HG       GLU  27  -4.729  11.089   4.717
  629   2HG   GLU  27          1HG       GLU  27  -3.283  10.436   5.485
  630    H    LYS  28           H        LYS  28  -3.971  13.437   1.904
  631    HA   LYS  28           HA       LYS  28  -6.287  11.919   1.431
  632   1HB   LYS  28          2HB       LYS  28  -5.205  14.318  -0.060
  633   2HB   LYS  28          1HB       LYS  28  -6.828  13.675  -0.250
  634   1HG   LYS  28          2HG       LYS  28  -5.656  14.829   2.272
  635   2HG   LYS  28          1HG       LYS  28  -6.820  15.615   1.207
  636   1HD   LYS  28          2HD       LYS  28  -7.337  13.014   2.644
  637   2HD   LYS  28          1HD       LYS  28  -7.803  14.593   3.272
  638   1HE   LYS  28          2HE       LYS  28  -9.723  13.684   2.223
  639   2HE   LYS  28          1HE       LYS  28  -9.106  14.936   1.147
  640   1HZ   LYS  28          1HZ       LYS  28  -8.752  13.456  -0.458
  641   2HZ   LYS  28          2HZ       LYS  28  -9.702  12.384   0.440
  642   3HZ   LYS  28          3HZ       LYS  28  -8.019  12.343   0.584
  643    H    VAL  29           H        VAL  29  -3.460  12.599  -0.600
  644    HA   VAL  29           HA       VAL  29  -4.307  11.247  -2.894
  645    HB   VAL  29           HB       VAL  29  -1.486  11.563  -1.844
  646   1HG1  VAL  29          1HG1      VAL  29  -1.154   9.999  -3.468
  647   2HG1  VAL  29          2HG1      VAL  29  -1.125  11.456  -4.461
  648   3HG1  VAL  29          3HG1      VAL  29  -2.588  10.476  -4.376
  649   1HG2  VAL  29          1HG2      VAL  29  -2.359  13.228  -4.083
  650   2HG2  VAL  29          2HG2      VAL  29  -1.459  13.661  -2.630
  651   3HG2  VAL  29          3HG2      VAL  29  -3.218  13.549  -2.578
  652    H    VAL  30           H        VAL  30  -2.707  10.113   0.027
  653    HA   VAL  30           HA       VAL  30  -2.296   7.445  -0.863
  654    HB   VAL  30           HB       VAL  30  -2.622   8.474   1.964
  655   1HG1  VAL  30          1HG1      VAL  30  -1.769   6.466   2.748
  656   2HG1  VAL  30          2HG1      VAL  30  -1.067   6.041   1.187
  657   3HG1  VAL  30          3HG1      VAL  30  -2.811   5.938   1.425
  658   1HG2  VAL  30          1HG2      VAL  30  -0.722   9.299   0.265
  659   2HG2  VAL  30          2HG2      VAL  30   0.046   7.838   0.882
  660   3HG2  VAL  30          3HG2      VAL  30  -0.454   9.108   1.997
  661    H    LYS  31           H        LYS  31  -4.822   9.033   1.126
  662    HA   LYS  31           HA       LYS  31  -6.490   6.926   1.653
  663   1HB   LYS  31          2HB       LYS  31  -7.315   9.703   0.780
  664   2HB   LYS  31          1HB       LYS  31  -8.394   8.528   1.510
  665   1HG   LYS  31          2HG       LYS  31  -6.021   9.834   2.812
  666   2HG   LYS  31          1HG       LYS  31  -7.721  10.158   3.137
  667   1HD   LYS  31          2HD       LYS  31  -7.710   7.541   3.615
  668   2HD   LYS  31          1HD       LYS  31  -6.016   7.890   3.963
  669   1HE   LYS  31          2HE       LYS  31  -8.368   9.299   5.207
  670   2HE   LYS  31          1HE       LYS  31  -7.427   8.019   5.972
  671   1HZ   LYS  31          1HZ       LYS  31  -6.540  10.748   5.250
  672   2HZ   LYS  31          2HZ       LYS  31  -5.449   9.511   5.630
  673   3HZ   LYS  31          3HZ       LYS  31  -6.571  10.030   6.782
  674    H    GLN  32           H        GLN  32  -6.508   8.966  -1.239
  675    HA   GLN  32           HA       GLN  32  -8.495   7.555  -2.644
  676   1HB   GLN  32          2HB       GLN  32  -7.689   9.832  -3.251
  677   2HB   GLN  32          1HB       GLN  32  -6.176   9.121  -3.798
  678   1HG   GLN  32          2HG       GLN  32  -7.555   9.554  -5.697
  679   2HG   GLN  32          1HG       GLN  32  -7.431   7.814  -5.471
  680   1HE2  GLN  32          1HE2      GLN  32  -9.470   9.130  -3.137
  681   2HE2  GLN  32          2HE2      GLN  32 -10.976   8.812  -3.916
  682    H    PHE  33           H        PHE  33  -5.019   7.157  -2.428
  683    HA   PHE  33           HA       PHE  33  -4.543   5.336  -4.457
  684   1HB   PHE  33          2HB       PHE  33  -2.854   6.439  -2.922
  685   2HB   PHE  33          1HB       PHE  33  -3.277   5.239  -1.709
  686    HD1  PHE  33           1HD      PHE  33  -2.217   5.428  -5.272
  687    HD2  PHE  33           2HD      PHE  33  -1.978   3.345  -1.558
  688    HE1  PHE  33           1HE      PHE  33  -0.583   3.864  -6.243
  689    HE2  PHE  33           2HE      PHE  33  -0.336   1.795  -2.534
  690    HZ   PHE  33           HZ       PHE  33   0.360   2.062  -4.883
  691    H    PHE  34           H        PHE  34  -5.027   4.521  -1.056
  692    HA   PHE  34           HA       PHE  34  -5.536   1.762  -1.546
  693   1HB   PHE  34          2HB       PHE  34  -6.110   3.422   0.912
  694   2HB   PHE  34          1HB       PHE  34  -6.114   1.656   0.839
  695    HD1  PHE  34           1HD      PHE  34  -3.844   0.923  -0.660
  696    HD2  PHE  34           2HD      PHE  34  -4.260   4.153   2.068
  697    HE1  PHE  34           1HE      PHE  34  -1.416   0.915  -0.289
  698    HE2  PHE  34           2HE      PHE  34  -1.831   4.144   2.458
  699    HZ   PHE  34           HZ       PHE  34  -0.414   2.523   1.267
  700    H    ASN  35           H        ASN  35  -7.608   4.554  -1.010
  701    HA   ASN  35           HA       ASN  35 -10.091   3.344  -0.745
  702   1HB   ASN  35          2HB       ASN  35  -9.732   5.766  -0.562
  703   2HB   ASN  35          1HB       ASN  35  -9.360   5.855  -2.280
  704   1HD2  ASN  35          1HD2      ASN  35 -11.536   6.817  -0.306
  705   2HD2  ASN  35          2HD2      ASN  35 -12.997   6.560  -1.197
  706    H    ASP  36           H        ASP  36  -8.144   3.986  -3.570
  707    HA   ASP  36           HA       ASP  36 -10.123   2.822  -5.371
  708   1HB   ASP  36          2HB       ASP  36  -7.471   4.150  -5.960
  709   2HB   ASP  36          1HB       ASP  36  -8.610   3.582  -7.176
  710    H    ASN  37           H        ASN  37  -7.070   1.956  -3.891
  711    HA   ASN  37           HA       ASN  37  -6.524  -0.183  -5.750
  712   1HB   ASN  37          2HB       ASN  37  -5.364   0.427  -3.021
  713   2HB   ASN  37          1HB       ASN  37  -4.820  -0.892  -4.049
  714   1HD2  ASN  37          1HD2      ASN  37  -3.636   1.723  -2.994
  715   2HD2  ASN  37          2HD2      ASN  37  -2.916   2.422  -4.402
  716    H    GLY  38           H        GLY  38  -7.907   0.187  -2.571
  717   1HA   GLY  38          2HA       GLY  38  -8.355  -1.831  -1.187
  718   2HA   GLY  38          1HA       GLY  38  -9.795  -1.132  -1.891
  719    H    VAL  39           H        VAL  39 -11.130  -2.520  -2.722
  720    HA   VAL  39           HA       VAL  39 -10.358  -5.244  -3.085
  721    HB   VAL  39           HB       VAL  39 -13.007  -3.876  -3.414
  722   1HG1  VAL  39          1HG1      VAL  39 -13.625  -6.485  -3.053
  723   2HG1  VAL  39          2HG1      VAL  39 -12.163  -6.633  -4.027
  724   3HG1  VAL  39          3HG1      VAL  39 -13.535  -5.705  -4.632
  725   1HG2  VAL  39          1HG2      VAL  39 -13.245  -4.115  -1.219
  726   2HG2  VAL  39          2HG2      VAL  39 -11.546  -4.580  -1.144
  727   3HG2  VAL  39          3HG2      VAL  39 -12.792  -5.817  -1.299
  728    H    ASP  40           H        ASP  40 -11.908  -2.954  -5.400
  729    HA   ASP  40           HA       ASP  40 -11.411  -4.867  -7.507
  730   1HB   ASP  40          2HB       ASP  40 -12.761  -2.169  -7.552
  731   2HB   ASP  40          1HB       ASP  40 -12.676  -3.278  -8.917
  732    H    GLY  41           H        GLY  41  -9.093  -3.382  -6.279
  733   1HA   GLY  41          2HA       GLY  41  -8.169  -1.460  -8.137
  734   2HA   GLY  41          1HA       GLY  41  -7.167  -2.357  -7.009
  735    H    GLU  42           H        GLU  42  -6.801  -1.597  -9.889
  736    HA   GLU  42           HA       GLU  42  -6.850  -4.089 -11.348
  737   1HB   GLU  42          2HB       GLU  42  -5.545  -1.444 -12.022
  738   2HB   GLU  42          1HB       GLU  42  -5.697  -2.807 -13.121
  739   1HG   GLU  42          2HG       GLU  42  -8.134  -2.620 -13.007
  740   2HG   GLU  42          1HG       GLU  42  -7.971  -1.241 -11.920
  741    H    TRP  43           H        TRP  43  -5.544  -5.561 -10.287
  742    HA   TRP  43           HA       TRP  43  -2.734  -4.797  -9.860
  743   1HB   TRP  43          2HB       TRP  43  -4.174  -7.225  -8.796
  744   2HB   TRP  43          1HB       TRP  43  -2.578  -6.659  -8.336
  745    HD1  TRP  43           HD       TRP  43  -5.046  -3.832  -8.454
  746    HE1  TRP  43           1HE      TRP  43  -5.778  -3.233  -6.060
  747    HE3  TRP  43           3HE      TRP  43  -3.066  -7.830  -5.992
  748    HZ2  TRP  43           2HZ      TRP  43  -5.542  -4.326  -3.470
  749    HZ3  TRP  43           3HZ      TRP  43  -3.349  -7.979  -3.563
  750    HH2  TRP  43           HH       TRP  43  -4.562  -6.261  -2.320
  751    H    THR  44           H        THR  44  -1.126  -5.735 -10.968
  752    HA   THR  44           HA       THR  44  -1.777  -8.047 -12.675
  753    HB   THR  44           HB       THR  44   0.120  -7.315 -14.111
  754    HG1  THR  44           1HG      THR  44   1.115  -6.068 -12.354
  755   1HG2  THR  44          1HG2      THR  44  -2.406  -6.110 -13.977
  756   2HG2  THR  44          2HG2      THR  44  -1.305  -6.179 -15.352
  757   3HG2  THR  44          3HG2      THR  44  -1.242  -4.811 -14.241
  758    H    TYR  45           H        TYR  45  -0.394  -9.841 -12.572
  759    HA   TYR  45           HA       TYR  45   1.533  -9.738 -10.347
  760   1HB   TYR  45          2HB       TYR  45  -0.362 -11.232  -9.951
  761   2HB   TYR  45          1HB       TYR  45  -0.003 -12.102 -11.439
  762    HD1  TYR  45           1HD      TYR  45   2.240 -10.931  -8.693
  763    HD2  TYR  45           2HD      TYR  45   0.642 -14.242 -10.834
  764    HE1  TYR  45           1HE      TYR  45   3.717 -12.446  -7.441
  765    HE2  TYR  45           2HE      TYR  45   2.115 -15.766  -9.588
  766    HH   TYR  45           HH       TYR  45   3.331 -15.817  -7.453
  767    H    ASP  46           H        ASP  46   3.533 -10.666 -10.504
  768    HA   ASP  46           HA       ASP  46   4.396 -11.531 -13.184
  769   1HB   ASP  46          2HB       ASP  46   5.265  -9.282 -12.700
  770   2HB   ASP  46          1HB       ASP  46   5.968  -9.871 -11.197
  771    H    ASP  47           H        ASP  47   3.986 -13.696 -12.446
  772    HA   ASP  47           HA       ASP  47   4.871 -14.950 -10.193
  773   1HB   ASP  47          2HB       ASP  47   4.872 -16.085 -12.996
  774   2HB   ASP  47          1HB       ASP  47   4.937 -17.036 -11.515
  775    H    ALA  48           H        ALA  48   6.788 -14.152 -13.037
  776    HA   ALA  48           HA       ALA  48   9.045 -15.649 -12.633
  777   1HB   ALA  48          1HB       ALA  48  10.005 -14.359 -14.210
  778   2HB   ALA  48          2HB       ALA  48   9.551 -12.854 -13.412
  779   3HB   ALA  48          3HB       ALA  48   8.368 -13.730 -14.382
  780    H    THR  49           H        THR  49   8.076 -12.754 -10.894
  781    HA   THR  49           HA       THR  49  10.387 -13.160  -9.113
  782    HB   THR  49           HB       THR  49  10.506 -10.713  -8.786
  783    HG1  THR  49           1HG      THR  49   9.169  -9.392  -9.769
  784   1HG2  THR  49          1HG2      THR  49  12.066 -11.482 -10.360
  785   2HG2  THR  49          2HG2      THR  49  11.282 -10.088 -11.103
  786   3HG2  THR  49          3HG2      THR  49  10.825 -11.721 -11.591
  787    H    LYS  50           H        LYS  50   7.286 -13.688  -9.124
  788    HA   LYS  50           HA       LYS  50   5.582 -13.666  -7.597
  789   1HB   LYS  50          2HB       LYS  50   8.038 -13.637  -5.878
  790   2HB   LYS  50          1HB       LYS  50   6.450 -13.559  -5.140
  791   1HG   LYS  50          2HG       LYS  50   7.176 -15.828  -5.133
  792   2HG   LYS  50          1HG       LYS  50   5.872 -15.668  -6.308
  793   1HD   LYS  50          2HD       LYS  50   7.386 -15.709  -8.125
  794   2HD   LYS  50          1HD       LYS  50   8.781 -15.572  -7.051
  795   1HE   LYS  50          2HE       LYS  50   8.263 -17.767  -6.103
  796   2HE   LYS  50          1HE       LYS  50   6.861 -17.899  -7.165
  797   1HZ   LYS  50          1HZ       LYS  50   9.130 -18.980  -7.812
  798   2HZ   LYS  50          2HZ       LYS  50   9.496 -17.425  -8.366
  799   3HZ   LYS  50          3HZ       LYS  50   8.162 -18.252  -8.992
  800    H    THR  51           H        THR  51   6.506 -11.107  -8.714
  801    HA   THR  51           HA       THR  51   5.835  -9.289  -6.514
  802    HB   THR  51           HB       THR  51   7.129  -8.700  -9.179
  803    HG1  THR  51           1HG      THR  51   8.131  -9.069  -6.574
  804   1HG2  THR  51          1HG2      THR  51   7.479  -6.495  -8.505
  805   2HG2  THR  51          2HG2      THR  51   7.009  -6.836  -6.839
  806   3HG2  THR  51          3HG2      THR  51   5.789  -6.817  -8.112
  807    H    PHE  52           H        PHE  52   4.081  -8.055  -6.531
  808    HA   PHE  52           HA       PHE  52   2.284  -8.219  -8.864
  809   1HB   PHE  52          2HB       PHE  52   1.534  -7.594  -5.996
  810   2HB   PHE  52          1HB       PHE  52   0.432  -7.881  -7.336
  811    HD1  PHE  52           1HD      PHE  52  -0.600  -9.922  -7.393
  812    HD2  PHE  52           2HD      PHE  52   3.262  -9.624  -5.628
  813    HE1  PHE  52           1HE      PHE  52  -0.696 -12.306  -6.784
  814    HE2  PHE  52           2HE      PHE  52   3.173 -12.007  -5.024
  815    HZ   PHE  52           HZ       PHE  52   1.192 -13.351  -5.602
  816    H    THR  53           H        THR  53   1.432  -6.286  -9.696
  817    HA   THR  53           HA       THR  53   2.492  -3.834  -8.454
  818    HB   THR  53           HB       THR  53   2.286  -2.912 -10.878
  819    HG1  THR  53           1HG      THR  53   2.618  -4.501 -12.444
  820   1HG2  THR  53          1HG2      THR  53   4.435  -4.410  -9.603
  821   2HG2  THR  53          2HG2      THR  53   4.460  -2.846 -10.423
  822   3HG2  THR  53          3HG2      THR  53   4.546  -4.339 -11.362
  823    H    VAL  54           H        VAL  54   1.048  -2.502  -7.707
  824    HA   VAL  54           HA       VAL  54  -1.725  -2.699  -8.649
  825    HB   VAL  54           HB       VAL  54  -0.645  -1.401  -6.130
  826   1HG1  VAL  54          1HG1      VAL  54  -2.673  -0.302  -6.939
  827   2HG1  VAL  54          2HG1      VAL  54  -2.990  -1.211  -5.463
  828   3HG1  VAL  54          3HG1      VAL  54  -3.492  -1.860  -7.023
  829   1HG2  VAL  54          1HG2      VAL  54  -0.433  -3.672  -5.740
  830   2HG2  VAL  54          2HG2      VAL  54  -1.850  -4.077  -6.708
  831   3HG2  VAL  54          3HG2      VAL  54  -2.049  -3.333  -5.122
  832    H    THR  55           H        THR  55  -2.100  -1.345 -10.279
  833    HA   THR  55           HA       THR  55  -0.888   1.326 -10.221
  834    HB   THR  55           HB       THR  55  -2.232  -0.080 -12.530
  835    HG1  THR  55           1HG      THR  55  -0.211  -1.014 -11.778
  836   1HG2  THR  55          1HG2      THR  55  -1.096   1.577 -13.919
  837   2HG2  THR  55          2HG2      THR  55  -0.523   2.395 -12.464
  838   3HG2  THR  55          3HG2      THR  55  -2.251   2.323 -12.815
  839    H    GLU  56           H        GLU  56  -2.098   2.981  -9.557
  840    HA   GLU  56           HA       GLU  56  -4.924   2.665  -9.178
  841   1HB   GLU  56          2HB       GLU  56  -4.895   4.893  -8.272
  842   2HB   GLU  56          1HB       GLU  56  -3.478   4.036  -7.683
  843   1HG   GLU  56          2HG       GLU  56  -2.117   5.162  -9.388
  844   2HG   GLU  56          1HG       GLU  56  -3.543   6.051  -9.916
  Start of MODEL   35
    1   1H    MET   1          1HT       MET   1   6.742 -18.450   3.253
    2   2H    MET   1          2HT       MET   1   6.009 -19.538   2.186
    3   3H    MET   1          3HT       MET   1   5.186 -18.139   2.664
    4    HA   MET   1           HA       MET   1   7.750 -18.046   1.200
    5   1HB   MET   1          2HB       MET   1   6.228 -19.273  -0.200
    6   2HB   MET   1          1HB       MET   1   4.922 -18.146   0.137
    7   1HG   MET   1          2HG       MET   1   5.755 -17.732  -2.064
    8   2HG   MET   1          1HG       MET   1   6.200 -16.380  -1.027
    9   1HE   MET   1          1HE       MET   1   7.459 -19.926  -1.753
   10   2HE   MET   1          2HE       MET   1   9.074 -19.686  -2.423
   11   3HE   MET   1          3HE       MET   1   7.652 -19.267  -3.379
   12    H    GLN   2           H        GLN   2   8.446 -16.032   0.834
   13    HA   GLN   2           HA       GLN   2   6.853 -13.818   1.894
   14   1HB   GLN   2          2HB       GLN   2   9.169 -14.119   2.748
   15   2HB   GLN   2          1HB       GLN   2   9.778 -13.904   1.114
   16   1HG   GLN   2          2HG       GLN   2  10.061 -11.861   2.299
   17   2HG   GLN   2          1HG       GLN   2   8.800 -11.635   1.092
   18   1HE2  GLN   2          1HE2      GLN   2   7.603 -13.475   3.636
   19   2HE2  GLN   2          2HE2      GLN   2   6.844 -12.210   4.525
   20    H    TYR   3           H        TYR   3   5.981 -12.324   0.564
   21    HA   TYR   3           HA       TYR   3   6.786 -12.421  -2.270
   22   1HB   TYR   3          2HB       TYR   3   4.070 -11.849  -1.078
   23   2HB   TYR   3          1HB       TYR   3   4.466 -11.645  -2.781
   24    HD1  TYR   3           1HD      TYR   3   4.549 -13.506  -4.254
   25    HD2  TYR   3           2HD      TYR   3   4.117 -14.129  -0.068
   26    HE1  TYR   3           1HE      TYR   3   4.016 -15.871  -4.666
   27    HE2  TYR   3           2HE      TYR   3   3.588 -16.492  -0.471
   28    HH   TYR   3           HH       TYR   3   3.821 -18.184  -2.101
   29    H    LYS   4           H        LYS   4   6.979 -10.527  -3.414
   30    HA   LYS   4           HA       LYS   4   7.202  -8.101  -1.766
   31   1HB   LYS   4          2HB       LYS   4   9.284  -8.981  -2.851
   32   2HB   LYS   4          1HB       LYS   4   8.535  -8.698  -4.413
   33   1HG   LYS   4          2HG       LYS   4  10.054  -6.904  -3.876
   34   2HG   LYS   4          1HG       LYS   4   8.393  -6.303  -3.898
   35   1HD   LYS   4          2HD       LYS   4   8.292  -6.326  -1.500
   36   2HD   LYS   4          1HD       LYS   4   9.863  -7.121  -1.396
   37   1HE   LYS   4          2HE       LYS   4  10.941  -5.167  -2.353
   38   2HE   LYS   4          1HE       LYS   4   9.379  -4.376  -2.543
   39   1HZ   LYS   4          1HZ       LYS   4  10.359  -3.521  -0.588
   40   2HZ   LYS   4          2HZ       LYS   4  10.764  -5.059  -0.014
   41   3HZ   LYS   4          3HZ       LYS   4   9.144  -4.578  -0.073
   42    H    VAL   5           H        VAL   5   5.247  -7.120  -1.957
   43    HA   VAL   5           HA       VAL   5   3.991  -6.934  -4.582
   44    HB   VAL   5           HB       VAL   5   2.983  -6.049  -1.874
   45   1HG1  VAL   5          1HG1      VAL   5   1.511  -6.222  -4.500
   46   2HG1  VAL   5          2HG1      VAL   5   2.032  -4.730  -3.717
   47   3HG1  VAL   5          3HG1      VAL   5   0.824  -5.755  -2.945
   48   1HG2  VAL   5          1HG2      VAL   5   1.337  -8.038  -2.624
   49   2HG2  VAL   5          2HG2      VAL   5   2.777  -8.284  -1.637
   50   3HG2  VAL   5          3HG2      VAL   5   2.838  -8.583  -3.374
   51    H    ILE   6           H        ILE   6   3.926  -5.136  -5.775
   52    HA   ILE   6           HA       ILE   6   5.132  -2.703  -4.637
   53    HB   ILE   6           HB       ILE   6   5.014  -3.535  -7.540
   54   1HG1  ILE   6          2HG1      ILE   6   7.346  -3.511  -5.610
   55   2HG1  ILE   6          1HG1      ILE   6   6.518  -4.954  -6.188
   56   1HG2  ILE   6          1HG2      ILE   6   6.785  -1.390  -6.466
   57   2HG2  ILE   6          2HG2      ILE   6   5.094  -1.027  -6.803
   58   3HG2  ILE   6          3HG2      ILE   6   6.145  -1.611  -8.094
   59   1HD1  ILE   6          1HD1      ILE   6   7.191  -4.302  -8.504
   60   2HD1  ILE   6          2HD1      ILE   6   8.523  -4.725  -7.428
   61   3HD1  ILE   6          3HD1      ILE   6   8.181  -3.032  -7.787
   62    H    LEU   7           H        LEU   7   3.982  -0.857  -4.629
   63    HA   LEU   7           HA       LEU   7   1.326  -0.928  -5.898
   64   1HB   LEU   7          2HB       LEU   7   2.114   0.867  -3.615
   65   2HB   LEU   7          1HB       LEU   7   0.504   0.425  -4.146
   66    HG   LEU   7           HG       LEU   7   2.468  -1.422  -2.805
   67   1HD1  LEU   7          1HD1      LEU   7   1.200  -1.209  -0.856
   68   2HD1  LEU   7          2HD1      LEU   7  -0.148  -0.451  -1.707
   69   3HD1  LEU   7          3HD1      LEU   7   1.351   0.443  -1.454
   70   1HD2  LEU   7          1HD2      LEU   7   0.848  -3.105  -2.925
   71   2HD2  LEU   7          2HD2      LEU   7   0.834  -2.379  -4.532
   72   3HD2  LEU   7          3HD2      LEU   7  -0.428  -1.973  -3.370
   73    H    ASN   8           H        ASN   8   1.842  -0.061  -7.878
   74    HA   ASN   8           HA       ASN   8   3.201   2.532  -7.966
   75   1HB   ASN   8          2HB       ASN   8   2.396   0.677 -10.217
   76   2HB   ASN   8          1HB       ASN   8   3.326   2.163 -10.397
   77   1HD2  ASN   8          1HD2      ASN   8   5.423   1.899 -10.532
   78   2HD2  ASN   8          2HD2      ASN   8   6.332   0.584  -9.878
   79    H    GLY   9           H        GLY   9   1.885   4.251  -7.723
   80   1HA   GLY   9          2HA       GLY   9  -0.723   4.172  -9.115
   81   2HA   GLY   9          1HA       GLY   9  -0.444   5.048  -7.622
   82    H    LYS  10           H        LYS  10  -1.422   6.793  -8.921
   83    HA   LYS  10           HA       LYS  10   0.189   7.952 -11.009
   84   1HB   LYS  10          2HB       LYS  10  -2.236   9.030  -9.564
   85   2HB   LYS  10          1HB       LYS  10  -1.510   9.743 -10.999
   86   1HG   LYS  10          2HG       LYS  10  -2.008   7.662 -12.236
   87   2HG   LYS  10          1HG       LYS  10  -2.822   7.040 -10.800
   88   1HD   LYS  10          2HD       LYS  10  -3.596   9.567 -12.256
   89   2HD   LYS  10          1HD       LYS  10  -4.377   8.002 -12.479
   90   1HE   LYS  10          2HE       LYS  10  -5.737   9.210 -10.972
   91   2HE   LYS  10          1HE       LYS  10  -4.862   8.028 -10.002
   92   1HZ   LYS  10          1HZ       LYS  10  -3.916   9.636  -8.822
   93   2HZ   LYS  10          2HZ       LYS  10  -4.996  10.716  -9.544
   94   3HZ   LYS  10          3HZ       LYS  10  -3.453  10.504 -10.200
   95    H    THR  11           H        THR  11  -0.869   9.028  -7.774
   96    HA   THR  11           HA       THR  11   1.375  10.898  -7.687
   97    HB   THR  11           HB       THR  11  -0.008  11.707  -5.637
   98    HG1  THR  11           1HG      THR  11  -2.313  11.248  -6.139
   99   1HG2  THR  11          1HG2      THR  11  -1.715  12.305  -7.896
  100   2HG2  THR  11          2HG2      THR  11  -0.004  12.497  -8.278
  101   3HG2  THR  11          3HG2      THR  11  -0.709  13.378  -6.923
  102    H    LEU  12           H        LEU  12   0.804   7.817  -6.824
  103    HA   LEU  12           HA       LEU  12   2.590   8.037  -4.525
  104   1HB   LEU  12          2HB       LEU  12   0.346   7.879  -3.608
  105   2HB   LEU  12          1HB       LEU  12   0.030   6.442  -4.562
  106    HG   LEU  12           HG       LEU  12   1.603   5.167  -3.280
  107   1HD1  LEU  12          1HD1      LEU  12   2.375   6.805  -1.175
  108   2HD1  LEU  12          2HD1      LEU  12   2.616   7.780  -2.623
  109   3HD1  LEU  12          3HD1      LEU  12   3.392   6.208  -2.486
  110   1HD2  LEU  12          1HD2      LEU  12   0.182   4.846  -1.591
  111   2HD2  LEU  12          2HD2      LEU  12  -0.751   6.172  -2.286
  112   3HD2  LEU  12          3HD2      LEU  12   0.396   6.487  -0.985
  113    H    LYS  13           H        LYS  13   4.063   6.475  -4.326
  114    HA   LYS  13           HA       LYS  13   3.877   4.043  -5.928
  115   1HB   LYS  13          2HB       LYS  13   6.350   5.779  -6.021
  116   2HB   LYS  13          1HB       LYS  13   6.057   4.295  -6.914
  117   1HG   LYS  13          2HG       LYS  13   5.698   5.871  -8.531
  118   2HG   LYS  13          1HG       LYS  13   4.060   5.632  -7.919
  119   1HD   LYS  13          2HD       LYS  13   4.266   7.607  -6.525
  120   2HD   LYS  13          1HD       LYS  13   5.936   7.825  -7.042
  121   1HE   LYS  13          2HE       LYS  13   4.387   9.321  -8.228
  122   2HE   LYS  13          1HE       LYS  13   5.213   8.208  -9.319
  123   1HZ   LYS  13          1HZ       LYS  13   2.833   8.422  -9.803
  124   2HZ   LYS  13          2HZ       LYS  13   2.464   7.819  -8.268
  125   3HZ   LYS  13          3HZ       LYS  13   3.254   6.836  -9.394
  126    H    GLY  14           H        GLY  14   5.064   2.307  -5.039
  127   1HA   GLY  14          2HA       GLY  14   7.014   2.617  -3.023
  128   2HA   GLY  14          1HA       GLY  14   5.448   2.382  -2.268
  129    H    GLU  15           H        GLU  15   6.815   0.545  -1.433
  130    HA   GLU  15           HA       GLU  15   6.181  -1.822  -3.018
  131   1HB   GLU  15          2HB       GLU  15   8.881  -1.332  -1.742
  132   2HB   GLU  15          1HB       GLU  15   8.366  -2.837  -2.487
  133   1HG   GLU  15          2HG       GLU  15   9.702  -1.790  -4.089
  134   2HG   GLU  15          1HG       GLU  15   8.046  -1.507  -4.620
  135    H    THR  16           H        THR  16   5.887  -3.715  -1.772
  136    HA   THR  16           HA       THR  16   6.051  -3.542   1.109
  137    HB   THR  16           HB       THR  16   3.926  -2.630   1.044
  138    HG1  THR  16           1HG      THR  16   3.321  -5.370   0.899
  139   1HG2  THR  16          1HG2      THR  16   2.110  -3.664  -0.464
  140   2HG2  THR  16          2HG2      THR  16   3.472  -4.258  -1.411
  141   3HG2  THR  16          3HG2      THR  16   3.262  -2.525  -1.161
  142    H    THR  17           H        THR  17   5.284  -5.683   2.131
  143    HA   THR  17           HA       THR  17   5.589  -7.932   0.290
  144    HB   THR  17           HB       THR  17   7.288  -8.970   1.773
  145    HG1  THR  17           1HG      THR  17   7.216  -6.429   3.012
  146   1HG2  THR  17          1HG2      THR  17   9.175  -7.358   1.244
  147   2HG2  THR  17          2HG2      THR  17   7.948  -6.362   0.464
  148   3HG2  THR  17          3HG2      THR  17   8.251  -7.999  -0.114
  149    H    THR  18           H        THR  18   4.089  -9.373   0.658
  150    HA   THR  18           HA       THR  18   2.981  -9.718   3.389
  151    HB   THR  18           HB       THR  18   1.356  -8.930   1.676
  152    HG1  THR  18           1HG      THR  18   0.683 -10.282   3.398
  153   1HG2  THR  18          1HG2      THR  18   1.671  -9.726  -0.393
  154   2HG2  THR  18          2HG2      THR  18   0.631 -11.031   0.178
  155   3HG2  THR  18          3HG2      THR  18   2.383 -11.237   0.175
  156    H    GLU  19           H        GLU  19   2.722 -11.858   4.165
  157    HA   GLU  19           HA       GLU  19   4.273 -13.886   2.679
  158   1HB   GLU  19          2HB       GLU  19   5.227 -13.279   4.858
  159   2HB   GLU  19          1HB       GLU  19   3.709 -13.685   5.647
  160   1HG   GLU  19          2HG       GLU  19   3.973 -16.012   4.964
  161   2HG   GLU  19          1HG       GLU  19   5.490 -15.606   4.163
  162    H    ALA  20           H        ALA  20   3.132 -15.505   1.801
  163    HA   ALA  20           HA       ALA  20   0.844 -16.588   3.232
  164   1HB   ALA  20          1HB       ALA  20   0.214 -14.679   1.532
  165   2HB   ALA  20          2HB       ALA  20  -0.784 -16.124   1.702
  166   3HB   ALA  20          3HB       ALA  20   0.356 -15.992   0.363
  167    H    VAL  21           H        VAL  21   0.178 -18.635   2.531
  168    HA   VAL  21           HA       VAL  21   2.141 -20.462   1.928
  169    HB   VAL  21           HB       VAL  21  -0.767 -20.821   1.204
  170   1HG1  VAL  21          1HG1      VAL  21   0.867 -22.543   0.410
  171   2HG1  VAL  21          2HG1      VAL  21  -0.387 -23.156   1.487
  172   3HG1  VAL  21          3HG1      VAL  21   1.242 -22.877   2.101
  173   1HG2  VAL  21          1HG2      VAL  21   0.640 -20.906   3.847
  174   2HG2  VAL  21          2HG2      VAL  21  -0.810 -21.869   3.560
  175   3HG2  VAL  21          3HG2      VAL  21  -0.876 -20.113   3.413
  176    H    ASP  22           H        ASP  22   0.327 -18.504  -0.282
  177    HA   ASP  22           HA       ASP  22   2.030 -19.331  -2.458
  178   1HB   ASP  22          2HB       ASP  22   0.098 -19.880  -3.983
  179   2HB   ASP  22          1HB       ASP  22   0.432 -21.073  -2.733
  180    H    ALA  23           H        ALA  23   1.272 -18.185  -4.578
  181    HA   ALA  23           HA       ALA  23   1.399 -15.438  -4.123
  182   1HB   ALA  23          1HB       ALA  23   0.289 -15.831  -6.690
  183   2HB   ALA  23          2HB       ALA  23   1.380 -17.182  -6.380
  184   3HB   ALA  23          3HB       ALA  23   1.973 -15.525  -6.265
  185    H    ALA  24           H        ALA  24  -1.370 -17.499  -4.891
  186    HA   ALA  24           HA       ALA  24  -3.271 -15.435  -5.148
  187   1HB   ALA  24          1HB       ALA  24  -3.347 -18.120  -5.509
  188   2HB   ALA  24          2HB       ALA  24  -4.781 -17.096  -5.417
  189   3HB   ALA  24          3HB       ALA  24  -4.230 -17.970  -3.989
  190    H    THR  25           H        THR  25  -2.582 -17.563  -2.360
  191    HA   THR  25           HA       THR  25  -4.226 -16.339  -0.513
  192    HB   THR  25           HB       THR  25  -2.531 -17.120   1.193
  193    HG1  THR  25           1HG      THR  25  -1.167 -17.808  -1.170
  194   1HG2  THR  25          1HG2      THR  25  -3.517 -19.051  -0.873
  195   2HG2  THR  25          2HG2      THR  25  -4.237 -18.661   0.689
  196   3HG2  THR  25          3HG2      THR  25  -2.717 -19.550   0.618
  197    H    ALA  26           H        ALA  26  -0.921 -15.521  -1.475
  198    HA   ALA  26           HA       ALA  26  -0.548 -13.364   0.289
  199   1HB   ALA  26          1HB       ALA  26   0.609 -13.371  -2.474
  200   2HB   ALA  26          2HB       ALA  26   1.144 -14.556  -1.282
  201   3HB   ALA  26          3HB       ALA  26   1.338 -12.832  -0.962
  202    H    GLU  27           H        GLU  27  -1.666 -13.445  -3.106
  203    HA   GLU  27           HA       GLU  27  -2.173 -10.778  -3.486
  204   1HB   GLU  27          2HB       GLU  27  -2.312 -12.457  -5.259
  205   2HB   GLU  27          1HB       GLU  27  -3.759 -13.131  -4.519
  206   1HG   GLU  27          2HG       GLU  27  -4.941 -11.034  -4.921
  207   2HG   GLU  27          1HG       GLU  27  -3.491 -10.360  -5.664
  208    H    LYS  28           H        LYS  28  -4.416 -13.240  -2.202
  209    HA   LYS  28           HA       LYS  28  -6.545 -11.440  -1.755
  210   1HB   LYS  28          2HB       LYS  28  -5.882 -14.183  -0.739
  211   2HB   LYS  28          1HB       LYS  28  -7.252 -13.299  -0.077
  212   1HG   LYS  28          2HG       LYS  28  -7.709 -14.914  -1.990
  213   2HG   LYS  28          1HG       LYS  28  -8.386 -13.289  -2.121
  214   1HD   LYS  28          2HD       LYS  28  -6.535 -12.625  -3.572
  215   2HD   LYS  28          1HD       LYS  28  -5.838 -14.241  -3.428
  216   1HE   LYS  28          2HE       LYS  28  -8.526 -13.576  -4.623
  217   2HE   LYS  28          1HE       LYS  28  -7.067 -13.977  -5.527
  218   1HZ   LYS  28          1HZ       LYS  28  -8.492 -15.895  -5.338
  219   2HZ   LYS  28          2HZ       LYS  28  -8.511 -15.771  -3.652
  220   3HZ   LYS  28          3HZ       LYS  28  -7.074 -16.160  -4.454
  221    H    VAL  29           H        VAL  29  -3.978 -12.670   0.377
  222    HA   VAL  29           HA       VAL  29  -4.795 -11.389   2.722
  223    HB   VAL  29           HB       VAL  29  -1.979 -11.986   1.780
  224   1HG1  VAL  29          1HG1      VAL  29  -1.365 -10.702   3.508
  225   2HG1  VAL  29          2HG1      VAL  29  -1.916 -12.042   4.513
  226   3HG1  VAL  29          3HG1      VAL  29  -2.990 -10.681   4.191
  227   1HG2  VAL  29          1HG2      VAL  29  -2.217 -14.092   2.541
  228   2HG2  VAL  29          2HG2      VAL  29  -3.938 -13.781   2.312
  229   3HG2  VAL  29          3HG2      VAL  29  -3.212 -13.595   3.909
  230    H    VAL  30           H        VAL  30  -2.885 -10.267  -0.007
  231    HA   VAL  30           HA       VAL  30  -2.259  -7.708   1.068
  232    HB   VAL  30           HB       VAL  30  -2.472  -8.589  -1.819
  233   1HG1  VAL  30          1HG1      VAL  30  -0.802  -6.300  -0.863
  234   2HG1  VAL  30          2HG1      VAL  30  -2.514  -6.061  -1.209
  235   3HG1  VAL  30          3HG1      VAL  30  -1.429  -6.628  -2.478
  236   1HG2  VAL  30          1HG2      VAL  30   0.161  -8.178  -0.579
  237   2HG2  VAL  30          2HG2      VAL  30  -0.382  -9.416  -1.712
  238   3HG2  VAL  30          3HG2      VAL  30  -0.748  -9.570   0.007
  239    H    LYS  31           H        LYS  31  -4.772  -8.901  -1.182
  240    HA   LYS  31           HA       LYS  31  -6.170  -6.603  -1.700
  241   1HB   LYS  31          2HB       LYS  31  -7.142  -9.406  -1.205
  242   2HB   LYS  31          1HB       LYS  31  -8.251  -8.111  -1.631
  243   1HG   LYS  31          2HG       LYS  31  -7.070  -7.761  -3.720
  244   2HG   LYS  31          1HG       LYS  31  -5.918  -9.029  -3.291
  245   1HD   LYS  31          2HD       LYS  31  -7.683 -10.681  -3.288
  246   2HD   LYS  31          1HD       LYS  31  -8.891  -9.431  -3.590
  247   1HE   LYS  31          2HE       LYS  31  -7.845  -8.937  -5.746
  248   2HE   LYS  31          1HE       LYS  31  -6.634 -10.182  -5.446
  249   1HZ   LYS  31          1HZ       LYS  31  -8.076 -11.829  -5.923
  250   2HZ   LYS  31          2HZ       LYS  31  -8.862 -10.623  -6.811
  251   3HZ   LYS  31          3HZ       LYS  31  -9.410 -11.026  -5.263
  252    H    GLN  32           H        GLN  32  -6.518  -8.748   1.065
  253    HA   GLN  32           HA       GLN  32  -8.557  -7.357   2.395
  254   1HB   GLN  32          2HB       GLN  32  -7.546  -9.693   2.860
  255   2HB   GLN  32          1HB       GLN  32  -6.368  -8.831   3.839
  256   1HG   GLN  32          2HG       GLN  32  -7.991  -8.107   5.358
  257   2HG   GLN  32          1HG       GLN  32  -9.316  -8.497   4.259
  258   1HE2  GLN  32          1HE2      GLN  32 -10.081 -10.548   4.148
  259   2HE2  GLN  32          2HE2      GLN  32  -9.588 -11.813   5.218
  260    H    PHE  33           H        PHE  33  -5.090  -6.938   2.317
  261    HA   PHE  33           HA       PHE  33  -4.676  -5.189   4.432
  262   1HB   PHE  33          2HB       PHE  33  -2.944  -6.267   2.918
  263   2HB   PHE  33          1HB       PHE  33  -3.321  -5.024   1.732
  264    HD1  PHE  33           1HD      PHE  33  -2.430  -5.276   5.339
  265    HD2  PHE  33           2HD      PHE  33  -1.923  -3.204   1.642
  266    HE1  PHE  33           1HE      PHE  33  -0.792  -3.773   6.393
  267    HE2  PHE  33           2HE      PHE  33  -0.281  -1.713   2.706
  268    HZ   PHE  33           HZ       PHE  33   0.284  -2.006   5.087
  269    H    PHE  34           H        PHE  34  -5.092  -4.304   1.031
  270    HA   PHE  34           HA       PHE  34  -5.571  -1.548   1.557
  271   1HB   PHE  34          2HB       PHE  34  -6.183  -3.144  -0.935
  272   2HB   PHE  34          1HB       PHE  34  -6.097  -1.384  -0.824
  273    HD1  PHE  34           1HD      PHE  34  -3.794  -0.781   0.669
  274    HD2  PHE  34           2HD      PHE  34  -4.374  -3.962  -2.086
  275    HE1  PHE  34           1HE      PHE  34  -1.369  -0.889   0.291
  276    HE2  PHE  34           2HE      PHE  34  -1.951  -4.074  -2.480
  277    HZ   PHE  34           HZ       PHE  34  -0.453  -2.537  -1.279
  278    H    ASN  35           H        ASN  35  -7.671  -4.296   0.916
  279    HA   ASN  35           HA       ASN  35 -10.141  -3.093   0.638
  280   1HB   ASN  35          2HB       ASN  35  -9.751  -5.523   0.485
  281   2HB   ASN  35          1HB       ASN  35  -9.448  -5.589   2.218
  282   1HD2  ASN  35          1HD2      ASN  35 -11.541  -6.617   0.208
  283   2HD2  ASN  35          2HD2      ASN  35 -13.037  -6.332   1.026
  284    H    ASP  36           H        ASP  36  -8.258  -3.744   3.505
  285    HA   ASP  36           HA       ASP  36 -10.259  -2.539   5.260
  286   1HB   ASP  36          2HB       ASP  36  -7.669  -3.953   5.904
  287   2HB   ASP  36          1HB       ASP  36  -8.797  -3.331   7.104
  288    H    ASN  37           H        ASN  37  -7.180  -1.719   3.831
  289    HA   ASN  37           HA       ASN  37  -6.593   0.371   5.728
  290   1HB   ASN  37          2HB       ASN  37  -5.464  -0.206   2.980
  291   2HB   ASN  37          1HB       ASN  37  -4.903   1.104   4.011
  292   1HD2  ASN  37          1HD2      ASN  37  -3.737  -1.512   2.929
  293   2HD2  ASN  37          2HD2      ASN  37  -3.010  -2.221   4.328
  294    H    GLY  38           H        GLY  38  -7.974   0.098   2.537
  295   1HA   GLY  38          2HA       GLY  38  -8.444   2.127   1.201
  296   2HA   GLY  38          1HA       GLY  38  -9.881   1.453   1.936
  297    H    VAL  39           H        VAL  39 -11.163   2.899   2.737
  298    HA   VAL  39           HA       VAL  39 -10.250   5.573   3.195
  299    HB   VAL  39           HB       VAL  39 -12.992   4.370   3.323
  300   1HG1  VAL  39          1HG1      VAL  39 -13.506   6.970   3.031
  301   2HG1  VAL  39          2HG1      VAL  39 -12.018   7.100   3.969
  302   3HG1  VAL  39          3HG1      VAL  39 -13.395   6.207   4.618
  303   1HG2  VAL  39          1HG2      VAL  39 -12.479   4.355   1.104
  304   2HG2  VAL  39          2HG2      VAL  39 -11.363   5.715   1.242
  305   3HG2  VAL  39          3HG2      VAL  39 -13.105   5.999   1.256
  306    H    ASP  40           H        ASP  40 -12.055   3.319   5.369
  307    HA   ASP  40           HA       ASP  40 -11.614   5.163   7.538
  308   1HB   ASP  40          2HB       ASP  40 -13.011   2.490   7.433
  309   2HB   ASP  40          1HB       ASP  40 -12.948   3.526   8.855
  310    H    GLY  41           H        GLY  41  -9.234   3.698   6.424
  311   1HA   GLY  41          2HA       GLY  41  -8.469   1.761   8.378
  312   2HA   GLY  41          1HA       GLY  41  -7.398   2.546   7.224
  313    H    GLU  42           H        GLU  42  -6.688   1.985   9.909
  314    HA   GLU  42           HA       GLU  42  -6.864   4.506  11.355
  315   1HB   GLU  42          2HB       GLU  42  -5.446   1.927  12.057
  316   2HB   GLU  42          1HB       GLU  42  -5.598   3.320  13.118
  317   1HG   GLU  42          2HG       GLU  42  -8.027   3.054  13.117
  318   2HG   GLU  42          1HG       GLU  42  -7.868   1.651  12.060
  319    H    TRP  43           H        TRP  43  -5.642   6.003  10.248
  320    HA   TRP  43           HA       TRP  43  -2.892   5.301   9.541
  321   1HB   TRP  43          2HB       TRP  43  -4.519   7.753   8.863
  322   2HB   TRP  43          1HB       TRP  43  -2.909   7.392   8.258
  323    HD1  TRP  43           HD       TRP  43  -5.737   4.773   8.378
  324    HE1  TRP  43           1HE      TRP  43  -6.301   4.097   5.953
  325    HE3  TRP  43           3HE      TRP  43  -2.761   8.095   5.914
  326    HZ2  TRP  43           2HZ      TRP  43  -5.562   4.871   3.351
  327    HZ3  TRP  43           3HZ      TRP  43  -2.737   8.062   3.465
  328    HH2  TRP  43           HH       TRP  43  -4.108   6.483   2.204
  329    H    THR  44           H        THR  44  -1.255   5.849  10.813
  330    HA   THR  44           HA       THR  44  -1.592   8.091  12.689
  331    HB   THR  44           HB       THR  44   0.345   7.089  13.899
  332    HG1  THR  44           1HG      THR  44   0.003   4.933  12.094
  333   1HG2  THR  44          1HG2      THR  44  -0.793   5.353  14.969
  334   2HG2  THR  44          2HG2      THR  44  -1.732   4.964  13.527
  335   3HG2  THR  44          3HG2      THR  44  -2.055   6.453  14.415
  336    H    TYR  45           H        TYR  45  -0.267   9.859  12.516
  337    HA   TYR  45           HA       TYR  45   1.614   9.839  10.255
  338   1HB   TYR  45          2HB       TYR  45  -0.223  11.441  10.069
  339   2HB   TYR  45          1HB       TYR  45   0.226  12.158  11.612
  340    HD1  TYR  45           1HD      TYR  45   2.464  11.117   8.828
  341    HD2  TYR  45           2HD      TYR  45   0.794  14.352  11.030
  342    HE1  TYR  45           1HE      TYR  45   3.960  12.678   7.657
  343    HE2  TYR  45           2HE      TYR  45   2.285  15.923   9.864
  344    HH   TYR  45           HH       TYR  45   4.096  15.035   7.107
  345    H    ASP  46           H        ASP  46   3.694  10.541  10.440
  346    HA   ASP  46           HA       ASP  46   4.639  11.212  13.149
  347   1HB   ASP  46          2HB       ASP  46   5.313   8.922  12.548
  348   2HB   ASP  46          1HB       ASP  46   6.070   9.527  11.079
  349    H    ASP  47           H        ASP  47   4.393  13.425  12.503
  350    HA   ASP  47           HA       ASP  47   5.397  14.726  10.328
  351   1HB   ASP  47          2HB       ASP  47   5.477  15.703  13.189
  352   2HB   ASP  47          1HB       ASP  47   5.628  16.724  11.761
  353    H    ALA  48           H        ALA  48   7.204  13.583  13.112
  354    HA   ALA  48           HA       ALA  48   9.594  14.895  12.841
  355   1HB   ALA  48          1HB       ALA  48   8.708  12.923  14.436
  356   2HB   ALA  48          2HB       ALA  48  10.398  13.417  14.338
  357   3HB   ALA  48          3HB       ALA  48   9.835  12.019  13.424
  358    H    THR  49           H        THR  49   8.406  12.218  10.889
  359    HA   THR  49           HA       THR  49  10.784  12.541   9.179
  360    HB   THR  49           HB       THR  49  10.693  10.122   8.681
  361    HG1  THR  49           1HG      THR  49   9.116   8.948   9.385
  362   1HG2  THR  49          1HG2      THR  49  11.437  11.242  11.233
  363   2HG2  THR  49          2HG2      THR  49  12.246  10.019  10.252
  364   3HG2  THR  49          3HG2      THR  49  10.968   9.547  11.371
  365    H    LYS  50           H        LYS  50   7.736  13.335   9.183
  366    HA   LYS  50           HA       LYS  50   6.085  13.616   7.616
  367   1HB   LYS  50          2HB       LYS  50   8.453  13.248   5.772
  368   2HB   LYS  50          1HB       LYS  50   6.869  13.794   5.244
  369   1HG   LYS  50          2HG       LYS  50   8.579  15.227   7.264
  370   2HG   LYS  50          1HG       LYS  50   8.504  15.620   5.546
  371   1HD   LYS  50          2HD       LYS  50   6.058  15.995   5.801
  372   2HD   LYS  50          1HD       LYS  50   6.243  15.746   7.538
  373   1HE   LYS  50          2HE       LYS  50   7.625  17.877   5.911
  374   2HE   LYS  50          1HE       LYS  50   6.218  18.129   6.940
  375   1HZ   LYS  50          1HZ       LYS  50   7.529  18.329   8.698
  376   2HZ   LYS  50          2HZ       LYS  50   8.875  18.264   7.677
  377   3HZ   LYS  50          3HZ       LYS  50   8.287  16.847   8.390
  378    H    THR  51           H        THR  51   6.644  10.924   8.603
  379    HA   THR  51           HA       THR  51   5.922   9.278   6.289
  380    HB   THR  51           HB       THR  51   6.952   8.495   9.019
  381    HG1  THR  51           1HG      THR  51   8.144   8.706   6.477
  382   1HG2  THR  51          1HG2      THR  51   5.745   6.877   6.935
  383   2HG2  THR  51          2HG2      THR  51   6.133   6.477   8.607
  384   3HG2  THR  51          3HG2      THR  51   7.376   6.359   7.361
  385    H    PHE  52           H        PHE  52   4.164   7.832   6.365
  386    HA   PHE  52           HA       PHE  52   2.239   8.350   8.533
  387   1HB   PHE  52          2HB       PHE  52   1.577   7.955   5.618
  388   2HB   PHE  52          1HB       PHE  52   0.417   8.155   6.923
  389    HD1  PHE  52           1HD      PHE  52  -0.368  10.264   7.449
  390    HD2  PHE  52           2HD      PHE  52   3.268   9.880   5.272
  391    HE1  PHE  52           1HE      PHE  52  -0.311  12.703   7.121
  392    HE2  PHE  52           2HE      PHE  52   3.332  12.316   4.943
  393    HZ   PHE  52           HZ       PHE  52   1.542  13.732   5.868
  394    H    THR  53           H        THR  53   2.622   6.549   9.635
  395    HA   THR  53           HA       THR  53   2.724   3.941   8.445
  396    HB   THR  53           HB       THR  53   2.435   3.206  10.929
  397    HG1  THR  53           1HG      THR  53   3.288   5.859  11.360
  398   1HG2  THR  53          1HG2      THR  53   4.535   2.811  10.158
  399   2HG2  THR  53          2HG2      THR  53   4.864   4.041  11.384
  400   3HG2  THR  53          3HG2      THR  53   4.800   4.489   9.678
  401    H    VAL  54           H        VAL  54   1.151   2.624   7.942
  402    HA   VAL  54           HA       VAL  54  -1.560   3.208   8.943
  403    HB   VAL  54           HB       VAL  54  -0.770   1.852   6.347
  404   1HG1  VAL  54          1HG1      VAL  54  -2.796   0.883   6.717
  405   2HG1  VAL  54          2HG1      VAL  54  -3.352   2.400   6.010
  406   3HG1  VAL  54          3HG1      VAL  54  -3.359   2.191   7.760
  407   1HG2  VAL  54          1HG2      VAL  54  -1.521   3.821   5.232
  408   2HG2  VAL  54          2HG2      VAL  54  -0.375   4.322   6.476
  409   3HG2  VAL  54          3HG2      VAL  54  -2.107   4.524   6.741
  410    H    THR  55           H        THR  55  -2.094   1.829  10.510
  411    HA   THR  55           HA       THR  55  -1.010  -0.887  10.435
  412    HB   THR  55           HB       THR  55  -2.428   0.495  12.711
  413    HG1  THR  55           1HG      THR  55   0.316   0.272  12.060
  414   1HG2  THR  55          1HG2      THR  55  -1.247  -1.196  14.087
  415   2HG2  THR  55          2HG2      THR  55  -0.779  -2.016  12.596
  416   3HG2  THR  55          3HG2      THR  55  -2.483  -1.870  13.027
  417    H    GLU  56           H        GLU  56  -2.217  -2.435   9.605
  418    HA   GLU  56           HA       GLU  56  -4.802  -2.310   8.749
  419   1HB   GLU  56          2HB       GLU  56  -3.280  -4.139   8.196
  420   2HB   GLU  56          1HB       GLU  56  -3.362  -4.729   9.850
  421   1HG   GLU  56          2HG       GLU  56  -4.749  -6.084   8.431
  422   2HG   GLU  56          1HG       GLU  56  -5.760  -5.173   9.553
  423   1H    MET   1          1HT       MET   1   7.234  18.333  -3.065
  424   2H    MET   1          2HT       MET   1   6.512  19.438  -2.008
  425   3H    MET   1          3HT       MET   1   5.662  18.061  -2.498
  426    HA   MET   1           HA       MET   1   8.202  17.905  -0.998
  427   1HB   MET   1          2HB       MET   1   6.692  19.170   0.380
  428   2HB   MET   1          1HB       MET   1   5.364  18.074   0.025
  429   1HG   MET   1          2HG       MET   1   6.154  17.639   2.237
  430   2HG   MET   1          1HG       MET   1   6.583  16.277   1.206
  431   1HE   MET   1          1HE       MET   1   7.917  19.792   1.952
  432   2HE   MET   1          2HE       MET   1   9.515  19.513   2.643
  433   3HE   MET   1          3HE       MET   1   8.070  19.128   3.579
  434    H    GLN   2           H        GLN   2   8.844  15.875  -0.622
  435    HA   GLN   2           HA       GLN   2   7.213  13.698  -1.705
  436   1HB   GLN   2          2HB       GLN   2   9.549  13.944  -2.527
  437   2HB   GLN   2          1HB       GLN   2  10.128  13.715  -0.885
  438   1HG   GLN   2          2HG       GLN   2  10.378  11.664  -2.064
  439   2HG   GLN   2          1HG       GLN   2   9.095  11.469  -0.876
  440   1HE2  GLN   2          1HE2      GLN   2   7.979  13.339  -3.436
  441   2HE2  GLN   2          2HE2      GLN   2   7.203  12.091  -4.336
  442    H    TYR   3           H        TYR   3   6.287  12.227  -0.387
  443    HA   TYR   3           HA       TYR   3   7.054  12.304   2.457
  444   1HB   TYR   3          2HB       TYR   3   4.342  11.799   1.226
  445   2HB   TYR   3          1HB       TYR   3   4.708  11.586   2.936
  446    HD1  TYR   3           1HD      TYR   3   4.815  13.445   4.409
  447    HD2  TYR   3           2HD      TYR   3   4.459  14.077   0.219
  448    HE1  TYR   3           1HE      TYR   3   4.334  15.821   4.815
  449    HE2  TYR   3           2HE      TYR   3   3.980  16.453   0.614
  450    HH   TYR   3           HH       TYR   3   4.231  18.139   2.248
  451    H    LYS   4           H        LYS   4   7.184  10.408   3.604
  452    HA   LYS   4           HA       LYS   4   7.371   7.977   1.958
  453   1HB   LYS   4          2HB       LYS   4   9.460   8.807   3.072
  454   2HB   LYS   4          1HB       LYS   4   8.680   8.542   4.625
  455   1HG   LYS   4          2HG       LYS   4  10.163   6.712   4.108
  456   2HG   LYS   4          1HG       LYS   4   8.490   6.152   4.107
  457   1HD   LYS   4          2HD       LYS   4   8.421   6.176   1.707
  458   2HD   LYS   4          1HD       LYS   4  10.013   6.933   1.626
  459   1HE   LYS   4          2HE       LYS   4  11.029   4.952   2.598
  460   2HE   LYS   4          1HE       LYS   4   9.446   4.199   2.764
  461   1HZ   LYS   4          1HZ       LYS   4  10.433   3.320   0.826
  462   2HZ   LYS   4          2HZ       LYS   4  10.883   4.849   0.257
  463   3HZ   LYS   4          3HZ       LYS   4   9.250   4.407   0.291
  464    H    VAL   5           H        VAL   5   5.389   7.044   2.121
  465    HA   VAL   5           HA       VAL   5   4.093   6.888   4.729
  466    HB   VAL   5           HB       VAL   5   3.103   6.027   2.007
  467   1HG1  VAL   5          1HG1      VAL   5   1.598   6.236   4.612
  468   2HG1  VAL   5          2HG1      VAL   5   2.094   4.733   3.836
  469   3HG1  VAL   5          3HG1      VAL   5   0.923   5.787   3.046
  470   1HG2  VAL   5          1HG2      VAL   5   1.495   8.056   2.733
  471   2HG2  VAL   5          2HG2      VAL   5   2.955   8.267   1.766
  472   3HG2  VAL   5          3HG2      VAL   5   2.997   8.565   3.504
  473    H    ILE   6           H        ILE   6   3.967   5.092   5.921
  474    HA   ILE   6           HA       ILE   6   5.131   2.630   4.798
  475    HB   ILE   6           HB       ILE   6   4.992   3.466   7.701
  476   1HG1  ILE   6          2HG1      ILE   6   7.349   3.385   5.804
  477   2HG1  ILE   6          1HG1      ILE   6   6.548   4.847   6.368
  478   1HG2  ILE   6          1HG2      ILE   6   6.726   1.279   6.650
  479   2HG2  ILE   6          2HG2      ILE   6   5.020   0.957   6.963
  480   3HG2  ILE   6          3HG2      ILE   6   6.067   1.515   8.269
  481   1HD1  ILE   6          1HD1      ILE   6   7.173   4.181   8.695
  482   2HD1  ILE   6          2HD1      ILE   6   8.529   4.570   7.638
  483   3HD1  ILE   6          3HD1      ILE   6   8.143   2.886   7.991
  484    H    LEU   7           H        LEU   7   3.935   0.814   4.775
  485    HA   LEU   7           HA       LEU   7   1.264   0.949   6.005
  486   1HB   LEU   7          2HB       LEU   7   2.042  -0.866   3.734
  487   2HB   LEU   7          1HB       LEU   7   0.435  -0.384   4.242
  488    HG   LEU   7           HG       LEU   7   2.461   1.415   2.930
  489   1HD1  LEU   7          1HD1      LEU   7   1.217   1.232   0.963
  490   2HD1  LEU   7          2HD1      LEU   7  -0.161   0.507   1.794
  491   3HD1  LEU   7          3HD1      LEU   7   1.319  -0.423   1.563
  492   1HD2  LEU   7          1HD2      LEU   7   0.882   3.137   3.028
  493   2HD2  LEU   7          2HD2      LEU   7   0.827   2.412   4.633
  494   3HD2  LEU   7          3HD2      LEU   7  -0.428   2.036   3.455
  495    H    ASN   8           H        ASN   8   1.732   0.070   7.992
  496    HA   ASN   8           HA       ASN   8   3.026  -2.555   8.099
  497   1HB   ASN   8          2HB       ASN   8   2.235  -0.682  10.339
  498   2HB   ASN   8          1HB       ASN   8   3.125  -2.189  10.532
  499   1HD2  ASN   8          1HD2      ASN   8   5.226  -1.977  10.696
  500   2HD2  ASN   8          2HD2      ASN   8   6.174  -0.683  10.055
  501    H    GLY   9           H        GLY   9   1.673  -4.240   7.838
  502   1HA   GLY   9          2HA       GLY   9  -0.953  -4.099   9.193
  503   2HA   GLY   9          1HA       GLY   9  -0.673  -4.982   7.703
  504    H    LYS  10           H        LYS  10  -1.713  -6.702   8.988
  505    HA   LYS  10           HA       LYS  10  -0.158  -7.900  11.098
  506   1HB   LYS  10          2HB       LYS  10  -2.589  -8.919   9.620
  507   2HB   LYS  10          1HB       LYS  10  -1.901  -9.648  11.065
  508   1HG   LYS  10          2HG       LYS  10  -2.367  -7.557  12.294
  509   2HG   LYS  10          1HG       LYS  10  -3.144  -6.914  10.848
  510   1HD   LYS  10          2HD       LYS  10  -4.000  -9.422  12.293
  511   2HD   LYS  10          1HD       LYS  10  -4.745  -7.839  12.504
  512   1HE   LYS  10          2HE       LYS  10  -6.114  -9.014  10.977
  513   2HE   LYS  10          1HE       LYS  10  -5.197  -7.853  10.021
  514   1HZ   LYS  10          1HZ       LYS  10  -4.274  -9.484   8.854
  515   2HZ   LYS  10          2HZ       LYS  10  -5.389 -10.538   9.560
  516   3HZ   LYS  10          3HZ       LYS  10  -3.850 -10.363  10.238
  517    H    THR  11           H        THR  11  -1.196  -8.950   7.848
  518    HA   THR  11           HA       THR  11   1.002 -10.873   7.793
  519    HB   THR  11           HB       THR  11  -0.371 -11.651   5.724
  520    HG1  THR  11           1HG      THR  11  -2.672 -11.135   6.193
  521   1HG2  THR  11          1HG2      THR  11  -2.124 -12.205   7.958
  522   2HG2  THR  11          2HG2      THR  11  -0.424 -12.439   8.365
  523   3HG2  THR  11          3HG2      THR  11  -1.132 -13.303   6.999
  524    H    LEU  12           H        LEU  12   0.517  -7.780   6.922
  525    HA   LEU  12           HA       LEU  12   2.329  -8.044   4.649
  526   1HB   LEU  12          2HB       LEU  12   0.104  -7.832   3.700
  527   2HB   LEU  12          1HB       LEU  12  -0.190  -6.386   4.651
  528    HG   LEU  12           HG       LEU  12   1.431  -5.150   3.391
  529   1HD1  LEU  12          1HD1      LEU  12   2.192  -6.808   1.297
  530   2HD1  LEU  12          2HD1      LEU  12   2.389  -7.788   2.747
  531   3HD1  LEU  12          3HD1      LEU  12   3.204  -6.235   2.622
  532   1HD2  LEU  12          1HD2      LEU  12   0.041  -4.796   1.682
  533   2HD2  LEU  12          2HD2      LEU  12  -0.934  -6.099   2.363
  534   3HD2  LEU  12          3HD2      LEU  12   0.224  -6.443   1.079
  535    H    LYS  13           H        LYS  13   3.844  -6.518   4.471
  536    HA   LYS  13           HA       LYS  13   3.694  -4.082   6.070
  537   1HB   LYS  13          2HB       LYS  13   6.122  -5.878   6.199
  538   2HB   LYS  13          1HB       LYS  13   5.854  -4.387   7.089
  539   1HG   LYS  13          2HG       LYS  13   5.433  -5.955   8.699
  540   2HG   LYS  13          1HG       LYS  13   3.810  -5.675   8.064
  541   1HD   LYS  13          2HD       LYS  13   3.986  -7.654   6.672
  542   2HD   LYS  13          1HD       LYS  13   5.643  -7.913   7.214
  543   1HE   LYS  13          2HE       LYS  13   4.042  -9.370   8.377
  544   2HE   LYS  13          1HE       LYS  13   4.879  -8.278   9.480
  545   1HZ   LYS  13          1HZ       LYS  13   2.489  -8.434   9.931
  546   2HZ   LYS  13          2HZ       LYS  13   2.156  -7.823   8.391
  547   3HZ   LYS  13          3HZ       LYS  13   2.954  -6.859   9.527
  548    H    GLY  14           H        GLY  14   4.936  -2.377   5.199
  549   1HA   GLY  14          2HA       GLY  14   6.905  -2.733   3.211
  550   2HA   GLY  14          1HA       GLY  14   5.356  -2.460   2.434
  551    H    GLU  15           H        GLU  15   6.779  -0.657   1.618
  552    HA   GLU  15           HA       GLU  15   6.181   1.724   3.195
  553   1HB   GLU  15          2HB       GLU  15   8.886   1.169   1.956
  554   2HB   GLU  15          1HB       GLU  15   8.397   2.687   2.694
  555   1HG   GLU  15          2HG       GLU  15   9.684   1.606   4.316
  556   2HG   GLU  15          1HG       GLU  15   8.014   1.365   4.823
  557    H    THR  16           H        THR  16   5.951   3.623   1.945
  558    HA   THR  16           HA       THR  16   6.150   3.447  -0.933
  559    HB   THR  16           HB       THR  16   4.003   2.586  -0.899
  560    HG1  THR  16           1HG      THR  16   3.462   5.339  -0.762
  561   1HG2  THR  16          1HG2      THR  16   2.192   3.664   0.583
  562   2HG2  THR  16          2HG2      THR  16   3.553   4.224   1.551
  563   3HG2  THR  16          3HG2      THR  16   3.306   2.497   1.296
  564    H    THR  17           H        THR  17   5.451   5.605  -1.966
  565    HA   THR  17           HA       THR  17   5.784   7.847  -0.121
  566    HB   THR  17           HB       THR  17   7.527   8.844  -1.578
  567    HG1  THR  17           1HG      THR  17   7.412   6.303  -2.819
  568   1HG2  THR  17          1HG2      THR  17   9.368   7.186  -1.024
  569   2HG2  THR  17          2HG2      THR  17   8.106   6.219  -0.262
  570   3HG2  THR  17          3HG2      THR  17   8.441   7.850   0.321
  571    H    THR  18           H        THR  18   4.324   9.322  -0.510
  572    HA   THR  18           HA       THR  18   3.264   9.695  -3.255
  573    HB   THR  18           HB       THR  18   1.596   8.947  -1.566
  574    HG1  THR  18           1HG      THR  18   0.980  10.315  -3.296
  575   1HG2  THR  18          1HG2      THR  18   1.901   9.735   0.509
  576   2HG2  THR  18          2HG2      THR  18   0.901  11.065  -0.077
  577   3HG2  THR  18          3HG2      THR  18   2.658  11.227  -0.050
  578    H    GLU  19           H        GLU  19   3.067  11.840  -4.034
  579    HA   GLU  19           HA       GLU  19   4.646  13.830  -2.528
  580   1HB   GLU  19          2HB       GLU  19   5.616  13.200  -4.692
  581   2HB   GLU  19          1HB       GLU  19   4.121  13.644  -5.502
  582   1HG   GLU  19          2HG       GLU  19   4.431  15.962  -4.816
  583   2HG   GLU  19          1HG       GLU  19   5.925  15.520  -3.993
  584    H    ALA  20           H        ALA  20   3.534  15.476  -1.664
  585    HA   ALA  20           HA       ALA  20   1.291  16.615  -3.128
  586   1HB   ALA  20          1HB       ALA  20   0.593  14.723  -1.437
  587   2HB   ALA  20          2HB       ALA  20  -0.367  16.191  -1.622
  588   3HB   ALA  20          3HB       ALA  20   0.750  16.031  -0.265
  589    H    VAL  21           H        VAL  21   0.667  18.677  -2.436
  590    HA   VAL  21           HA       VAL  21   2.664  20.456  -1.804
  591    HB   VAL  21           HB       VAL  21  -0.243  20.886  -1.122
  592   1HG1  VAL  21          1HG1      VAL  21   1.421  22.567  -0.305
  593   2HG1  VAL  21          2HG1      VAL  21   0.197  23.211  -1.398
  594   3HG1  VAL  21          3HG1      VAL  21   1.828  22.892  -1.989
  595   1HG2  VAL  21          1HG2      VAL  21   1.201  20.936  -3.744
  596   2HG2  VAL  21          2HG2      VAL  21  -0.227  21.935  -3.477
  597   3HG2  VAL  21          3HG2      VAL  21  -0.339  20.179  -3.332
  598    H    ASP  22           H        ASP  22   0.773  18.543   0.380
  599    HA   ASP  22           HA       ASP  22   2.464  19.328   2.580
  600   1HB   ASP  22          2HB       ASP  22   0.524  19.925   4.077
  601   2HB   ASP  22          1HB       ASP  22   0.906  21.109   2.831
  602    H    ALA  23           H        ALA  23   1.649  18.202   4.688
  603    HA   ALA  23           HA       ALA  23   1.716  15.453   4.234
  604   1HB   ALA  23          1HB       ALA  23   0.578  15.873   6.785
  605   2HB   ALA  23          2HB       ALA  23   1.706  17.196   6.491
  606   3HB   ALA  23          3HB       ALA  23   2.261  15.526   6.384
  607    H    ALA  24           H        ALA  24  -1.014  17.581   4.964
  608    HA   ALA  24           HA       ALA  24  -2.967  15.563   5.194
  609   1HB   ALA  24          1HB       ALA  24  -2.983  18.249   5.553
  610   2HB   ALA  24          2HB       ALA  24  -4.439  17.261   5.441
  611   3HB   ALA  24          3HB       ALA  24  -3.848  18.121   4.021
  612    H    THR  25           H        THR  25  -2.189  17.673   2.417
  613    HA   THR  25           HA       THR  25  -3.833  16.490   0.545
  614    HB   THR  25           HB       THR  25  -2.097  17.229  -1.136
  615    HG1  THR  25           1HG      THR  25  -0.749  17.884   1.245
  616   1HG2  THR  25          1HG2      THR  25  -3.065  19.185   0.916
  617   2HG2  THR  25          2HG2      THR  25  -3.773  18.812  -0.656
  618   3HG2  THR  25          3HG2      THR  25  -2.232  19.663  -0.562
  619    H    ALA  26           H        ALA  26  -0.564  15.592   1.553
  620    HA   ALA  26           HA       ALA  26  -0.219  13.426  -0.204
  621   1HB   ALA  26          1HB       ALA  26   0.899  13.405   2.575
  622   2HB   ALA  26          2HB       ALA  26   1.480  14.576   1.391
  623   3HB   ALA  26          3HB       ALA  26   1.637  12.849   1.072
  624    H    GLU  27           H        GLU  27  -1.382  13.534   3.175
  625    HA   GLU  27           HA       GLU  27  -1.960  10.881   3.547
  626   1HB   GLU  27          2HB       GLU  27  -2.084  12.563   5.318
  627   2HB   GLU  27          1HB       GLU  27  -3.503  13.272   4.558
  628   1HG   GLU  27          2HG       GLU  27  -4.741  11.204   4.943
  629   2HG   GLU  27          1HG       GLU  27  -3.319  10.495   5.704
  630    H    LYS  28           H        LYS  28  -4.124  13.396   2.232
  631    HA   LYS  28           HA       LYS  28  -6.289  11.647   1.754
  632   1HB   LYS  28          2HB       LYS  28  -5.545  14.374   0.749
  633   2HB   LYS  28          1HB       LYS  28  -6.926  13.525   0.067
  634   1HG   LYS  28          2HG       LYS  28  -7.372  15.150   1.972
  635   2HG   LYS  28          1HG       LYS  28  -8.090  13.542   2.094
  636   1HD   LYS  28          2HD       LYS  28  -6.277  12.834   3.572
  637   2HD   LYS  28          1HD       LYS  28  -5.537  14.432   3.437
  638   1HE   LYS  28          2HE       LYS  28  -8.259  13.833   4.594
  639   2HE   LYS  28          1HE       LYS  28  -6.802  14.198   5.518
  640   1HZ   LYS  28          1HZ       LYS  28  -8.178  16.150   5.310
  641   2HZ   LYS  28          2HZ       LYS  28  -8.176  16.026   3.623
  642   3HZ   LYS  28          3HZ       LYS  28  -6.742  16.381   4.445
  643    H    VAL  29           H        VAL  29  -3.664  12.815  -0.342
  644    HA   VAL  29           HA       VAL  29  -4.477  11.554  -2.698
  645    HB   VAL  29           HB       VAL  29  -1.662  12.083  -1.716
  646   1HG1  VAL  29          1HG1      VAL  29  -1.055  10.784  -3.435
  647   2HG1  VAL  29          2HG1      VAL  29  -1.559  12.136  -4.448
  648   3HG1  VAL  29          3HG1      VAL  29  -2.670  10.802  -4.142
  649   1HG2  VAL  29          1HG2      VAL  29  -1.838  14.193  -2.480
  650   2HG2  VAL  29          2HG2      VAL  29  -3.569  13.924  -2.276
  651   3HG2  VAL  29          3HG2      VAL  29  -2.825  13.720  -3.863
  652    H    VAL  30           H        VAL  30  -2.635  10.386   0.058
  653    HA   VAL  30           HA       VAL  30  -2.056   7.812  -1.010
  654    HB   VAL  30           HB       VAL  30  -2.288   8.700   1.874
  655   1HG1  VAL  30          1HG1      VAL  30  -0.661   6.371   0.942
  656   2HG1  VAL  30          2HG1      VAL  30  -2.384   6.173   1.265
  657   3HG1  VAL  30          3HG1      VAL  30  -1.302   6.714   2.549
  658   1HG2  VAL  30          1HG2      VAL  30   0.353   8.223   0.672
  659   2HG2  VAL  30          2HG2      VAL  30  -0.178   9.474   1.796
  660   3HG2  VAL  30          3HG2      VAL  30  -0.515   9.638   0.074
  661    H    LYS  31           H        LYS  31  -4.571   9.067   1.205
  662    HA   LYS  31           HA       LYS  31  -6.031   6.805   1.703
  663   1HB   LYS  31          2HB       LYS  31  -6.928   9.629   1.195
  664   2HB   LYS  31          1HB       LYS  31  -8.073   8.362   1.605
  665   1HG   LYS  31          2HG       LYS  31  -6.930   7.984   3.710
  666   2HG   LYS  31          1HG       LYS  31  -5.742   9.223   3.299
  667   1HD   LYS  31          2HD       LYS  31  -7.468  10.918   3.270
  668   2HD   LYS  31          1HD       LYS  31  -8.709   9.697   3.555
  669   1HE   LYS  31          2HE       LYS  31  -7.706   9.179   5.726
  670   2HE   LYS  31          1HE       LYS  31  -6.459  10.394   5.442
  671   1HZ   LYS  31          1HZ       LYS  31  -7.870  12.076   5.900
  672   2HZ   LYS  31          2HZ       LYS  31  -8.695  10.888   6.777
  673   3HZ   LYS  31          3HZ       LYS  31  -9.213  11.304   5.222
  674    H    GLN  32           H        GLN  32  -6.288   8.956  -1.066
  675    HA   GLN  32           HA       GLN  32  -8.341   7.615  -2.424
  676   1HB   GLN  32          2HB       GLN  32  -7.268   9.926  -2.875
  677   2HB   GLN  32          1HB       GLN  32  -6.097   9.035  -3.838
  678   1HG   GLN  32          2HG       GLN  32  -7.715   8.350  -5.380
  679   2HG   GLN  32          1HG       GLN  32  -9.045   8.773  -4.298
  680   1HE2  GLN  32          1HE2      GLN  32  -9.762  10.841  -4.199
  681   2HE2  GLN  32          2HE2      GLN  32  -9.224  12.094  -5.260
  682    H    PHE  33           H        PHE  33  -4.887   7.111  -2.297
  683    HA   PHE  33           HA       PHE  33  -4.486   5.353  -4.408
  684   1HB   PHE  33          2HB       PHE  33  -2.749   6.387  -2.869
  685   2HB   PHE  33          1HB       PHE  33  -3.173   5.154  -1.687
  686    HD1  PHE  33           1HD      PHE  33  -2.225   5.384  -5.282
  687    HD2  PHE  33           2HD      PHE  33  -1.821   3.302  -1.580
  688    HE1  PHE  33           1HE      PHE  33  -0.609   3.843  -6.313
  689    HE2  PHE  33           2HE      PHE  33  -0.200   1.772  -2.620
  690    HZ   PHE  33           HZ       PHE  33   0.405   2.049  -4.993
  691    H    PHE  34           H        PHE  34  -4.971   4.478  -1.013
  692    HA   PHE  34           HA       PHE  34  -5.510   1.734  -1.545
  693   1HB   PHE  34          2HB       PHE  34  -6.118   3.346   0.937
  694   2HB   PHE  34          1HB       PHE  34  -6.073   1.584   0.826
  695    HD1  PHE  34           1HD      PHE  34  -3.764   0.926  -0.633
  696    HD2  PHE  34           2HD      PHE  34  -4.307   4.121   2.114
  697    HE1  PHE  34           1HE      PHE  34  -1.342   0.974  -0.220
  698    HE2  PHE  34           2HE      PHE  34  -1.886   4.173   2.543
  699    HZ   PHE  34           HZ       PHE  34  -0.409   2.600   1.362
  700    H    ASN  35           H        ASN  35  -7.551   4.534  -0.934
  701    HA   ASN  35           HA       ASN  35 -10.054   3.391  -0.691
  702   1HB   ASN  35          2HB       ASN  35  -9.607   5.811  -0.533
  703   2HB   ASN  35          1HB       ASN  35  -9.278   5.868  -2.260
  704   1HD2  ASN  35          1HD2      ASN  35 -11.372   6.947  -0.280
  705   2HD2  ASN  35          2HD2      ASN  35 -12.863   6.700  -1.119
  706    H    ASP  36           H        ASP  36  -8.113   3.995  -3.532
  707    HA   ASP  36           HA       ASP  36 -10.119   2.840  -5.315
  708   1HB   ASP  36          2HB       ASP  36  -7.487   4.190  -5.922
  709   2HB   ASP  36          1HB       ASP  36  -8.611   3.595  -7.137
  710    H    ASN  37           H        ASN  37  -7.082   1.945  -3.842
  711    HA   ASN  37           HA       ASN  37  -6.519  -0.160  -5.731
  712   1HB   ASN  37          2HB       ASN  37  -5.414   0.391  -2.967
  713   2HB   ASN  37          1HB       ASN  37  -4.872  -0.932  -3.991
  714   1HD2  ASN  37          1HD2      ASN  37  -3.658   1.654  -2.892
  715   2HD2  ASN  37          2HD2      ASN  37  -2.893   2.345  -4.279
  716    H    GLY  38           H        GLY  38  -7.937   0.149  -2.561
  717   1HA   GLY  38          2HA       GLY  38  -8.477  -1.868  -1.231
  718   2HA   GLY  38          1HA       GLY  38  -9.886  -1.161  -1.988
  719    H    VAL  39           H        VAL  39 -11.190  -2.576  -2.806
  720    HA   VAL  39           HA       VAL  39 -10.337  -5.271  -3.251
  721    HB   VAL  39           HB       VAL  39 -13.047  -4.001  -3.418
  722   1HG1  VAL  39          1HG1      VAL  39 -13.628  -6.588  -3.134
  723   2HG1  VAL  39          2HG1      VAL  39 -12.130  -6.753  -4.050
  724   3HG1  VAL  39          3HG1      VAL  39 -13.475  -5.829  -4.719
  725   1HG2  VAL  39          1HG2      VAL  39 -12.565  -3.998  -1.192
  726   2HG2  VAL  39          2HG2      VAL  39 -11.480  -5.385  -1.313
  727   3HG2  VAL  39          3HG2      VAL  39 -13.228  -5.627  -1.351
  728    H    ASP  40           H        ASP  40 -12.054  -2.972  -5.450
  729    HA   ASP  40           HA       ASP  40 -11.628  -4.827  -7.613
  730   1HB   ASP  40          2HB       ASP  40 -12.961  -2.123  -7.528
  731   2HB   ASP  40          1HB       ASP  40 -12.902  -3.160  -8.947
  732    H    GLY  41           H        GLY  41  -9.229  -3.422  -6.464
  733   1HA   GLY  41          2HA       GLY  41  -8.389  -1.504  -8.408
  734   2HA   GLY  41          1HA       GLY  41  -7.355  -2.313  -7.240
  735    H    GLU  42           H        GLU  42  -6.592  -1.771  -9.913
  736    HA   GLU  42           HA       GLU  42  -6.811  -4.288 -11.362
  737   1HB   GLU  42          2HB       GLU  42  -5.320  -1.744 -12.044
  738   2HB   GLU  42          1HB       GLU  42  -5.492  -3.133 -13.106
  739   1HG   GLU  42          2HG       GLU  42  -7.912  -2.808 -13.139
  740   2HG   GLU  42          1HG       GLU  42  -7.735  -1.409 -12.081
  741    H    TRP  43           H        TRP  43  -5.640  -5.815 -10.239
  742    HA   TRP  43           HA       TRP  43  -2.885  -5.178  -9.493
  743   1HB   TRP  43          2HB       TRP  43  -4.580  -7.589  -8.838
  744   2HB   TRP  43          1HB       TRP  43  -2.971  -7.267  -8.209
  745    HD1  TRP  43           HD       TRP  43  -5.733  -4.581  -8.370
  746    HE1  TRP  43           1HE      TRP  43  -6.313  -3.891  -5.953
  747    HE3  TRP  43           3HE      TRP  43  -2.872  -7.974  -5.865
  748    HZ2  TRP  43           2HZ      TRP  43  -5.630  -4.682  -3.341
  749    HZ3  TRP  43           3HZ      TRP  43  -2.883  -7.941  -3.416
  750    HH2  TRP  43           HH       TRP  43  -4.233  -6.329  -2.173
  751    H    THR  44           H        THR  44  -1.245  -5.766 -10.742
  752    HA   THR  44           HA       THR  44  -1.609  -8.000 -12.621
  753    HB   THR  44           HB       THR  44   0.369  -7.045 -13.804
  754    HG1  THR  44           1HG      THR  44   0.053  -4.881 -12.004
  755   1HG2  THR  44          1HG2      THR  44  -0.711  -5.282 -14.890
  756   2HG2  THR  44          2HG2      THR  44  -1.661  -4.870 -13.462
  757   3HG2  THR  44          3HG2      THR  44  -2.007  -6.352 -14.355
  758    H    TYR  45           H        TYR  45  -0.330  -9.799 -12.430
  759    HA   TYR  45           HA       TYR  45   1.518  -9.825 -10.144
  760   1HB   TYR  45          2HB       TYR  45  -0.359 -11.381  -9.983
  761   2HB   TYR  45          1HB       TYR  45   0.096 -12.110 -11.519
  762    HD1  TYR  45           1HD      TYR  45   2.318 -11.123  -8.705
  763    HD2  TYR  45           2HD      TYR  45   0.601 -14.316 -10.931
  764    HE1  TYR  45           1HE      TYR  45   3.760 -12.720  -7.514
  765    HE2  TYR  45           2HE      TYR  45   2.037 -15.922  -9.744
  766    HH   TYR  45           HH       TYR  45   3.828 -15.080  -6.961
  767    H    ASP  46           H        ASP  46   3.583 -10.576 -10.300
  768    HA   ASP  46           HA       ASP  46   4.551 -11.269 -12.995
  769   1HB   ASP  46          2HB       ASP  46   5.272  -8.998 -12.385
  770   2HB   ASP  46          1HB       ASP  46   5.993  -9.621 -10.903
  771    H    ASP  47           H        ASP  47   4.241 -13.478 -12.354
  772    HA   ASP  47           HA       ASP  47   5.183 -14.801 -10.164
  773   1HB   ASP  47          2HB       ASP  47   5.279 -15.782 -13.024
  774   2HB   ASP  47          1HB       ASP  47   5.385 -16.805 -11.595
  775    H    ALA  48           H        ALA  48   7.057 -13.704 -12.921
  776    HA   ALA  48           HA       ALA  48   9.410 -15.072 -12.618
  777   1HB   ALA  48          1HB       ALA  48   8.595 -13.080 -14.224
  778   2HB   ALA  48          2HB       ALA  48  10.271 -13.616 -14.103
  779   3HB   ALA  48          3HB       ALA  48   9.729 -12.204 -13.196
  780    H    THR  49           H        THR  49   8.261 -12.368 -10.682
  781    HA   THR  49           HA       THR  49  10.603 -12.749  -8.938
  782    HB   THR  49           HB       THR  49  10.566 -10.329  -8.441
  783    HG1  THR  49           1HG      THR  49   9.027  -9.116  -9.167
  784   1HG2  THR  49          1HG2      THR  49  11.318 -11.465 -10.981
  785   2HG2  THR  49          2HG2      THR  49  12.143 -10.263  -9.989
  786   3HG2  THR  49          3HG2      THR  49  10.892  -9.759 -11.127
  787    H    LYS  50           H        LYS  50   7.539 -13.469  -8.986
  788    HA   LYS  50           HA       LYS  50   5.860 -13.709  -7.443
  789   1HB   LYS  50          2HB       LYS  50   8.210 -13.398  -5.564
  790   2HB   LYS  50          1HB       LYS  50   6.605 -13.904  -5.059
  791   1HG   LYS  50          2HG       LYS  50   8.308 -15.378  -7.056
  792   2HG   LYS  50          1HG       LYS  50   8.200 -15.771  -5.338
  793   1HD   LYS  50          2HD       LYS  50   5.749 -16.086  -5.628
  794   2HD   LYS  50          1HD       LYS  50   5.964 -15.843  -7.363
  795   1HE   LYS  50          2HE       LYS  50   7.271 -18.005  -5.716
  796   2HE   LYS  50          1HE       LYS  50   5.873 -18.224  -6.766
  797   1HZ   LYS  50          1HZ       LYS  50   7.204 -18.455  -8.505
  798   2HZ   LYS  50          2HZ       LYS  50   8.537 -18.422  -7.464
  799   3HZ   LYS  50          3HZ       LYS  50   7.992 -16.992  -8.186
  800    H    THR  51           H        THR  51   6.498 -11.031  -8.422
  801    HA   THR  51           HA       THR  51   5.784  -9.368  -6.117
  802    HB   THR  51           HB       THR  51   6.870  -8.611  -8.832
  803    HG1  THR  51           1HG      THR  51   8.022  -8.849  -6.273
  804   1HG2  THR  51          1HG2      THR  51   5.674  -6.963  -6.765
  805   2HG2  THR  51          2HG2      THR  51   6.095  -6.573  -8.431
  806   3HG2  THR  51          3HG2      THR  51   7.323  -6.484  -7.167
  807    H    PHE  52           H        PHE  52   4.061  -7.879  -6.217
  808    HA   PHE  52           HA       PHE  52   2.155  -8.350  -8.414
  809   1HB   PHE  52          2HB       PHE  52   1.463  -7.938  -5.507
  810   2HB   PHE  52          1HB       PHE  52   0.315  -8.112  -6.828
  811    HD1  PHE  52           1HD      PHE  52  -0.512 -10.201  -7.365
  812    HD2  PHE  52           2HD      PHE  52   3.101  -9.905  -5.137
  813    HE1  PHE  52           1HE      PHE  52  -0.519 -12.640  -7.037
  814    HE2  PHE  52           2HE      PHE  52   3.101 -12.342  -4.808
  815    HZ   PHE  52           HZ       PHE  52   1.290 -13.714  -5.758
  816    H    THR  53           H        THR  53   2.598  -6.560  -9.508
  817    HA   THR  53           HA       THR  53   2.746  -3.954  -8.317
  818    HB   THR  53           HB       THR  53   2.510  -3.214 -10.804
  819    HG1  THR  53           1HG      THR  53   3.304  -5.887 -11.224
  820   1HG2  THR  53          1HG2      THR  53   4.609  -2.870 -10.005
  821   2HG2  THR  53          2HG2      THR  53   4.925  -4.106 -11.224
  822   3HG2  THR  53          3HG2      THR  53   4.827  -4.554  -9.521
  823    H    VAL  54           H        VAL  54   1.199  -2.601  -7.836
  824    HA   VAL  54           HA       VAL  54  -1.510  -3.118  -8.876
  825    HB   VAL  54           HB       VAL  54  -0.725  -1.782  -6.268
  826   1HG1  VAL  54          1HG1      VAL  54  -2.723  -0.764  -6.667
  827   2HG1  VAL  54          2HG1      VAL  54  -3.323  -2.266  -5.967
  828   3HG1  VAL  54          3HG1      VAL  54  -3.301  -2.057  -7.718
  829   1HG2  VAL  54          1HG2      VAL  54  -1.540  -3.732  -5.165
  830   2HG2  VAL  54          2HG2      VAL  54  -0.388  -4.259  -6.392
  831   3HG2  VAL  54          3HG2      VAL  54  -2.121  -4.420  -6.682
  832    H    THR  55           H        THR  55  -1.989  -1.727 -10.449
  833    HA   THR  55           HA       THR  55  -0.841   0.962 -10.359
  834    HB   THR  55           HB       THR  55  -2.260  -0.386 -12.655
  835    HG1  THR  55           1HG      THR  55   0.479  -0.229 -11.965
  836   1HG2  THR  55          1HG2      THR  55  -1.018   1.277 -14.013
  837   2HG2  THR  55          2HG2      THR  55  -0.552   2.084 -12.516
  838   3HG2  THR  55          3HG2      THR  55  -2.253   1.981 -12.971
  839    H    GLU  56           H        GLU  56  -2.021   2.539  -9.546
  840    HA   GLU  56           HA       GLU  56  -4.620   2.476  -8.725
  841   1HB   GLU  56          2HB       GLU  56  -3.063   4.269  -8.151
  842   2HB   GLU  56          1HB       GLU  56  -3.106   4.860  -9.807
  843   1HG   GLU  56          2HG       GLU  56  -4.480   6.248  -8.407
  844   2HG   GLU  56          1HG       GLU  56  -5.496   5.364  -9.543
  Start of MODEL   36
    1   1H    MET   1          1HT       MET   1   5.863 -18.625   2.506
    2   2H    MET   1          2HT       MET   1   6.406 -19.748   1.364
    3   3H    MET   1          3HT       MET   1   5.245 -18.598   0.931
    4    HA   MET   1           HA       MET   1   8.049 -18.024   1.702
    5   1HB   MET   1          2HB       MET   1   6.632 -17.937  -0.969
    6   2HB   MET   1          1HB       MET   1   8.270 -17.370  -0.685
    7   1HG   MET   1          2HG       MET   1   8.942 -19.634  -0.062
    8   2HG   MET   1          1HG       MET   1   7.300 -20.199  -0.363
    9   1HE   MET   1          1HE       MET   1   6.908 -19.739  -4.194
   10   2HE   MET   1          2HE       MET   1   6.627 -18.389  -3.095
   11   3HE   MET   1          3HE       MET   1   6.109 -20.014  -2.645
   12    H    GLN   2           H        GLN   2   8.556 -15.769   0.676
   13    HA   GLN   2           HA       GLN   2   6.483 -13.908   1.609
   14   1HB   GLN   2          2HB       GLN   2   8.599 -13.780   2.852
   15   2HB   GLN   2          1HB       GLN   2   9.473 -13.506   1.351
   16   1HG   GLN   2          2HG       GLN   2   8.267 -11.406   1.032
   17   2HG   GLN   2          1HG       GLN   2   7.395 -11.679   2.539
   18   1HE2  GLN   2          1HE2      GLN   2  10.420 -12.864   3.056
   19   2HE2  GLN   2          2HE2      GLN   2  11.165 -11.463   3.731
   20    H    TYR   3           H        TYR   3   5.969 -12.101   0.334
   21    HA   TYR   3           HA       TYR   3   7.025 -12.151  -2.412
   22   1HB   TYR   3          2HB       TYR   3   4.133 -11.788  -1.604
   23   2HB   TYR   3          1HB       TYR   3   4.756 -11.637  -3.244
   24    HD1  TYR   3           1HD      TYR   3   4.488 -13.464  -4.624
   25    HD2  TYR   3           2HD      TYR   3   4.843 -14.106  -0.434
   26    HE1  TYR   3           1HE      TYR   3   4.168 -15.878  -4.973
   27    HE2  TYR   3           2HE      TYR   3   4.525 -16.522  -0.771
   28    HH   TYR   3           HH       TYR   3   4.729 -18.184  -2.495
   29    H    LYS   4           H        LYS   4   7.135 -10.164  -3.485
   30    HA   LYS   4           HA       LYS   4   6.956  -7.838  -1.685
   31   1HB   LYS   4          2HB       LYS   4   9.217  -8.285  -2.511
   32   2HB   LYS   4          1HB       LYS   4   8.637  -8.228  -4.171
   33   1HG   LYS   4          2HG       LYS   4   8.064  -5.880  -3.909
   34   2HG   LYS   4          1HG       LYS   4   8.592  -5.928  -2.226
   35   1HD   LYS   4          2HD       LYS   4  10.344  -6.458  -4.627
   36   2HD   LYS   4          1HD       LYS   4  10.292  -4.948  -3.714
   37   1HE   LYS   4          2HE       LYS   4  11.097  -7.652  -2.643
   38   2HE   LYS   4          1HE       LYS   4  12.185  -6.319  -3.024
   39   1HZ   LYS   4          1HZ       LYS   4  11.929  -5.894  -0.843
   40   2HZ   LYS   4          2HZ       LYS   4  10.439  -6.687  -0.733
   41   3HZ   LYS   4          3HZ       LYS   4  10.514  -5.115  -1.348
   42    H    VAL   5           H        VAL   5   5.084  -6.818  -1.997
   43    HA   VAL   5           HA       VAL   5   3.925  -6.732  -4.668
   44    HB   VAL   5           HB       VAL   5   2.772  -5.769  -2.049
   45   1HG1  VAL   5          1HG1      VAL   5   0.862  -6.406  -4.111
   46   2HG1  VAL   5          2HG1      VAL   5   1.988  -5.166  -4.660
   47   3HG1  VAL   5          3HG1      VAL   5   1.058  -4.920  -3.184
   48   1HG2  VAL   5          1HG2      VAL   5   2.586  -7.960  -1.633
   49   2HG2  VAL   5          2HG2      VAL   5   2.912  -8.406  -3.308
   50   3HG2  VAL   5          3HG2      VAL   5   1.286  -7.921  -2.826
   51    H    ILE   6           H        ILE   6   4.118  -5.089  -5.953
   52    HA   ILE   6           HA       ILE   6   5.219  -2.565  -4.974
   53    HB   ILE   6           HB       ILE   6   4.887  -3.689  -7.756
   54   1HG1  ILE   6          2HG1      ILE   6   7.346  -2.897  -6.182
   55   2HG1  ILE   6          1HG1      ILE   6   6.769  -4.545  -6.395
   56   1HG2  ILE   6          1HG2      ILE   6   4.658  -1.553  -8.409
   57   2HG2  ILE   6          2HG2      ILE   6   6.399  -1.475  -8.128
   58   3HG2  ILE   6          3HG2      ILE   6   5.278  -0.911  -6.888
   59   1HD1  ILE   6          1HD1      ILE   6   7.789  -2.694  -8.533
   60   2HD1  ILE   6          2HD1      ILE   6   7.081  -4.279  -8.840
   61   3HD1  ILE   6          3HD1      ILE   6   8.574  -4.146  -7.912
   62    H    LEU   7           H        LEU   7   3.920  -0.926  -4.558
   63    HA   LEU   7           HA       LEU   7   1.200  -0.933  -5.657
   64   1HB   LEU   7          2HB       LEU   7   2.216   0.957  -3.550
   65   2HB   LEU   7          1HB       LEU   7   0.571   0.422  -3.843
   66    HG   LEU   7           HG       LEU   7   2.796  -1.196  -2.616
   67   1HD1  LEU   7          1HD1      LEU   7   1.831   0.391  -1.084
   68   2HD1  LEU   7          2HD1      LEU   7   1.276  -1.233  -0.672
   69   3HD1  LEU   7          3HD1      LEU   7   0.202  -0.123  -1.524
   70   1HD2  LEU   7          1HD2      LEU   7  -0.011  -2.009  -3.361
   71   2HD2  LEU   7          2HD2      LEU   7   1.081  -2.954  -2.346
   72   3HD2  LEU   7          3HD2      LEU   7   1.491  -2.644  -4.033
   73    H    ASN   8           H        ASN   8   1.686  -0.182  -7.756
   74    HA   ASN   8           HA       ASN   8   3.026   2.393  -8.017
   75   1HB   ASN   8          2HB       ASN   8   3.641   0.401  -9.421
   76   2HB   ASN   8          1HB       ASN   8   2.058   0.526 -10.179
   77   1HD2  ASN   8          1HD2      ASN   8   5.087   1.044 -10.809
   78   2HD2  ASN   8          2HD2      ASN   8   5.015   2.482 -11.768
   79    H    GLY   9           H        GLY   9   1.690   4.106  -7.729
   80   1HA   GLY   9          2HA       GLY   9  -0.912   4.020  -9.132
   81   2HA   GLY   9          1HA       GLY   9  -0.646   4.904  -7.639
   82    H    LYS  10           H        LYS  10  -1.602   6.651  -8.957
   83    HA   LYS  10           HA       LYS  10  -0.045   7.776 -11.086
   84   1HB   LYS  10          2HB       LYS  10  -2.337   8.946  -9.504
   85   2HB   LYS  10          1HB       LYS  10  -1.666   9.634 -10.976
   86   1HG   LYS  10          2HG       LYS  10  -2.313   7.575 -12.181
   87   2HG   LYS  10          1HG       LYS  10  -3.079   6.990 -10.705
   88   1HD   LYS  10          2HD       LYS  10  -3.809   9.545 -12.135
   89   2HD   LYS  10          1HD       LYS  10  -4.676   8.017 -12.297
   90   1HE   LYS  10          2HE       LYS  10  -5.890   9.305 -10.730
   91   2HE   LYS  10          1HE       LYS  10  -5.024   8.088  -9.798
   92   1HZ   LYS  10          1HZ       LYS  10  -3.508  10.491 -10.098
   93   2HZ   LYS  10          2HZ       LYS  10  -3.934   9.655  -8.689
   94   3HZ   LYS  10          3HZ       LYS  10  -5.003  10.783  -9.360
   95    H    THR  11           H        THR  11  -0.862   8.929  -7.802
   96    HA   THR  11           HA       THR  11   1.490  10.670  -7.887
   97    HB   THR  11           HB       THR  11   0.257  11.697  -5.860
   98    HG1  THR  11           1HG      THR  11  -2.030  11.342  -6.009
   99   1HG2  THR  11          1HG2      THR  11  -0.417  13.307  -7.224
  100   2HG2  THR  11          2HG2      THR  11  -1.566  12.238  -8.028
  101   3HG2  THR  11          3HG2      THR  11   0.117  12.283  -8.556
  102    H    LEU  12           H        LEU  12   0.868   7.674  -6.935
  103    HA   LEU  12           HA       LEU  12   2.646   7.911  -4.630
  104   1HB   LEU  12          2HB       LEU  12   0.388   7.764  -3.735
  105   2HB   LEU  12          1HB       LEU  12   0.096   6.306  -4.665
  106    HG   LEU  12           HG       LEU  12   1.679   5.073  -3.345
  107   1HD1  LEU  12          1HD1      LEU  12   2.614   7.723  -2.689
  108   2HD1  LEU  12          2HD1      LEU  12   3.441   6.177  -2.560
  109   3HD1  LEU  12          3HD1      LEU  12   2.397   6.734  -1.248
  110   1HD2  LEU  12          1HD2      LEU  12   0.183   4.738  -1.731
  111   2HD2  LEU  12          2HD2      LEU  12  -0.704   6.117  -2.379
  112   3HD2  LEU  12          3HD2      LEU  12   0.444   6.349  -1.062
  113    H    LYS  13           H        LYS  13   4.125   6.359  -4.427
  114    HA   LYS  13           HA       LYS  13   3.922   3.906  -5.981
  115   1HB   LYS  13          2HB       LYS  13   6.247   5.823  -6.269
  116   2HB   LYS  13          1HB       LYS  13   6.181   4.199  -6.943
  117   1HG   LYS  13          2HG       LYS  13   4.269   4.855  -8.323
  118   2HG   LYS  13          1HG       LYS  13   4.357   6.486  -7.657
  119   1HD   LYS  13          2HD       LYS  13   6.596   6.756  -8.583
  120   2HD   LYS  13          1HD       LYS  13   6.540   5.111  -9.222
  121   1HE   LYS  13          2HE       LYS  13   4.624   5.734 -10.622
  122   2HE   LYS  13          1HE       LYS  13   4.703   7.378  -9.991
  123   1HZ   LYS  13          1HZ       LYS  13   5.794   7.307 -12.097
  124   2HZ   LYS  13          2HZ       LYS  13   6.760   6.001 -11.628
  125   3HZ   LYS  13          3HZ       LYS  13   6.981   7.515 -10.909
  126    H    GLY  14           H        GLY  14   5.175   2.206  -5.123
  127   1HA   GLY  14          2HA       GLY  14   7.169   2.566  -3.163
  128   2HA   GLY  14          1HA       GLY  14   5.627   2.320  -2.363
  129    H    GLU  15           H        GLU  15   6.923   0.491  -1.506
  130    HA   GLU  15           HA       GLU  15   6.288  -1.894  -3.048
  131   1HB   GLU  15          2HB       GLU  15   9.052  -1.369  -1.931
  132   2HB   GLU  15          1HB       GLU  15   8.514  -2.873  -2.666
  133   1HG   GLU  15          2HG       GLU  15   8.178  -1.721  -4.791
  134   2HG   GLU  15          1HG       GLU  15   8.710  -0.209  -4.055
  135    H    THR  16           H        THR  16   5.600  -3.520  -1.806
  136    HA   THR  16           HA       THR  16   6.070  -3.392   1.081
  137    HB   THR  16           HB       THR  16   3.927  -2.522   1.067
  138    HG1  THR  16           1HG      THR  16   3.394  -5.281   1.009
  139   1HG2  THR  16          1HG2      THR  16   3.388  -4.248  -1.309
  140   2HG2  THR  16          2HG2      THR  16   3.239  -2.500  -1.150
  141   3HG2  THR  16          3HG2      THR  16   2.077  -3.563  -0.354
  142    H    THR  17           H        THR  17   5.374  -5.525   2.166
  143    HA   THR  17           HA       THR  17   5.685  -7.795   0.353
  144    HB   THR  17           HB       THR  17   7.425  -8.766   1.882
  145    HG1  THR  17           1HG      THR  17   7.205  -7.510   3.685
  146   1HG2  THR  17          1HG2      THR  17   8.474  -8.064  -0.001
  147   2HG2  THR  17          2HG2      THR  17   9.224  -6.983   1.173
  148   3HG2  THR  17          3HG2      THR  17   7.902  -6.404   0.160
  149    H    THR  18           H        THR  18   4.141  -9.177   0.756
  150    HA   THR  18           HA       THR  18   3.075  -9.488   3.496
  151    HB   THR  18           HB       THR  18   1.452  -8.921   1.696
  152    HG1  THR  18           1HG      THR  18   0.881 -10.273   3.507
  153   1HG2  THR  18          1HG2      THR  18   1.197 -11.467   0.464
  154   2HG2  THR  18          2HG2      THR  18   2.836 -10.868   0.202
  155   3HG2  THR  18          3HG2      THR  18   1.451  -9.889  -0.285
  156    H    GLU  19           H        GLU  19   3.127 -11.478   4.486
  157    HA   GLU  19           HA       GLU  19   4.789 -13.539   3.195
  158   1HB   GLU  19          2HB       GLU  19   5.541 -12.752   5.395
  159   2HB   GLU  19          1HB       GLU  19   3.982 -13.167   6.093
  160   1HG   GLU  19          2HG       GLU  19   5.639 -14.833   6.652
  161   2HG   GLU  19          1HG       GLU  19   4.394 -15.526   5.613
  162    H    ALA  20           H        ALA  20   3.555 -14.994   2.078
  163    HA   ALA  20           HA       ALA  20   1.337 -16.236   3.514
  164   1HB   ALA  20          1HB       ALA  20   0.737 -14.277   1.805
  165   2HB   ALA  20          2HB       ALA  20  -0.295 -15.687   2.045
  166   3HB   ALA  20          3HB       ALA  20   0.806 -15.624   0.669
  167    H    VAL  21           H        VAL  21   0.797 -18.286   2.839
  168    HA   VAL  21           HA       VAL  21   2.804 -20.026   2.149
  169    HB   VAL  21           HB       VAL  21  -0.102 -20.514   1.511
  170   1HG1  VAL  21          1HG1      VAL  21   0.376 -22.815   1.765
  171   2HG1  VAL  21          2HG1      VAL  21   1.976 -22.484   2.428
  172   3HG1  VAL  21          3HG1      VAL  21   1.643 -22.160   0.727
  173   1HG2  VAL  21          1HG2      VAL  21   0.011 -21.560   3.895
  174   2HG2  VAL  21          2HG2      VAL  21  -0.260 -19.826   3.704
  175   3HG2  VAL  21          3HG2      VAL  21   1.344 -20.429   4.121
  176    H    ASP  22           H        ASP  22   0.552 -18.409  -0.027
  177    HA   ASP  22           HA       ASP  22   2.298 -19.103  -2.257
  178   1HB   ASP  22          2HB       ASP  22   0.487 -19.905  -3.679
  179   2HB   ASP  22          1HB       ASP  22   0.618 -20.898  -2.232
  180    H    ALA  23           H        ALA  23   1.475 -17.995  -4.343
  181    HA   ALA  23           HA       ALA  23   1.509 -15.246  -3.928
  182   1HB   ALA  23          1HB       ALA  23   1.085 -15.021  -6.301
  183   2HB   ALA  23          2HB       ALA  23   0.531 -16.692  -6.383
  184   3HB   ALA  23          3HB       ALA  23   2.218 -16.341  -6.012
  185    H    ALA  24           H        ALA  24  -1.232 -17.385  -4.583
  186    HA   ALA  24           HA       ALA  24  -3.173 -15.351  -4.812
  187   1HB   ALA  24          1HB       ALA  24  -3.372 -17.847  -5.409
  188   2HB   ALA  24          2HB       ALA  24  -4.787 -17.047  -4.724
  189   3HB   ALA  24          3HB       ALA  24  -3.780 -18.080  -3.709
  190    H    THR  25           H        THR  25  -2.288 -17.400  -2.022
  191    HA   THR  25           HA       THR  25  -3.964 -16.240  -0.145
  192    HB   THR  25           HB       THR  25  -2.307 -17.031   1.527
  193    HG1  THR  25           1HG      THR  25  -0.340 -17.435   1.009
  194   1HG2  THR  25          1HG2      THR  25  -2.967 -18.904  -0.706
  195   2HG2  THR  25          2HG2      THR  25  -3.754 -18.743   0.863
  196   3HG2  THR  25          3HG2      THR  25  -2.132 -19.428   0.756
  197    H    ALA  26           H        ALA  26  -0.697 -15.359  -1.164
  198    HA   ALA  26           HA       ALA  26  -0.340 -13.165   0.557
  199   1HB   ALA  26          1HB       ALA  26   0.975 -14.259  -1.794
  200   2HB   ALA  26          2HB       ALA  26   1.665 -13.422  -0.406
  201   3HB   ALA  26          3HB       ALA  26   1.021 -12.497  -1.762
  202    H    GLU  27           H        GLU  27  -1.475 -13.308  -2.834
  203    HA   GLU  27           HA       GLU  27  -2.057 -10.656  -3.232
  204   1HB   GLU  27          2HB       GLU  27  -2.177 -12.339  -5.002
  205   2HB   GLU  27          1HB       GLU  27  -3.586 -13.059  -4.236
  206   1HG   GLU  27          2HG       GLU  27  -4.846 -11.000  -4.617
  207   2HG   GLU  27          1HG       GLU  27  -3.433 -10.285  -5.391
  208    H    LYS  28           H        LYS  28  -4.176 -13.174  -1.876
  209    HA   LYS  28           HA       LYS  28  -6.407 -11.528  -1.436
  210   1HB   LYS  28          2HB       LYS  28  -5.505 -13.997   0.059
  211   2HB   LYS  28          1HB       LYS  28  -7.095 -13.258   0.214
  212   1HG   LYS  28          2HG       LYS  28  -5.929 -14.459  -2.288
  213   2HG   LYS  28          1HG       LYS  28  -7.182 -15.168  -1.267
  214   1HD   LYS  28          2HD       LYS  28  -7.414 -12.540  -2.732
  215   2HD   LYS  28          1HD       LYS  28  -8.098 -14.073  -3.282
  216   1HE   LYS  28          2HE       LYS  28  -8.781 -12.640  -0.716
  217   2HE   LYS  28          1HE       LYS  28  -9.782 -12.698  -2.167
  218   1HZ   LYS  28          1HZ       LYS  28  -9.493 -14.634  -0.078
  219   2HZ   LYS  28          2HZ       LYS  28  -9.280 -15.316  -1.610
  220   3HZ   LYS  28          3HZ       LYS  28 -10.707 -14.483  -1.248
  221    H    VAL  29           H        VAL  29  -3.635 -12.339   0.593
  222    HA   VAL  29           HA       VAL  29  -4.416 -11.028   2.923
  223    HB   VAL  29           HB       VAL  29  -1.644 -11.428   1.781
  224   1HG1  VAL  29          1HG1      VAL  29  -1.124 -11.232   4.354
  225   2HG1  VAL  29          2HG1      VAL  29  -2.570 -10.224   4.336
  226   3HG1  VAL  29          3HG1      VAL  29  -1.188  -9.803   3.323
  227   1HG2  VAL  29          1HG2      VAL  29  -1.632 -13.479   2.703
  228   2HG2  VAL  29          2HG2      VAL  29  -3.387 -13.324   2.622
  229   3HG2  VAL  29          3HG2      VAL  29  -2.536 -12.960   4.124
  230    H    VAL  30           H        VAL  30  -2.787  -9.821   0.036
  231    HA   VAL  30           HA       VAL  30  -2.355  -7.197   1.027
  232    HB   VAL  30           HB       VAL  30  -2.708  -8.016  -1.862
  233   1HG1  VAL  30          1HG1      VAL  30  -0.891  -5.841  -0.963
  234   2HG1  VAL  30          2HG1      VAL  30  -2.626  -5.524  -0.976
  235   3HG1  VAL  30          3HG1      VAL  30  -1.805  -6.001  -2.461
  236   1HG2  VAL  30          1HG2      VAL  30  -0.863  -9.102  -0.192
  237   2HG2  VAL  30          2HG2      VAL  30   0.014  -7.701  -0.809
  238   3HG2  VAL  30          3HG2      VAL  30  -0.640  -8.895  -1.930
  239    H    LYS  31           H        LYS  31  -4.891  -8.664  -1.030
  240    HA   LYS  31           HA       LYS  31  -6.480  -6.468  -1.474
  241   1HB   LYS  31          2HB       LYS  31  -7.365  -9.288  -0.867
  242   2HB   LYS  31          1HB       LYS  31  -8.425  -8.032  -1.489
  243   1HG   LYS  31          2HG       LYS  31  -6.892  -7.853  -3.457
  244   2HG   LYS  31          1HG       LYS  31  -6.076  -9.299  -2.859
  245   1HD   LYS  31          2HD       LYS  31  -7.637 -10.116  -4.402
  246   2HD   LYS  31          1HD       LYS  31  -8.405 -10.365  -2.830
  247   1HE   LYS  31          2HE       LYS  31 -10.006  -9.451  -4.407
  248   2HE   LYS  31          1HE       LYS  31  -9.667  -8.281  -3.132
  249   1HZ   LYS  31          1HZ       LYS  31  -9.623  -7.705  -5.737
  250   2HZ   LYS  31          2HZ       LYS  31  -7.989  -8.065  -5.483
  251   3HZ   LYS  31          3HZ       LYS  31  -8.741  -6.854  -4.571
  252    H    GLN  32           H        GLN  32  -6.551  -8.662   1.301
  253    HA   GLN  32           HA       GLN  32  -8.593  -7.348   2.720
  254   1HB   GLN  32          2HB       GLN  32  -7.484  -9.657   3.140
  255   2HB   GLN  32          1HB       GLN  32  -6.295  -8.751   4.065
  256   1HG   GLN  32          2HG       GLN  32  -8.057  -9.698   5.474
  257   2HG   GLN  32          1HG       GLN  32  -8.012  -7.935   5.550
  258   1HE2  GLN  32          1HE2      GLN  32  -9.857 -10.698   4.753
  259   2HE2  GLN  32          2HE2      GLN  32 -11.291  -9.881   4.244
  260    H    PHE  33           H        PHE  33  -5.138  -6.897   2.531
  261    HA   PHE  33           HA       PHE  33  -4.672  -5.108   4.598
  262   1HB   PHE  33          2HB       PHE  33  -2.990  -6.232   3.070
  263   2HB   PHE  33          1HB       PHE  33  -3.392  -5.029   1.854
  264    HD1  PHE  33           1HD      PHE  33  -2.201  -5.322   5.361
  265    HD2  PHE  33           2HD      PHE  33  -2.162  -3.079   1.732
  266    HE1  PHE  33           1HE      PHE  33  -0.492  -3.814   6.296
  267    HE2  PHE  33           2HE      PHE  33  -0.456  -1.581   2.676
  268    HZ   PHE  33           HZ       PHE  33   0.377  -1.956   4.964
  269    H    PHE  34           H        PHE  34  -5.246  -4.306   1.191
  270    HA   PHE  34           HA       PHE  34  -5.701  -1.526   1.679
  271   1HB   PHE  34          2HB       PHE  34  -6.390  -3.191  -0.745
  272   2HB   PHE  34          1HB       PHE  34  -6.378  -1.427  -0.678
  273    HD1  PHE  34           1HD      PHE  34  -3.994  -0.860   0.862
  274    HD2  PHE  34           2HD      PHE  34  -4.651  -3.783  -2.154
  275    HE1  PHE  34           1HE      PHE  34  -1.590  -0.872   0.360
  276    HE2  PHE  34           2HE      PHE  34  -2.250  -3.800  -2.668
  277    HZ   PHE  34           HZ       PHE  34  -0.719  -2.342  -1.393
  278    H    ASN  35           H        ASN  35  -7.784  -4.306   1.209
  279    HA   ASN  35           HA       ASN  35 -10.274  -3.150   0.990
  280   1HB   ASN  35          2HB       ASN  35  -9.761  -5.592   0.923
  281   2HB   ASN  35          1HB       ASN  35  -9.552  -5.567   2.670
  282   1HD2  ASN  35          1HD2      ASN  35 -11.500  -6.676   0.534
  283   2HD2  ASN  35          2HD2      ASN  35 -13.046  -6.428   1.269
  284    H    ASP  36           H        ASP  36  -8.299  -3.699   3.809
  285    HA   ASP  36           HA       ASP  36 -10.255  -2.438   5.574
  286   1HB   ASP  36          2HB       ASP  36  -7.654  -3.842   6.182
  287   2HB   ASP  36          1HB       ASP  36  -8.723  -3.155   7.400
  288    H    ASN  37           H        ASN  37  -7.260  -1.644   3.984
  289    HA   ASN  37           HA       ASN  37  -6.619   0.518   5.796
  290   1HB   ASN  37          2HB       ASN  37  -5.542  -0.164   3.051
  291   2HB   ASN  37          1HB       ASN  37  -4.960   1.174   4.029
  292   1HD2  ASN  37          1HD2      ASN  37  -3.785  -1.438   3.001
  293   2HD2  ASN  37          2HD2      ASN  37  -3.048  -2.126   4.406
  294    H    GLY  38           H        GLY  38  -7.935   0.162   2.565
  295   1HA   GLY  38          2HA       GLY  38  -8.405   2.193   1.220
  296   2HA   GLY  38          1HA       GLY  38  -9.852   1.472   1.888
  297    H    VAL  39           H        VAL  39 -11.202   2.839   2.748
  298    HA   VAL  39           HA       VAL  39 -10.213   5.478   3.597
  299    HB   VAL  39           HB       VAL  39 -13.015   4.687   2.889
  300   1HG1  VAL  39          1HG1      VAL  39 -13.371   6.677   3.899
  301   2HG1  VAL  39          2HG1      VAL  39 -12.842   7.323   2.345
  302   3HG1  VAL  39          3HG1      VAL  39 -11.701   7.205   3.685
  303   1HG2  VAL  39          1HG2      VAL  39 -11.008   6.050   1.103
  304   2HG2  VAL  39          2HG2      VAL  39 -12.650   5.559   0.685
  305   3HG2  VAL  39          3HG2      VAL  39 -11.421   4.339   1.012
  306    H    ASP  40           H        ASP  40 -11.030   2.714   5.219
  307    HA   ASP  40           HA       ASP  40 -12.262   4.286   7.376
  308   1HB   ASP  40          2HB       ASP  40 -12.850   1.412   6.647
  309   2HB   ASP  40          1HB       ASP  40 -13.493   2.254   8.054
  310    H    GLY  41           H        GLY  41  -9.423   3.146   6.618
  311   1HA   GLY  41          2HA       GLY  41  -8.860   1.437   8.881
  312   2HA   GLY  41          1HA       GLY  41  -7.700   2.029   7.704
  313    H    GLU  42           H        GLU  42  -6.789   1.992  10.160
  314    HA   GLU  42           HA       GLU  42  -7.235   4.607  11.398
  315   1HB   GLU  42          2HB       GLU  42  -5.628   2.228  12.352
  316   2HB   GLU  42          1HB       GLU  42  -5.877   3.714  13.259
  317   1HG   GLU  42          2HG       GLU  42  -8.023   1.777  12.415
  318   2HG   GLU  42          1HG       GLU  42  -7.345   1.938  14.036
  319    H    TRP  43           H        TRP  43  -6.138   6.096  10.215
  320    HA   TRP  43           HA       TRP  43  -3.430   5.558   9.329
  321   1HB   TRP  43          2HB       TRP  43  -5.258   7.925   8.929
  322   2HB   TRP  43          1HB       TRP  43  -3.648   7.783   8.232
  323    HD1  TRP  43           HD       TRP  43  -6.768   5.445   8.259
  324    HE1  TRP  43           1HE      TRP  43  -7.116   4.593   5.858
  325    HE3  TRP  43           3HE      TRP  43  -2.876   7.848   6.003
  326    HZ2  TRP  43           2HZ      TRP  43  -5.875   4.906   3.322
  327    HZ3  TRP  43           3HZ      TRP  43  -2.519   7.526   3.599
  328    HH2  TRP  43           HH       TRP  43  -3.992   6.086   2.283
  329    H    THR  44           H        THR  44  -1.805   5.874  10.703
  330    HA   THR  44           HA       THR  44  -1.925   8.172  12.539
  331    HB   THR  44           HB       THR  44  -0.152   6.991  13.824
  332    HG1  THR  44           1HG      THR  44   0.232   4.794  13.274
  333   1HG2  THR  44          1HG2      THR  44  -1.560   4.937  14.464
  334   2HG2  THR  44          2HG2      THR  44  -2.763   5.613  13.365
  335   3HG2  THR  44          3HG2      THR  44  -2.217   6.547  14.759
  336    H    TYR  45           H        TYR  45  -0.403   9.772  12.355
  337    HA   TYR  45           HA       TYR  45   1.579   9.426  10.203
  338   1HB   TYR  45          2HB       TYR  45  -0.179  11.160   9.846
  339   2HB   TYR  45          1HB       TYR  45   0.429  12.015  11.259
  340    HD1  TYR  45           1HD      TYR  45   2.471  10.317   8.664
  341    HD2  TYR  45           2HD      TYR  45   1.150  14.029  10.272
  342    HE1  TYR  45           1HE      TYR  45   4.083  11.503   7.235
  343    HE2  TYR  45           2HE      TYR  45   2.759  15.224   8.846
  344    HH   TYR  45           HH       TYR  45   4.017  14.908   6.825
  345    H    ASP  46           H        ASP  46   3.686  10.144  10.468
  346    HA   ASP  46           HA       ASP  46   4.486  10.802  13.225
  347   1HB   ASP  46          2HB       ASP  46   5.116   8.492  12.676
  348   2HB   ASP  46          1HB       ASP  46   5.973   9.058  11.246
  349    H    ASP  47           H        ASP  47   4.375  13.027  12.584
  350    HA   ASP  47           HA       ASP  47   5.564  14.279  10.464
  351   1HB   ASP  47          2HB       ASP  47   5.481  15.271  13.320
  352   2HB   ASP  47          1HB       ASP  47   5.751  16.276  11.900
  353    H    ALA  48           H        ALA  48   7.134  13.069  13.368
  354    HA   ALA  48           HA       ALA  48   9.571  14.310  13.288
  355   1HB   ALA  48          1HB       ALA  48  10.231  12.782  14.804
  356   2HB   ALA  48          2HB       ALA  48   9.708  11.417  13.817
  357   3HB   ALA  48          3HB       ALA  48   8.530  12.319  14.767
  358    H    THR  49           H        THR  49   8.443  11.718  11.200
  359    HA   THR  49           HA       THR  49  10.929  12.009   9.647
  360    HB   THR  49           HB       THR  49  10.787   9.609   9.071
  361    HG1  THR  49           1HG      THR  49   9.232   8.368   9.824
  362   1HG2  THR  49          1HG2      THR  49  11.529  10.647  11.607
  363   2HG2  THR  49          2HG2      THR  49  12.176   9.251  10.744
  364   3HG2  THR  49          3HG2      THR  49  10.803   9.056  11.834
  365    H    LYS  50           H        LYS  50   8.008  13.014   9.488
  366    HA   LYS  50           HA       LYS  50   6.393  13.356   7.893
  367   1HB   LYS  50          2HB       LYS  50   8.790  13.029   6.081
  368   2HB   LYS  50          1HB       LYS  50   7.249  13.735   5.611
  369   1HG   LYS  50          2HG       LYS  50   7.943  15.188   7.841
  370   2HG   LYS  50          1HG       LYS  50   9.489  14.918   7.032
  371   1HD   LYS  50          2HD       LYS  50   8.542  15.792   4.944
  372   2HD   LYS  50          1HD       LYS  50   7.004  16.063   5.767
  373   1HE   LYS  50          2HE       LYS  50   9.637  17.364   6.465
  374   2HE   LYS  50          1HE       LYS  50   8.310  18.127   5.590
  375   1HZ   LYS  50          1HZ       LYS  50   6.938  17.548   7.648
  376   2HZ   LYS  50          2HZ       LYS  50   8.032  18.831   7.768
  377   3HZ   LYS  50          3HZ       LYS  50   8.424  17.324   8.428
  378    H    THR  51           H        THR  51   6.690  10.655   8.779
  379    HA   THR  51           HA       THR  51   5.987   9.174   6.338
  380    HB   THR  51           HB       THR  51   7.160   8.156   8.929
  381    HG1  THR  51           1HG      THR  51   8.601   9.243   7.464
  382   1HG2  THR  51          1HG2      THR  51   7.364   6.275   6.821
  383   2HG2  THR  51          2HG2      THR  51   5.670   6.728   7.008
  384   3HG2  THR  51          3HG2      THR  51   6.573   6.102   8.387
  385    H    PHE  52           H        PHE  52   4.149   7.990   6.269
  386    HA   PHE  52           HA       PHE  52   2.271   8.346   8.507
  387   1HB   PHE  52          2HB       PHE  52   1.667   7.688   5.616
  388   2HB   PHE  52          1HB       PHE  52   0.483   8.016   6.876
  389    HD1  PHE  52           1HD      PHE  52  -0.284  10.176   7.219
  390    HD2  PHE  52           2HD      PHE  52   3.325   9.561   5.051
  391    HE1  PHE  52           1HE      PHE  52  -0.227  12.567   6.645
  392    HE2  PHE  52           2HE      PHE  52   3.389  11.952   4.475
  393    HZ   PHE  52           HZ       PHE  52   1.612  13.458   5.272
  394    H    THR  53           H        THR  53   1.560   6.603   9.593
  395    HA   THR  53           HA       THR  53   2.254   3.964   8.500
  396    HB   THR  53           HB       THR  53   1.968   3.269  10.994
  397    HG1  THR  53           1HG      THR  53   1.246   5.479  11.521
  398   1HG2  THR  53          1HG2      THR  53   4.107   2.906  10.461
  399   2HG2  THR  53          2HG2      THR  53   4.383   4.385  11.387
  400   3HG2  THR  53          3HG2      THR  53   4.276   4.454   9.628
  401    H    VAL  54           H        VAL  54   0.698   2.683   7.934
  402    HA   VAL  54           HA       VAL  54  -2.033   3.201   8.907
  403    HB   VAL  54           HB       VAL  54  -1.178   1.700   6.418
  404   1HG1  VAL  54          1HG1      VAL  54  -3.632   1.938   5.859
  405   2HG1  VAL  54          2HG1      VAL  54  -3.880   2.394   7.545
  406   3HG1  VAL  54          3HG1      VAL  54  -3.241   0.800   7.147
  407   1HG2  VAL  54          1HG2      VAL  54  -0.800   3.809   5.695
  408   2HG2  VAL  54          2HG2      VAL  54  -1.831   4.534   6.929
  409   3HG2  VAL  54          3HG2      VAL  54  -2.553   3.810   5.492
  410    H    THR  55           H        THR  55  -2.392   1.918  10.628
  411    HA   THR  55           HA       THR  55  -1.199  -0.738  10.674
  412    HB   THR  55           HB       THR  55  -2.831   0.540  12.858
  413    HG1  THR  55           1HG      THR  55  -0.051   0.725  12.321
  414   1HG2  THR  55          1HG2      THR  55  -1.254  -0.872  14.258
  415   2HG2  THR  55          2HG2      THR  55  -0.859  -1.717  12.759
  416   3HG2  THR  55          3HG2      THR  55  -2.517  -1.723  13.369
  417    H    GLU  56           H        GLU  56  -2.265  -2.301   9.703
  418    HA   GLU  56           HA       GLU  56  -4.892  -2.383   8.928
  419   1HB   GLU  56          2HB       GLU  56  -3.251  -3.976   8.125
  420   2HB   GLU  56          1HB       GLU  56  -3.088  -4.671   9.731
  421   1HG   GLU  56          2HG       GLU  56  -4.423  -6.091   8.290
  422   2HG   GLU  56          1HG       GLU  56  -5.383  -5.473   9.633
  423   1H    MET   1          1HT       MET   1   6.348  18.530  -2.329
  424   2H    MET   1          2HT       MET   1   6.902  19.640  -1.179
  425   3H    MET   1          3HT       MET   1   5.708  18.517  -0.764
  426    HA   MET   1           HA       MET   1   8.508  17.875  -1.495
  427   1HB   MET   1          2HB       MET   1   7.050  17.823   1.156
  428   2HB   MET   1          1HB       MET   1   8.678  17.216   0.894
  429   1HG   MET   1          2HG       MET   1   9.414  19.463   0.283
  430   2HG   MET   1          1HG       MET   1   7.783  20.068   0.559
  431   1HE   MET   1          1HE       MET   1   7.325  19.618   4.384
  432   2HE   MET   1          2HE       MET   1   7.028  18.275   3.280
  433   3HE   MET   1          3HE       MET   1   6.555  19.912   2.825
  434    H    GLN   2           H        GLN   2   8.945  15.609  -0.463
  435    HA   GLN   2           HA       GLN   2   6.842  13.800  -1.425
  436   1HB   GLN   2          2HB       GLN   2   8.971  13.618  -2.638
  437   2HB   GLN   2          1HB       GLN   2   9.816  13.324  -1.125
  438   1HG   GLN   2          2HG       GLN   2   8.554  11.254  -0.824
  439   2HG   GLN   2          1HG       GLN   2   7.712  11.548  -2.342
  440   1HE2  GLN   2          1HE2      GLN   2  10.772  12.660  -2.818
  441   2HE2  GLN   2          2HE2      GLN   2  11.492  11.241  -3.482
  442    H    TYR   3           H        TYR   3   6.265  12.006  -0.159
  443    HA   TYR   3           HA       TYR   3   7.283  12.030   2.602
  444   1HB   TYR   3          2HB       TYR   3   4.395  11.737   1.754
  445   2HB   TYR   3          1HB       TYR   3   4.992  11.571   3.403
  446    HD1  TYR   3           1HD      TYR   3   4.748  13.405   4.780
  447    HD2  TYR   3           2HD      TYR   3   5.178  14.038   0.595
  448    HE1  TYR   3           1HE      TYR   3   4.482  15.825   5.123
  449    HE2  TYR   3           2HE      TYR   3   4.914  16.460   0.928
  450    HH   TYR   3           HH       TYR   3   5.134  18.116   2.655
  451    H    LYS   4           H        LYS   4   7.329  10.041   3.676
  452    HA   LYS   4           HA       LYS   4   7.120   7.720   1.874
  453   1HB   LYS   4          2HB       LYS   4   9.380   8.113   2.733
  454   2HB   LYS   4          1HB       LYS   4   8.773   8.069   4.383
  455   1HG   LYS   4          2HG       LYS   4   8.147   5.735   4.112
  456   2HG   LYS   4          1HG       LYS   4   8.701   5.770   2.438
  457   1HD   LYS   4          2HD       LYS   4  10.432   6.259   4.862
  458   2HD   LYS   4          1HD       LYS   4  10.356   4.750   3.949
  459   1HE   LYS   4          2HE       LYS   4  11.241   7.433   2.890
  460   2HE   LYS   4          1HE       LYS   4  12.292   6.074   3.286
  461   1HZ   LYS   4          1HZ       LYS   4  12.055   5.656   1.102
  462   2HZ   LYS   4          2HZ       LYS   4  10.586   6.485   0.970
  463   3HZ   LYS   4          3HZ       LYS   4  10.616   4.911   1.588
  464    H    VAL   5           H        VAL   5   5.219   6.746   2.159
  465    HA   VAL   5           HA       VAL   5   4.021   6.689   4.814
  466    HB   VAL   5           HB       VAL   5   2.881   5.753   2.179
  467   1HG1  VAL   5          1HG1      VAL   5   0.959   6.437   4.214
  468   2HG1  VAL   5          2HG1      VAL   5   2.047   5.169   4.779
  469   3HG1  VAL   5          3HG1      VAL   5   1.132   4.946   3.289
  470   1HG2  VAL   5          1HG2      VAL   5   2.754   7.949   1.762
  471   2HG2  VAL   5          2HG2      VAL   5   3.069   8.385   3.441
  472   3HG2  VAL   5          3HG2      VAL   5   1.439   7.940   2.935
  473    H    ILE   6           H        ILE   6   4.157   5.042   6.100
  474    HA   ILE   6           HA       ILE   6   5.209   2.490   5.137
  475    HB   ILE   6           HB       ILE   6   4.867   3.623   7.915
  476   1HG1  ILE   6          2HG1      ILE   6   7.327   2.773   6.376
  477   2HG1  ILE   6          1HG1      ILE   6   6.787   4.434   6.581
  478   1HG2  ILE   6          1HG2      ILE   6   4.575   1.493   8.564
  479   2HG2  ILE   6          2HG2      ILE   6   6.316   1.373   8.307
  480   3HG2  ILE   6          3HG2      ILE   6   5.201   0.836   7.051
  481   1HD1  ILE   6          1HD1      ILE   6   7.732   2.558   8.733
  482   2HD1  ILE   6          2HD1      ILE   6   7.056   4.160   9.029
  483   3HD1  ILE   6          3HD1      ILE   6   8.559   3.990   8.123
  484    H    LEU   7           H        LEU   7   3.877   0.885   4.704
  485    HA   LEU   7           HA       LEU   7   1.143   0.957   5.762
  486   1HB   LEU   7          2HB       LEU   7   2.142  -0.957   3.670
  487   2HB   LEU   7          1HB       LEU   7   0.506  -0.382   3.939
  488    HG   LEU   7           HG       LEU   7   2.787   1.180   2.745
  489   1HD1  LEU   7          1HD1      LEU   7   1.805  -0.382   1.199
  490   2HD1  LEU   7          2HD1      LEU   7   1.295   1.255   0.780
  491   3HD1  LEU   7          3HD1      LEU   7   0.183   0.170   1.617
  492   1HD2  LEU   7          1HD2      LEU   7  -0.008   2.062   3.450
  493   2HD2  LEU   7          2HD2      LEU   7   1.119   2.980   2.451
  494   3HD2  LEU   7          3HD2      LEU   7   1.498   2.662   4.143
  495    H    ASN   8           H        ASN   8   1.579   0.195   7.868
  496    HA   ASN   8           HA       ASN   8   2.854  -2.413   8.147
  497   1HB   ASN   8          2HB       ASN   8   3.496  -0.435   9.562
  498   2HB   ASN   8          1HB       ASN   8   1.900  -0.520  10.296
  499   1HD2  ASN   8          1HD2      ASN   8   4.908  -1.113  10.968
  500   2HD2  ASN   8          2HD2      ASN   8   4.785  -2.548  11.926
  501    H    GLY   9           H        GLY   9   1.481  -4.092   7.841
  502   1HA   GLY   9          2HA       GLY   9  -1.137  -3.943   9.206
  503   2HA   GLY   9          1HA       GLY   9  -0.873  -4.833   7.717
  504    H    LYS  10           H        LYS  10  -1.889  -6.556   9.023
  505    HA   LYS  10           HA       LYS  10  -0.391  -7.718  11.174
  506   1HB   LYS  10          2HB       LYS  10  -2.688  -8.832   9.557
  507   2HB   LYS  10          1HB       LYS  10  -2.056  -9.536  11.039
  508   1HG   LYS  10          2HG       LYS  10  -2.669  -7.463  12.236
  509   2HG   LYS  10          1HG       LYS  10  -3.399  -6.859  10.748
  510   1HD   LYS  10          2HD       LYS  10  -4.211  -9.394  12.167
  511   2HD   LYS  10          1HD       LYS  10  -5.043  -7.848  12.316
  512   1HE   LYS  10          2HE       LYS  10  -6.267  -9.106  10.733
  513   2HE   LYS  10          1HE       LYS  10  -5.356  -7.909   9.814
  514   1HZ   LYS  10          1HZ       LYS  10  -3.906 -10.349  10.133
  515   2HZ   LYS  10          2HZ       LYS  10  -4.290  -9.504   8.721
  516   3HZ   LYS  10          3HZ       LYS  10  -5.395 -10.604   9.375
  517    H    THR  11           H        THR  11  -1.188  -8.851   7.877
  518    HA   THR  11           HA       THR  11   1.119 -10.650   7.994
  519    HB   THR  11           HB       THR  11  -0.111 -11.646   5.951
  520    HG1  THR  11           1HG      THR  11  -2.390 -11.236   6.067
  521   1HG2  THR  11          1HG2      THR  11  -0.843 -13.239   7.303
  522   2HG2  THR  11          2HG2      THR  11  -1.976 -12.143   8.094
  523   3HG2  THR  11          3HG2      THR  11  -0.302 -12.228   8.644
  524    H    LEU  12           H        LEU  12   0.583  -7.639   7.035
  525    HA   LEU  12           HA       LEU  12   2.388  -7.919   4.755
  526   1HB   LEU  12          2HB       LEU  12   0.146  -7.717   3.827
  527   2HB   LEU  12          1HB       LEU  12  -0.123  -6.252   4.754
  528    HG   LEU  12           HG       LEU  12   1.508  -5.058   3.457
  529   1HD1  LEU  12          1HD1      LEU  12   2.386  -7.731   2.814
  530   2HD1  LEU  12          2HD1      LEU  12   3.252  -6.207   2.696
  531   3HD1  LEU  12          3HD1      LEU  12   2.215  -6.737   1.370
  532   1HD2  LEU  12          1HD2      LEU  12   0.044  -4.688   1.822
  533   2HD2  LEU  12          2HD2      LEU  12  -0.886  -6.045   2.457
  534   3HD2  LEU  12          3HD2      LEU  12   0.275  -6.304   1.156
  535    H    LYS  13           H        LYS  13   3.905  -6.403   4.572
  536    HA   LYS  13           HA       LYS  13   3.741  -3.947   6.126
  537   1HB   LYS  13          2HB       LYS  13   6.015  -5.919   6.445
  538   2HB   LYS  13          1HB       LYS  13   5.978  -4.294   7.118
  539   1HG   LYS  13          2HG       LYS  13   4.032  -4.903   8.471
  540   2HG   LYS  13          1HG       LYS  13   4.088  -6.537   7.805
  541   1HD   LYS  13          2HD       LYS  13   6.309  -6.860   8.764
  542   2HD   LYS  13          1HD       LYS  13   6.282  -5.215   9.402
  543   1HE   LYS  13          2HE       LYS  13   4.333  -5.791  10.774
  544   2HE   LYS  13          1HE       LYS  13   4.381  -7.436  10.145
  545   1HZ   LYS  13          1HZ       LYS  13   5.443  -7.391  12.266
  546   2HZ   LYS  13          2HZ       LYS  13   6.447  -6.108  11.810
  547   3HZ   LYS  13          3HZ       LYS  13   6.641  -7.628  11.095
  548    H    GLY  14           H        GLY  14   5.047  -2.279   5.286
  549   1HA   GLY  14          2HA       GLY  14   7.059  -2.687   3.353
  550   2HA   GLY  14          1HA       GLY  14   5.535  -2.402   2.530
  551    H    GLU  15           H        GLU  15   6.887  -0.607   1.693
  552    HA   GLU  15           HA       GLU  15   6.289   1.794   3.226
  553   1HB   GLU  15          2HB       GLU  15   9.053   1.201   2.149
  554   2HB   GLU  15          1HB       GLU  15   8.544   2.718   2.876
  555   1HG   GLU  15          2HG       GLU  15   8.150   1.574   4.996
  556   2HG   GLU  15          1HG       GLU  15   8.654   0.051   4.267
  557    H    THR  16           H        THR  16   5.657   3.436   1.975
  558    HA   THR  16           HA       THR  16   6.165   3.295  -0.906
  559    HB   THR  16           HB       THR  16   4.002   2.479  -0.922
  560    HG1  THR  16           1HG      THR  16   3.536   5.249  -0.871
  561   1HG2  THR  16          1HG2      THR  16   3.473   4.217   1.447
  562   2HG2  THR  16          2HG2      THR  16   3.283   2.474   1.285
  563   3HG2  THR  16          3HG2      THR  16   2.158   3.563   0.473
  564    H    THR  17           H        THR  17   5.537   5.445  -1.999
  565    HA   THR  17           HA       THR  17   5.876   7.708  -0.182
  566    HB   THR  17           HB       THR  17   7.661   8.636  -1.686
  567    HG1  THR  17           1HG      THR  17   7.437   7.386  -3.492
  568   1HG2  THR  17          1HG2      THR  17   8.666   7.908   0.213
  569   2HG2  THR  17          2HG2      THR  17   9.407   6.809  -0.951
  570   3HG2  THR  17          3HG2      THR  17   8.057   6.263   0.042
  571    H    THR  18           H        THR  18   4.373   9.127  -0.607
  572    HA   THR  18           HA       THR  18   3.353   9.462  -3.359
  573    HB   THR  18           HB       THR  18   1.692   8.935  -1.584
  574    HG1  THR  18           1HG      THR  18   1.180  10.301  -3.403
  575   1HG2  THR  18          1HG2      THR  18   1.483  11.486  -0.356
  576   2HG2  THR  18          2HG2      THR  18   3.101  10.848  -0.071
  577   3HG2  THR  18          3HG2      THR  18   1.688   9.904   0.397
  578    H    GLU  19           H        GLU  19   3.468  11.452  -4.350
  579    HA   GLU  19           HA       GLU  19   5.160  13.470  -3.035
  580   1HB   GLU  19          2HB       GLU  19   5.925  12.667  -5.224
  581   2HB   GLU  19          1HB       GLU  19   4.388  13.118  -5.946
  582   1HG   GLU  19          2HG       GLU  19   6.090  14.743  -6.481
  583   2HG   GLU  19          1HG       GLU  19   4.848  15.467  -5.459
  584    H    ALA  20           H        ALA  20   3.948  14.956  -1.935
  585    HA   ALA  20           HA       ALA  20   1.781  16.250  -3.401
  586   1HB   ALA  20          1HB       ALA  20   1.109  14.307  -1.702
  587   2HB   ALA  20          2HB       ALA  20   0.115  15.742  -1.957
  588   3HB   ALA  20          3HB       ALA  20   1.196  15.652  -0.566
  589    H    VAL  21           H        VAL  21   1.280  18.314  -2.735
  590    HA   VAL  21           HA       VAL  21   3.320  20.004  -2.016
  591    HB   VAL  21           HB       VAL  21   0.418  20.562  -1.419
  592   1HG1  VAL  21          1HG1      VAL  21   0.956  22.852  -1.666
  593   2HG1  VAL  21          2HG1      VAL  21   2.557  22.482  -2.306
  594   3HG1  VAL  21          3HG1      VAL  21   2.191  22.166  -0.610
  595   1HG2  VAL  21          1HG2      VAL  21   0.589  21.606  -3.800
  596   2HG2  VAL  21          2HG2      VAL  21   0.274  19.879  -3.614
  597   3HG2  VAL  21          3HG2      VAL  21   1.899  20.443  -4.009
  598    H    ASP  22           H        ASP  22   0.999  18.442   0.127
  599    HA   ASP  22           HA       ASP  22   2.729  19.094   2.382
  600   1HB   ASP  22          2HB       ASP  22   0.917  19.940   3.778
  601   2HB   ASP  22          1HB       ASP  22   1.093  20.929   2.334
  602    H    ALA  23           H        ALA  23   1.850  18.006   4.457
  603    HA   ALA  23           HA       ALA  23   1.822  15.259   4.041
  604   1HB   ALA  23          1HB       ALA  23   1.361  15.043   6.409
  605   2HB   ALA  23          2HB       ALA  23   0.845  16.728   6.483
  606   3HB   ALA  23          3HB       ALA  23   2.528  16.336   6.136
  607    H    ALA  24           H        ALA  24  -0.874  17.462   4.657
  608    HA   ALA  24           HA       ALA  24  -2.867  15.476   4.861
  609   1HB   ALA  24          1HB       ALA  24  -3.014  17.977   5.453
  610   2HB   ALA  24          2HB       ALA  24  -4.438  17.211   4.748
  611   3HB   ALA  24          3HB       ALA  24  -3.391  18.219   3.748
  612    H    THR  25           H        THR  25  -1.893  17.504   2.082
  613    HA   THR  25           HA       THR  25  -3.569  16.383   0.181
  614    HB   THR  25           HB       THR  25  -1.871  17.135  -1.467
  615    HG1  THR  25           1HG      THR  25   0.098  17.490  -0.921
  616   1HG2  THR  25          1HG2      THR  25  -2.517  19.024   0.757
  617   2HG2  THR  25          2HG2      THR  25  -3.286  18.883  -0.824
  618   3HG2  THR  25          3HG2      THR  25  -1.649  19.526  -0.695
  619    H    ALA  26           H        ALA  26  -0.340  15.424   1.246
  620    HA   ALA  26           HA       ALA  26  -0.011  13.223  -0.471
  621   1HB   ALA  26          1HB       ALA  26   1.297  14.285   1.900
  622   2HB   ALA  26          2HB       ALA  26   1.985  13.429   0.520
  623   3HB   ALA  26          3HB       ALA  26   1.299  12.521   1.867
  624    H    GLU  27           H        GLU  27  -1.192  13.393   2.905
  625    HA   GLU  27           HA       GLU  27  -1.842  10.756   3.294
  626   1HB   GLU  27          2HB       GLU  27  -1.947  12.442   5.061
  627   2HB   GLU  27          1HB       GLU  27  -3.328  13.196   4.276
  628   1HG   GLU  27          2HG       GLU  27  -4.641  11.168   4.638
  629   2HG   GLU  27          1HG       GLU  27  -3.258  10.418   5.433
  630    H    LYS  28           H        LYS  28  -3.881  13.325   1.909
  631    HA   LYS  28           HA       LYS  28  -6.145  11.733   1.437
  632   1HB   LYS  28          2HB       LYS  28  -5.162  14.181  -0.045
  633   2HB   LYS  28          1HB       LYS  28  -6.766  13.479  -0.223
  634   1HG   LYS  28          2HG       LYS  28  -5.609  14.651   2.296
  635   2HG   LYS  28          1HG       LYS  28  -6.829  15.391   1.257
  636   1HD   LYS  28          2HD       LYS  28  -7.147  12.770   2.719
  637   2HD   LYS  28          1HD       LYS  28  -7.799  14.319   3.259
  638   1HE   LYS  28          2HE       LYS  28  -8.481  12.903   0.685
  639   2HE   LYS  28          1HE       LYS  28  -9.500  12.986   2.121
  640   1HZ   LYS  28          1HZ       LYS  28  -9.136  14.914   0.036
  641   2HZ   LYS  28          2HZ       LYS  28  -8.928  15.591   1.571
  642   3HZ   LYS  28          3HZ       LYS  28 -10.368  14.792   1.189
  643    H    VAL  29           H        VAL  29  -3.326  12.476  -0.553
  644    HA   VAL  29           HA       VAL  29  -4.105  11.183  -2.894
  645    HB   VAL  29           HB       VAL  29  -1.341  11.516  -1.713
  646   1HG1  VAL  29          1HG1      VAL  29  -0.789  11.308  -4.278
  647   2HG1  VAL  29          2HG1      VAL  29  -2.260  10.336  -4.281
  648   3HG1  VAL  29          3HG1      VAL  29  -0.903   9.881  -3.248
  649   1HG2  VAL  29          1HG2      VAL  29  -1.266  13.567  -2.633
  650   2HG2  VAL  29          2HG2      VAL  29  -3.024  13.455  -2.578
  651   3HG2  VAL  29          3HG2      VAL  29  -2.163  13.069  -4.067
  652    H    VAL  30           H        VAL  30  -2.547   9.940   0.015
  653    HA   VAL  30           HA       VAL  30  -2.164   7.304  -0.968
  654    HB   VAL  30           HB       VAL  30  -2.539   8.132   1.914
  655   1HG1  VAL  30          1HG1      VAL  30  -0.762   5.913   1.041
  656   2HG1  VAL  30          2HG1      VAL  30  -2.505   5.639   1.029
  657   3HG1  VAL  30          3HG1      VAL  30  -1.694   6.096   2.526
  658   1HG2  VAL  30          1HG2      VAL  30  -0.645   9.174   0.271
  659   2HG2  VAL  30          2HG2      VAL  30   0.189   7.751   0.899
  660   3HG2  VAL  30          3HG2      VAL  30  -0.451   8.961   2.012
  661    H    LYS  31           H        LYS  31  -4.693   8.834   1.051
  662    HA   LYS  31           HA       LYS  31  -6.341   6.677   1.473
  663   1HB   LYS  31          2HB       LYS  31  -7.149   9.518   0.854
  664   2HB   LYS  31          1HB       LYS  31  -8.248   8.288   1.461
  665   1HG   LYS  31          2HG       LYS  31  -6.747   8.071   3.450
  666   2HG   LYS  31          1HG       LYS  31  -5.887   9.497   2.864
  667   1HD   LYS  31          2HD       LYS  31  -7.450  10.353   4.386
  668   2HD   LYS  31          1HD       LYS  31  -8.189  10.620   2.803
  669   1HE   LYS  31          2HE       LYS  31  -9.835   9.744   4.357
  670   2HE   LYS  31          1HE       LYS  31  -9.505   8.567   3.086
  671   1HZ   LYS  31          1HZ       LYS  31  -9.513   7.991   5.691
  672   2HZ   LYS  31          2HZ       LYS  31  -7.868   8.309   5.461
  673   3HZ   LYS  31          3HZ       LYS  31  -8.635   7.118   4.537
  674    H    GLN  32           H        GLN  32  -6.320   8.871  -1.302
  675    HA   GLN  32           HA       GLN  32  -8.373   7.608  -2.751
  676   1HB   GLN  32          2HB       GLN  32  -7.203   9.888  -3.154
  677   2HB   GLN  32          1HB       GLN  32  -6.021   8.953  -4.062
  678   1HG   GLN  32          2HG       GLN  32  -7.741   9.943  -5.496
  679   2HG   GLN  32          1HG       GLN  32  -7.738   8.180  -5.572
  680   1HE2  GLN  32          1HE2      GLN  32  -9.526  10.987  -4.800
  681   2HE2  GLN  32          2HE2      GLN  32 -10.988  10.205  -4.311
  682    H    PHE  33           H        PHE  33  -4.933   7.072  -2.512
  683    HA   PHE  33           HA       PHE  33  -4.480   5.273  -4.573
  684   1HB   PHE  33          2HB       PHE  33  -2.794   6.355  -3.021
  685   2HB   PHE  33          1HB       PHE  33  -3.243   5.161  -1.812
  686    HD1  PHE  33           1HD      PHE  33  -1.996   5.425  -5.301
  687    HD2  PHE  33           2HD      PHE  33  -2.063   3.184  -1.672
  688    HE1  PHE  33           1HE      PHE  33  -0.310   3.876  -6.212
  689    HE2  PHE  33           2HE      PHE  33  -0.380   1.644  -2.592
  690    HZ   PHE  33           HZ       PHE  33   0.494   1.999  -4.868
  691    H    PHE  34           H        PHE  34  -5.122   4.484  -1.176
  692    HA   PHE  34           HA       PHE  34  -5.638   1.717  -1.670
  693   1HB   PHE  34          2HB       PHE  34  -6.320   3.398   0.745
  694   2HB   PHE  34          1HB       PHE  34  -6.351   1.634   0.678
  695    HD1  PHE  34           1HD      PHE  34  -3.959   1.009  -0.828
  696    HD2  PHE  34           2HD      PHE  34  -4.588   3.948   2.177
  697    HE1  PHE  34           1HE      PHE  34  -1.563   0.963  -0.294
  698    HE2  PHE  34           2HE      PHE  34  -2.194   3.906   2.726
  699    HZ   PHE  34           HZ       PHE  34  -0.682   2.412   1.473
  700    H    ASN  35           H        ASN  35  -7.660   4.546  -1.229
  701    HA   ASN  35           HA       ASN  35 -10.180   3.451  -1.045
  702   1HB   ASN  35          2HB       ASN  35  -9.608   5.880  -0.970
  703   2HB   ASN  35          1HB       ASN  35  -9.375   5.851  -2.714
  704   1HD2  ASN  35          1HD2      ASN  35 -11.326   7.007  -0.606
  705   2HD2  ASN  35          2HD2      ASN  35 -12.868   6.796  -1.363
  706    H    ASP  36           H        ASP  36  -8.153   3.951  -3.836
  707    HA   ASP  36           HA       ASP  36 -10.114   2.739  -5.628
  708   1HB   ASP  36          2HB       ASP  36  -7.471   4.079  -6.199
  709   2HB   ASP  36          1HB       ASP  36  -8.539   3.417  -7.433
  710    H    ASN  37           H        ASN  37  -7.161   1.871  -3.996
  711    HA   ASN  37           HA       ASN  37  -6.548  -0.305  -5.800
  712   1HB   ASN  37          2HB       ASN  37  -5.492   0.351  -3.040
  713   2HB   ASN  37          1HB       ASN  37  -4.930  -1.002  -4.010
  714   1HD2  ASN  37          1HD2      ASN  37  -3.707   1.582  -2.965
  715   2HD2  ASN  37          2HD2      ASN  37  -2.933   2.251  -4.359
  716    H    GLY  38           H        GLY  38  -7.900   0.083  -2.587
  717   1HA   GLY  38          2HA       GLY  38  -8.437  -1.935  -1.249
  718   2HA   GLY  38          1HA       GLY  38  -9.857  -1.180  -1.939
  719    H    VAL  39           H        VAL  39 -11.228  -2.513  -2.817
  720    HA   VAL  39           HA       VAL  39 -10.291  -5.176  -3.652
  721    HB   VAL  39           HB       VAL  39 -13.083  -4.318  -2.984
  722   1HG1  VAL  39          1HG1      VAL  39 -13.473  -6.299  -3.999
  723   2HG1  VAL  39          2HG1      VAL  39 -12.982  -6.956  -2.438
  724   3HG1  VAL  39          3HG1      VAL  39 -11.820  -6.867  -3.761
  725   1HG2  VAL  39          1HG2      VAL  39 -11.135  -5.729  -1.170
  726   2HG2  VAL  39          2HG2      VAL  39 -12.771  -5.199  -0.775
  727   3HG2  VAL  39          3HG2      VAL  39 -11.507  -4.008  -1.084
  728    H    ASP  40           H        ASP  40 -11.018  -2.394  -5.286
  729    HA   ASP  40           HA       ASP  40 -12.257  -3.935  -7.460
  730   1HB   ASP  40          2HB       ASP  40 -12.785  -1.048  -6.738
  731   2HB   ASP  40          1HB       ASP  40 -13.429  -1.872  -8.155
  732    H    GLY  41           H        GLY  41  -9.403  -2.864  -6.661
  733   1HA   GLY  41          2HA       GLY  41  -8.767  -1.171  -8.915
  734   2HA   GLY  41          1HA       GLY  41  -7.636  -1.790  -7.723
  735    H    GLU  42           H        GLU  42  -6.692  -1.776 -10.167
  736    HA   GLU  42           HA       GLU  42  -7.183  -4.379 -11.412
  737   1HB   GLU  42          2HB       GLU  42  -5.506  -2.041 -12.342
  738   2HB   GLU  42          1HB       GLU  42  -5.778  -3.520 -13.253
  739   1HG   GLU  42          2HG       GLU  42  -7.887  -1.532 -12.438
  740   2HG   GLU  42          1HG       GLU  42  -7.190  -1.709 -14.048
  741    H    TRP  43           H        TRP  43  -6.140  -5.893 -10.213
  742    HA   TRP  43           HA       TRP  43  -3.432  -5.422  -9.287
  743   1HB   TRP  43          2HB       TRP  43  -5.323  -7.745  -8.915
  744   2HB   TRP  43          1HB       TRP  43  -3.719  -7.641  -8.195
  745    HD1  TRP  43           HD       TRP  43  -6.780  -5.229  -8.265
  746    HE1  TRP  43           1HE      TRP  43  -7.141  -4.367  -5.870
  747    HE3  TRP  43           3HE      TRP  43  -2.982  -7.724  -5.955
  748    HZ2  TRP  43           2HZ      TRP  43  -5.945  -4.708  -3.317
  749    HZ3  TRP  43           3HZ      TRP  43  -2.651  -7.411  -3.546
  750    HH2  TRP  43           HH       TRP  43  -4.107  -5.934  -2.250
  751    H    THR  44           H        THR  44  -1.796  -5.778 -10.638
  752    HA   THR  44           HA       THR  44  -1.947  -8.073 -12.477
  753    HB   THR  44           HB       THR  44  -0.128  -6.935 -13.736
  754    HG1  THR  44           1HG      THR  44   0.302  -4.747 -13.181
  755   1HG2  THR  44          1HG2      THR  44  -1.476  -4.848 -14.396
  756   2HG2  THR  44          2HG2      THR  44  -2.708  -5.494 -13.314
  757   3HG2  THR  44          3HG2      THR  44  -2.167  -6.441 -14.700
  758    H    TYR  45           H        TYR  45  -0.467  -9.710 -12.272
  759    HA   TYR  45           HA       TYR  45   1.494  -9.410 -10.093
  760   1HB   TYR  45          2HB       TYR  45  -0.311 -11.102  -9.761
  761   2HB   TYR  45          1HB       TYR  45   0.298 -11.970 -11.165
  762    HD1  TYR  45           1HD      TYR  45   2.341 -10.323  -8.542
  763    HD2  TYR  45           2HD      TYR  45   0.955 -14.002 -10.168
  764    HE1  TYR  45           1HE      TYR  45   3.903 -11.546  -7.090
  765    HE2  TYR  45           2HE      TYR  45   2.514 -15.235  -8.720
  766    HH   TYR  45           HH       TYR  45   3.750 -14.950  -6.680
  767    H    ASP  46           H        ASP  46   3.586 -10.180 -10.327
  768    HA   ASP  46           HA       ASP  46   4.407 -10.857 -13.073
  769   1HB   ASP  46          2HB       ASP  46   5.087  -8.563 -12.514
  770   2HB   ASP  46          1HB       ASP  46   5.910  -9.150 -11.072
  771    H    ASP  47           H        ASP  47   4.234 -13.079 -12.434
  772    HA   ASP  47           HA       ASP  47   5.363 -14.360 -10.297
  773   1HB   ASP  47          2HB       ASP  47   5.296 -15.349 -13.156
  774   2HB   ASP  47          1HB       ASP  47   5.522 -16.359 -11.731
  775    H    ALA  48           H        ALA  48   7.003 -13.189 -13.180
  776    HA   ALA  48           HA       ALA  48   9.407 -14.489 -13.065
  777   1HB   ALA  48          1HB       ALA  48  10.124 -12.976 -14.571
  778   2HB   ALA  48          2HB       ALA  48   9.622 -11.600 -13.590
  779   3HB   ALA  48          3HB       ALA  48   8.435 -12.471 -14.559
  780    H    THR  49           H        THR  49   8.314 -11.869 -10.992
  781    HA   THR  49           HA       THR  49  10.770 -12.219  -9.404
  782    HB   THR  49           HB       THR  49  10.678  -9.817  -8.830
  783    HG1  THR  49           1HG      THR  49   9.164  -8.538  -9.605
  784   1HG2  THR  49          1HG2      THR  49  11.431 -10.873 -11.356
  785   2HG2  THR  49          2HG2      THR  49  12.098  -9.493 -10.484
  786   3HG2  THR  49          3HG2      THR  49  10.746  -9.264 -11.593
  787    H    LYS  50           H        LYS  50   7.822 -13.154  -9.287
  788    HA   LYS  50           HA       LYS  50   6.178 -13.456  -7.716
  789   1HB   LYS  50          2HB       LYS  50   8.556 -13.187  -5.870
  790   2HB   LYS  50          1HB       LYS  50   6.992 -13.856  -5.422
  791   1HG   LYS  50          2HG       LYS  50   7.681 -15.325  -7.641
  792   2HG   LYS  50          1HG       LYS  50   9.222 -15.093  -6.811
  793   1HD   LYS  50          2HD       LYS  50   8.226 -15.943  -4.738
  794   2HD   LYS  50          1HD       LYS  50   6.693 -16.177  -5.582
  795   1HE   LYS  50          2HE       LYS  50   9.302 -17.541  -6.241
  796   2HE   LYS  50          1HE       LYS  50   7.944 -18.273  -5.387
  797   1HZ   LYS  50          1HZ       LYS  50   6.617 -17.659  -7.464
  798   2HZ   LYS  50          2HZ       LYS  50   7.680 -18.969  -7.570
  799   3HZ   LYS  50          3HZ       LYS  50   8.117 -17.472  -8.221
  800    H    THR  51           H        THR  51   6.553 -10.763  -8.596
  801    HA   THR  51           HA       THR  51   5.851  -9.265  -6.165
  802    HB   THR  51           HB       THR  51   7.085  -8.276  -8.740
  803    HG1  THR  51           1HG      THR  51   8.478  -9.398  -7.254
  804   1HG2  THR  51          1HG2      THR  51   7.305  -6.400  -6.629
  805   2HG2  THR  51          2HG2      THR  51   5.604  -6.811  -6.839
  806   3HG2  THR  51          3HG2      THR  51   6.541  -6.209  -8.206
  807    H    PHE  52           H        PHE  52   4.041  -8.037  -6.122
  808    HA   PHE  52           HA       PHE  52   2.186  -8.348  -8.386
  809   1HB   PHE  52          2HB       PHE  52   1.558  -7.674  -5.503
  810   2HB   PHE  52          1HB       PHE  52   0.385  -7.973  -6.782
  811    HD1  PHE  52           1HD      PHE  52  -0.429 -10.114  -7.136
  812    HD2  PHE  52           2HD      PHE  52   3.162  -9.588  -4.916
  813    HE1  PHE  52           1HE      PHE  52  -0.438 -12.507  -6.561
  814    HE2  PHE  52           2HE      PHE  52   3.160 -11.979  -4.339
  815    HZ   PHE  52           HZ       PHE  52   1.360 -13.441  -5.162
  816    H    THR  53           H        THR  53   1.534  -6.587  -9.482
  817    HA   THR  53           HA       THR  53   2.276  -3.968  -8.379
  818    HB   THR  53           HB       THR  53   2.044  -3.264 -10.876
  819    HG1  THR  53           1HG      THR  53   1.275  -5.456 -11.413
  820   1HG2  THR  53          1HG2      THR  53   4.183  -2.954 -10.313
  821   2HG2  THR  53          2HG2      THR  53   4.435  -4.438 -11.235
  822   3HG2  THR  53          3HG2      THR  53   4.300  -4.506  -9.478
  823    H    VAL  54           H        VAL  54   0.744  -2.648  -7.834
  824    HA   VAL  54           HA       VAL  54  -1.985  -3.099  -8.847
  825    HB   VAL  54           HB       VAL  54  -1.127  -1.619  -6.344
  826   1HG1  VAL  54          1HG1      VAL  54  -3.594  -1.798  -5.820
  827   2HG1  VAL  54          2HG1      VAL  54  -3.831  -2.247  -7.510
  828   3HG1  VAL  54          3HG1      VAL  54  -3.157  -0.670  -7.103
  829   1HG2  VAL  54          1HG2      VAL  54  -0.812  -3.737  -5.617
  830   2HG2  VAL  54          2HG2      VAL  54  -1.842  -4.436  -6.867
  831   3HG2  VAL  54          3HG2      VAL  54  -2.567  -3.696  -5.439
  832    H    THR  55           H        THR  55  -2.289  -1.808 -10.571
  833    HA   THR  55           HA       THR  55  -1.030   0.819 -10.601
  834    HB   THR  55           HB       THR  55  -2.660  -0.421 -12.808
  835    HG1  THR  55           1HG      THR  55   0.105  -0.673 -12.231
  836   1HG2  THR  55          1HG2      THR  55  -1.031   0.952 -14.185
  837   2HG2  THR  55          2HG2      THR  55  -0.637   1.788 -12.680
  838   3HG2  THR  55          3HG2      THR  55  -2.286   1.834 -13.313
  839    H    GLU  56           H        GLU  56  -2.070   2.406  -9.644
  840    HA   GLU  56           HA       GLU  56  -4.706   2.553  -8.906
  841   1HB   GLU  56          2HB       GLU  56  -3.038   4.105  -8.079
  842   2HB   GLU  56          1HB       GLU  56  -2.836   4.796  -9.683
  843   1HG   GLU  56          2HG       GLU  56  -4.155   6.249  -8.262
  844   2HG   GLU  56          1HG       GLU  56  -5.112   5.653  -9.617
  Start of MODEL   37
    1   1H    MET   1          1HT       MET   1   5.299 -19.983   1.860
    2   2H    MET   1          2HT       MET   1   4.190 -18.733   1.607
    3   3H    MET   1          3HT       MET   1   5.261 -18.659   2.913
    4    HA   MET   1           HA       MET   1   7.140 -18.546   1.375
    5   1HB   MET   1          2HB       MET   1   5.436 -19.637  -0.396
    6   2HB   MET   1          1HB       MET   1   5.253 -17.949  -0.853
    7   1HG   MET   1          2HG       MET   1   7.928 -19.296  -0.657
    8   2HG   MET   1          1HG       MET   1   6.963 -19.301  -2.128
    9   1HE   MET   1          1HE       MET   1   5.999 -17.365  -3.132
   10   2HE   MET   1          2HE       MET   1   7.051 -16.032  -3.608
   11   3HE   MET   1          3HE       MET   1   5.954 -15.845  -2.239
   12    H    GLN   2           H        GLN   2   7.931 -16.462   0.791
   13    HA   GLN   2           HA       GLN   2   6.261 -14.283   1.791
   14   1HB   GLN   2          2HB       GLN   2   8.501 -14.532   2.765
   15   2HB   GLN   2          1HB       GLN   2   9.220 -14.366   1.169
   16   1HG   GLN   2          2HG       GLN   2   9.411 -12.299   2.397
   17   2HG   GLN   2          1HG       GLN   2   8.341 -12.090   1.012
   18   1HE2  GLN   2          1HE2      GLN   2   6.628 -10.918   1.433
   19   2HE2  GLN   2          2HE2      GLN   2   5.799 -10.819   2.945
   20    H    TYR   3           H        TYR   3   5.551 -12.640   0.531
   21    HA   TYR   3           HA       TYR   3   6.463 -12.599  -2.271
   22   1HB   TYR   3          2HB       TYR   3   3.649 -12.226  -1.230
   23   2HB   TYR   3          1HB       TYR   3   4.142 -11.910  -2.890
   24    HD1  TYR   3           1HD      TYR   3   4.521 -13.705  -4.434
   25    HD2  TYR   3           2HD      TYR   3   3.598 -14.534  -0.365
   26    HE1  TYR   3           1HE      TYR   3   4.107 -16.057  -5.016
   27    HE2  TYR   3           2HE      TYR   3   3.184 -16.890  -0.935
   28    HH   TYR   3           HH       TYR   3   4.016 -18.492  -2.867
   29    H    LYS   4           H        LYS   4   6.824 -10.632  -3.195
   30    HA   LYS   4           HA       LYS   4   6.655  -8.323  -1.381
   31   1HB   LYS   4          2HB       LYS   4   8.916  -8.848  -2.129
   32   2HB   LYS   4          1HB       LYS   4   8.405  -8.763  -3.809
   33   1HG   LYS   4          2HG       LYS   4   7.866  -6.384  -3.503
   34   2HG   LYS   4          1HG       LYS   4   8.445  -6.483  -1.841
   35   1HD   LYS   4          2HD       LYS   4  10.138  -7.115  -4.254
   36   2HD   LYS   4          1HD       LYS   4  10.090  -5.535  -3.475
   37   1HE   LYS   4          2HE       LYS   4  11.987  -6.660  -2.609
   38   2HE   LYS   4          1HE       LYS   4  10.763  -6.684  -1.341
   39   1HZ   LYS   4          1HZ       LYS   4  10.641  -8.979  -3.060
   40   2HZ   LYS   4          2HZ       LYS   4  10.698  -8.896  -1.371
   41   3HZ   LYS   4          3HZ       LYS   4  12.130  -8.836  -2.268
   42    H    VAL   5           H        VAL   5   4.894  -7.144  -1.740
   43    HA   VAL   5           HA       VAL   5   3.791  -7.006  -4.438
   44    HB   VAL   5           HB       VAL   5   2.634  -5.986  -1.839
   45   1HG1  VAL   5          1HG1      VAL   5   0.770  -6.473  -4.001
   46   2HG1  VAL   5          2HG1      VAL   5   1.973  -5.261  -4.436
   47   3HG1  VAL   5          3HG1      VAL   5   0.980  -5.040  -2.995
   48   1HG2  VAL   5          1HG2      VAL   5   2.355  -8.194  -1.484
   49   2HG2  VAL   5          2HG2      VAL   5   2.562  -8.601  -3.188
   50   3HG2  VAL   5          3HG2      VAL   5   1.010  -7.996  -2.608
   51    H    ILE   6           H        ILE   6   3.770  -5.233  -5.640
   52    HA   ILE   6           HA       ILE   6   5.099  -2.835  -4.575
   53    HB   ILE   6           HB       ILE   6   4.947  -3.873  -7.410
   54   1HG1  ILE   6          2HG1      ILE   6   7.275  -3.540  -5.508
   55   2HG1  ILE   6          1HG1      ILE   6   6.531  -5.066  -5.969
   56   1HG2  ILE   6          1HG2      ILE   6   4.992  -1.255  -6.827
   57   2HG2  ILE   6          2HG2      ILE   6   5.800  -1.957  -8.228
   58   3HG2  ILE   6          3HG2      ILE   6   6.719  -1.607  -6.764
   59   1HD1  ILE   6          1HD1      ILE   6   8.184  -3.212  -7.643
   60   2HD1  ILE   6          2HD1      ILE   6   7.169  -4.467  -8.356
   61   3HD1  ILE   6          3HD1      ILE   6   8.476  -4.908  -7.257
   62    H    LEU   7           H        LEU   7   4.001  -0.980  -4.524
   63    HA   LEU   7           HA       LEU   7   1.347  -0.924  -5.792
   64   1HB   LEU   7          2HB       LEU   7   2.220   0.891  -3.560
   65   2HB   LEU   7          1HB       LEU   7   0.594   0.441  -4.036
   66    HG   LEU   7           HG       LEU   7   2.593  -1.326  -2.644
   67   1HD1  LEU   7          1HD1      LEU   7   1.411   0.489  -1.335
   68   2HD1  LEU   7          2HD1      LEU   7   1.209  -1.161  -0.746
   69   3HD1  LEU   7          3HD1      LEU   7  -0.086  -0.386  -1.661
   70   1HD2  LEU   7          1HD2      LEU   7   1.110  -2.453  -4.356
   71   2HD2  LEU   7          2HD2      LEU   7  -0.253  -2.004  -3.333
   72   3HD2  LEU   7          3HD2      LEU   7   1.007  -3.070  -2.708
   73    H    ASN   8           H        ASN   8   1.614   0.030  -7.729
   74    HA   ASN   8           HA       ASN   8   3.246   2.469  -7.888
   75   1HB   ASN   8          2HB       ASN   8   2.243   0.682 -10.115
   76   2HB   ASN   8          1HB       ASN   8   3.280   2.091 -10.319
   77   1HD2  ASN   8          1HD2      ASN   8   5.349   1.668 -10.502
   78   2HD2  ASN   8          2HD2      ASN   8   6.165   0.283  -9.873
   79    H    GLY   9           H        GLY   9   2.003   4.173  -7.419
   80   1HA   GLY   9          2HA       GLY   9  -0.526   4.463  -8.922
   81   2HA   GLY   9          1HA       GLY   9  -0.293   5.093  -7.300
   82    H    LYS  10           H        LYS  10  -1.067   6.491  -9.721
   83    HA   LYS  10           HA       LYS  10   0.831   7.941 -11.010
   84   1HB   LYS  10          2HB       LYS  10  -1.790   8.973  -9.919
   85   2HB   LYS  10          1HB       LYS  10  -0.847   9.746 -11.185
   86   1HG   LYS  10          2HG       LYS  10  -1.233   7.944 -12.686
   87   2HG   LYS  10          1HG       LYS  10  -1.939   6.953 -11.408
   88   1HD   LYS  10          2HD       LYS  10  -3.658   7.914 -12.871
   89   2HD   LYS  10          1HD       LYS  10  -3.807   8.502 -11.213
   90   1HE   LYS  10          2HE       LYS  10  -4.115  10.314 -12.805
   91   2HE   LYS  10          1HE       LYS  10  -2.658  10.565 -11.845
   92   1HZ   LYS  10          1HZ       LYS  10  -2.733  10.766 -14.497
   93   2HZ   LYS  10          2HZ       LYS  10  -2.285   9.142 -14.345
   94   3HZ   LYS  10          3HZ       LYS  10  -1.338  10.349 -13.634
   95    H    THR  11           H        THR  11  -0.688   8.946  -7.939
   96    HA   THR  11           HA       THR  11   1.434  10.900  -7.528
   97    HB   THR  11           HB       THR  11  -0.155  11.484  -5.547
   98    HG1  THR  11           1HG      THR  11  -2.364  10.909  -6.217
   99   1HG2  THR  11          1HG2      THR  11  -1.263  11.954  -8.296
  100   2HG2  THR  11          2HG2      THR  11   0.137  12.817  -7.663
  101   3HG2  THR  11          3HG2      THR  11  -1.427  12.969  -6.863
  102    H    LEU  12           H        LEU  12   0.829   7.736  -6.687
  103    HA   LEU  12           HA       LEU  12   2.597   7.993  -4.368
  104   1HB   LEU  12          2HB       LEU  12   0.336   7.804  -3.497
  105   2HB   LEU  12          1HB       LEU  12   0.063   6.359  -4.455
  106    HG   LEU  12           HG       LEU  12   1.592   5.101  -3.133
  107   1HD1  LEU  12          1HD1      LEU  12   3.399   6.176  -2.411
  108   2HD1  LEU  12          2HD1      LEU  12   2.411   6.702  -1.047
  109   3HD1  LEU  12          3HD1      LEU  12   2.591   7.735  -2.461
  110   1HD2  LEU  12          1HD2      LEU  12  -0.763   6.044  -2.192
  111   2HD2  LEU  12          2HD2      LEU  12   0.337   6.545  -0.907
  112   3HD2  LEU  12          3HD2      LEU  12   0.232   4.844  -1.365
  113    H    LYS  13           H        LYS  13   4.136   6.456  -4.195
  114    HA   LYS  13           HA       LYS  13   3.934   4.014  -5.781
  115   1HB   LYS  13          2HB       LYS  13   6.258   5.932  -6.047
  116   2HB   LYS  13          1HB       LYS  13   6.156   4.340  -6.783
  117   1HG   LYS  13          2HG       LYS  13   4.244   5.070  -8.112
  118   2HG   LYS  13          1HG       LYS  13   4.335   6.667  -7.366
  119   1HD   LYS  13          2HD       LYS  13   5.394   6.682  -9.558
  120   2HD   LYS  13          1HD       LYS  13   6.589   6.961  -8.289
  121   1HE   LYS  13          2HE       LYS  13   7.437   5.411  -9.971
  122   2HE   LYS  13          1HE       LYS  13   7.268   4.620  -8.404
  123   1HZ   LYS  13          1HZ       LYS  13   4.997   4.444 -10.222
  124   2HZ   LYS  13          2HZ       LYS  13   5.615   3.292  -9.150
  125   3HZ   LYS  13          3HZ       LYS  13   6.374   3.552 -10.639
  126    H    GLY  14           H        GLY  14   5.188   2.293  -4.974
  127   1HA   GLY  14          2HA       GLY  14   7.252   2.572  -3.086
  128   2HA   GLY  14          1HA       GLY  14   5.741   2.365  -2.219
  129    H    GLU  15           H        GLU  15   7.094   0.486  -1.461
  130    HA   GLU  15           HA       GLU  15   6.368  -1.861  -3.056
  131   1HB   GLU  15          2HB       GLU  15   9.070  -1.520  -1.737
  132   2HB   GLU  15          1HB       GLU  15   8.515  -2.935  -2.617
  133   1HG   GLU  15          2HG       GLU  15   9.756  -1.960  -4.240
  134   2HG   GLU  15          1HG       GLU  15   8.215  -1.167  -4.557
  135    H    THR  16           H        THR  16   6.028  -3.770  -1.817
  136    HA   THR  16           HA       THR  16   6.213  -3.597   1.066
  137    HB   THR  16           HB       THR  16   4.113  -2.629   1.013
  138    HG1  THR  16           1HG      THR  16   3.449  -5.353   0.869
  139   1HG2  THR  16          1HG2      THR  16   3.702  -2.689  -1.373
  140   2HG2  THR  16          2HG2      THR  16   2.288  -3.245  -0.478
  141   3HG2  THR  16          3HG2      THR  16   3.338  -4.410  -1.278
  142    H    THR  17           H        THR  17   5.378  -5.716   2.090
  143    HA   THR  17           HA       THR  17   5.617  -7.985   0.263
  144    HB   THR  17           HB       THR  17   7.298  -9.068   1.723
  145    HG1  THR  17           1HG      THR  17   6.764  -7.657   3.565
  146   1HG2  THR  17          1HG2      THR  17   8.062  -6.429   0.517
  147   2HG2  THR  17          2HG2      THR  17   8.221  -8.039  -0.187
  148   3HG2  THR  17          3HG2      THR  17   9.232  -7.570   1.180
  149    H    THR  18           H        THR  18   4.114  -9.426   0.664
  150    HA   THR  18           HA       THR  18   2.942  -9.629   3.379
  151    HB   THR  18           HB       THR  18   1.370  -8.925   1.579
  152    HG1  THR  18           1HG      THR  18   0.703 -10.243   3.382
  153   1HG2  THR  18          1HG2      THR  18   2.324 -10.102  -0.325
  154   2HG2  THR  18          2HG2      THR  18   0.627 -10.522  -0.091
  155   3HG2  THR  18          3HG2      THR  18   1.891 -11.646   0.408
  156    H    GLU  19           H        GLU  19   2.709 -11.669   4.296
  157    HA   GLU  19           HA       GLU  19   4.260 -13.820   3.011
  158   1HB   GLU  19          2HB       GLU  19   5.091 -13.140   5.199
  159   2HB   GLU  19          1HB       GLU  19   3.502 -13.382   5.909
  160   1HG   GLU  19          2HG       GLU  19   4.969 -15.213   6.471
  161   2HG   GLU  19          1HG       GLU  19   3.656 -15.775   5.438
  162    H    ALA  20           H        ALA  20   3.018 -15.293   1.979
  163    HA   ALA  20           HA       ALA  20   0.668 -16.328   3.360
  164   1HB   ALA  20          1HB       ALA  20  -0.888 -15.620   1.915
  165   2HB   ALA  20          2HB       ALA  20   0.157 -15.861   0.516
  166   3HB   ALA  20          3HB       ALA  20   0.307 -14.396   1.486
  167    H    VAL  21           H        VAL  21  -0.008 -18.352   2.693
  168    HA   VAL  21           HA       VAL  21   1.907 -20.230   2.108
  169    HB   VAL  21           HB       VAL  21  -1.011 -20.517   1.392
  170   1HG1  VAL  21          1HG1      VAL  21   0.987 -22.606   2.241
  171   2HG1  VAL  21          2HG1      VAL  21   0.514 -22.292   0.572
  172   3HG1  VAL  21          3HG1      VAL  21  -0.680 -22.871   1.732
  173   1HG2  VAL  21          1HG2      VAL  21  -0.973 -21.609   3.774
  174   2HG2  VAL  21          2HG2      VAL  21  -1.177 -19.869   3.587
  175   3HG2  VAL  21          3HG2      VAL  21   0.400 -20.531   4.016
  176    H    ASP  22           H        ASP  22   0.113 -18.270  -0.143
  177    HA   ASP  22           HA       ASP  22   1.834 -19.130  -2.287
  178   1HB   ASP  22          2HB       ASP  22  -0.063 -19.765  -3.813
  179   2HB   ASP  22          1HB       ASP  22   0.266 -20.910  -2.516
  180    H    ALA  23           H        ALA  23   1.077 -18.062  -4.441
  181    HA   ALA  23           HA       ALA  23   1.149 -15.301  -4.074
  182   1HB   ALA  23          1HB       ALA  23   1.851 -15.610  -6.172
  183   2HB   ALA  23          2HB       ALA  23   0.145 -15.606  -6.620
  184   3HB   ALA  23          3HB       ALA  23   0.976 -17.134  -6.326
  185    H    ALA  24           H        ALA  24  -1.581 -17.434  -4.776
  186    HA   ALA  24           HA       ALA  24  -3.509 -15.399  -5.108
  187   1HB   ALA  24          1HB       ALA  24  -5.066 -17.079  -5.201
  188   2HB   ALA  24          2HB       ALA  24  -4.318 -17.999  -3.896
  189   3HB   ALA  24          3HB       ALA  24  -3.608 -18.022  -5.511
  190    H    THR  25           H        THR  25  -2.836 -17.462  -2.259
  191    HA   THR  25           HA       THR  25  -4.475 -16.182  -0.448
  192    HB   THR  25           HB       THR  25  -2.797 -16.931   1.279
  193    HG1  THR  25           1HG      THR  25  -1.404 -17.650  -1.057
  194   1HG2  THR  25          1HG2      THR  25  -4.469 -18.505   0.828
  195   2HG2  THR  25          2HG2      THR  25  -2.944 -19.384   0.708
  196   3HG2  THR  25          3HG2      THR  25  -3.792 -18.886  -0.755
  197    H    ALA  26           H        ALA  26  -1.158 -15.428  -1.414
  198    HA   ALA  26           HA       ALA  26  -0.745 -13.235   0.283
  199   1HB   ALA  26          1HB       ALA  26   1.224 -13.817  -0.700
  200   2HB   ALA  26          2HB       ALA  26   0.755 -12.536  -1.816
  201   3HB   ALA  26          3HB       ALA  26   0.464 -14.223  -2.238
  202    H    GLU  27           H        GLU  27  -1.953 -13.386  -3.077
  203    HA   GLU  27           HA       GLU  27  -2.372 -10.708  -3.528
  204   1HB   GLU  27          2HB       GLU  27  -2.735 -12.730  -5.096
  205   2HB   GLU  27          1HB       GLU  27  -4.363 -12.761  -4.429
  206   1HG   GLU  27          2HG       GLU  27  -4.469 -11.548  -6.446
  207   2HG   GLU  27          1HG       GLU  27  -4.607 -10.382  -5.131
  208    H    LYS  28           H        LYS  28  -4.601 -13.056  -2.052
  209    HA   LYS  28           HA       LYS  28  -6.681 -11.202  -1.571
  210   1HB   LYS  28          2HB       LYS  28  -6.026 -13.934  -0.523
  211   2HB   LYS  28          1HB       LYS  28  -7.341 -13.007   0.186
  212   1HG   LYS  28          2HG       LYS  28  -7.983 -14.635  -1.623
  213   2HG   LYS  28          1HG       LYS  28  -8.549 -12.977  -1.839
  214   1HD   LYS  28          2HD       LYS  28  -6.698 -12.544  -3.379
  215   2HD   LYS  28          1HD       LYS  28  -6.125 -14.200  -3.157
  216   1HE   LYS  28          2HE       LYS  28  -8.229 -15.048  -4.080
  217   2HE   LYS  28          1HE       LYS  28  -8.796 -13.394  -4.304
  218   1HZ   LYS  28          1HZ       LYS  28  -6.256 -14.226  -5.529
  219   2HZ   LYS  28          2HZ       LYS  28  -7.350 -13.039  -6.031
  220   3HZ   LYS  28          3HZ       LYS  28  -7.713 -14.672  -6.265
  221    H    VAL  29           H        VAL  29  -4.108 -12.495   0.550
  222    HA   VAL  29           HA       VAL  29  -4.772 -11.169   2.882
  223    HB   VAL  29           HB       VAL  29  -1.967 -11.560   1.804
  224   1HG1  VAL  29          1HG1      VAL  29  -1.210 -10.659   3.685
  225   2HG1  VAL  29          2HG1      VAL  29  -2.188 -11.764   4.650
  226   3HG1  VAL  29          3HG1      VAL  29  -2.864 -10.226   4.114
  227   1HG2  VAL  29          1HG2      VAL  29  -2.089 -13.734   2.292
  228   2HG2  VAL  29          2HG2      VAL  29  -3.836 -13.513   2.366
  229   3HG2  VAL  29          3HG2      VAL  29  -2.874 -13.424   3.840
  230    H    VAL  30           H        VAL  30  -3.057 -10.026   0.046
  231    HA   VAL  30           HA       VAL  30  -2.467  -7.419   0.992
  232    HB   VAL  30           HB       VAL  30  -2.924  -8.338  -1.857
  233   1HG1  VAL  30          1HG1      VAL  30  -1.792  -6.381  -2.572
  234   2HG1  VAL  30          2HG1      VAL  30  -1.328  -5.965  -0.921
  235   3HG1  VAL  30          3HG1      VAL  30  -3.017  -5.856  -1.418
  236   1HG2  VAL  30          1HG2      VAL  30  -0.191  -7.887  -0.855
  237   2HG2  VAL  30          2HG2      VAL  30  -0.813  -9.126  -1.946
  238   3HG2  VAL  30          3HG2      VAL  30  -1.025  -9.299  -0.205
  239    H    LYS  31           H        LYS  31  -5.165  -8.800  -0.907
  240    HA   LYS  31           HA       LYS  31  -6.674  -6.567  -1.407
  241   1HB   LYS  31          2HB       LYS  31  -7.717  -9.257  -0.504
  242   2HB   LYS  31          1HB       LYS  31  -8.690  -7.999  -1.240
  243   1HG   LYS  31          2HG       LYS  31  -6.432  -9.486  -2.551
  244   2HG   LYS  31          1HG       LYS  31  -8.151  -9.726  -2.840
  245   1HD   LYS  31          2HD       LYS  31  -8.067  -7.154  -3.395
  246   2HD   LYS  31          1HD       LYS  31  -6.365  -7.511  -3.684
  247   1HE   LYS  31          2HE       LYS  31  -8.702  -8.893  -4.988
  248   2HE   LYS  31          1HE       LYS  31  -7.667  -7.679  -5.741
  249   1HZ   LYS  31          1HZ       LYS  31  -5.902  -9.128  -5.854
  250   2HZ   LYS  31          2HZ       LYS  31  -7.204 -10.167  -6.151
  251   3HZ   LYS  31          3HZ       LYS  31  -6.484 -10.131  -4.620
  252    H    GLN  32           H        GLN  32  -6.798  -8.602   1.489
  253    HA   GLN  32           HA       GLN  32  -8.646  -7.095   2.946
  254   1HB   GLN  32          2HB       GLN  32  -7.924  -9.374   3.573
  255   2HB   GLN  32          1HB       GLN  32  -6.341  -8.742   4.009
  256   1HG   GLN  32          2HG       GLN  32  -7.632  -9.076   5.994
  257   2HG   GLN  32          1HG       GLN  32  -7.398  -7.350   5.739
  258   1HE2  GLN  32          1HE2      GLN  32  -9.671  -8.589   3.568
  259   2HE2  GLN  32          2HE2      GLN  32 -11.096  -8.139   4.425
  260    H    PHE  33           H        PHE  33  -5.150  -6.828   2.665
  261    HA   PHE  33           HA       PHE  33  -4.579  -4.987   4.648
  262   1HB   PHE  33          2HB       PHE  33  -2.968  -6.174   3.063
  263   2HB   PHE  33          1HB       PHE  33  -3.356  -4.929   1.882
  264    HD1  PHE  33           1HD      PHE  33  -2.536  -4.986   5.513
  265    HD2  PHE  33           2HD      PHE  33  -1.702  -3.346   1.665
  266    HE1  PHE  33           1HE      PHE  33  -0.836  -3.508   6.502
  267    HE2  PHE  33           2HE      PHE  33   0.011  -1.886   2.663
  268    HZ   PHE  33           HZ       PHE  33   0.442  -1.978   5.088
  269    H    PHE  34           H        PHE  34  -4.993  -4.147   1.251
  270    HA   PHE  34           HA       PHE  34  -5.437  -1.394   1.723
  271   1HB   PHE  34          2HB       PHE  34  -6.190  -3.035  -0.702
  272   2HB   PHE  34          1HB       PHE  34  -6.063  -1.275  -0.638
  273    HD1  PHE  34           1HD      PHE  34  -3.693  -0.720   0.792
  274    HD2  PHE  34           2HD      PHE  34  -4.441  -3.886  -1.944
  275    HE1  PHE  34           1HE      PHE  34  -1.285  -0.885   0.337
  276    HE2  PHE  34           2HE      PHE  34  -2.030  -4.054  -2.414
  277    HZ   PHE  34           HZ       PHE  34  -0.457  -2.554  -1.257
  278    H    ASN  35           H        ASN  35  -7.597  -4.132   1.379
  279    HA   ASN  35           HA       ASN  35 -10.054  -2.857   1.167
  280   1HB   ASN  35          2HB       ASN  35  -9.766  -5.293   1.024
  281   2HB   ASN  35          1HB       ASN  35  -9.355  -5.352   2.734
  282   1HD2  ASN  35          1HD2      ASN  35 -11.619  -6.273   0.831
  283   2HD2  ASN  35          2HD2      ASN  35 -13.043  -5.949   1.754
  284    H    ASP  36           H        ASP  36  -8.046  -3.499   3.958
  285    HA   ASP  36           HA       ASP  36  -9.948  -2.251   5.781
  286   1HB   ASP  36          2HB       ASP  36  -7.270  -3.552   6.319
  287   2HB   ASP  36          1HB       ASP  36  -8.375  -2.955   7.552
  288    H    ASN  37           H        ASN  37  -7.010  -1.457   4.102
  289    HA   ASN  37           HA       ASN  37  -6.350   0.765   5.838
  290   1HB   ASN  37          2HB       ASN  37  -5.266   0.047   3.104
  291   2HB   ASN  37          1HB       ASN  37  -4.601   1.273   4.176
  292   1HD2  ASN  37          1HD2      ASN  37  -3.585  -1.310   2.998
  293   2HD2  ASN  37          2HD2      ASN  37  -2.939  -2.154   4.358
  294    H    GLY  38           H        GLY  38  -7.619   0.291   2.598
  295   1HA   GLY  38          2HA       GLY  38  -7.928   2.389   1.226
  296   2HA   GLY  38          1HA       GLY  38  -9.397   1.555   1.671
  297    H    VAL  39           H        VAL  39 -10.936   2.698   2.593
  298    HA   VAL  39           HA       VAL  39 -10.293   5.425   3.493
  299    HB   VAL  39           HB       VAL  39 -12.943   4.332   2.613
  300   1HG1  VAL  39          1HG1      VAL  39 -11.987   6.964   3.535
  301   2HG1  VAL  39          2HG1      VAL  39 -13.591   6.239   3.634
  302   3HG1  VAL  39          3HG1      VAL  39 -13.052   6.982   2.129
  303   1HG2  VAL  39          1HG2      VAL  39 -12.552   5.380   0.458
  304   2HG2  VAL  39          2HG2      VAL  39 -11.293   4.192   0.798
  305   3HG2  VAL  39          3HG2      VAL  39 -10.955   5.913   0.986
  306    H    ASP  40           H        ASP  40 -10.852   2.555   5.007
  307    HA   ASP  40           HA       ASP  40 -12.369   3.892   7.135
  308   1HB   ASP  40          2HB       ASP  40 -12.574   0.992   6.301
  309   2HB   ASP  40          1HB       ASP  40 -13.385   1.710   7.688
  310    H    GLY  41           H        GLY  41  -9.397   2.905   6.378
  311   1HA   GLY  41          2HA       GLY  41  -8.781   1.350   8.740
  312   2HA   GLY  41          1HA       GLY  41  -7.645   1.876   7.510
  313    H    GLU  42           H        GLU  42  -6.682   2.035   9.914
  314    HA   GLU  42           HA       GLU  42  -6.965   4.856  10.724
  315   1HB   GLU  42          2HB       GLU  42  -6.192   2.473  12.420
  316   2HB   GLU  42          1HB       GLU  42  -6.141   4.142  12.965
  317   1HG   GLU  42          2HG       GLU  42  -8.135   3.402  13.831
  318   2HG   GLU  42          1HG       GLU  42  -8.645   4.179  12.335
  319    H    TRP  43           H        TRP  43  -5.249   6.074  10.281
  320    HA   TRP  43           HA       TRP  43  -2.613   4.757  10.068
  321   1HB   TRP  43          2HB       TRP  43  -3.401   7.275   8.610
  322   2HB   TRP  43          1HB       TRP  43  -1.975   6.286   8.354
  323    HD1  TRP  43           HD       TRP  43  -4.491   3.733   8.429
  324    HE1  TRP  43           1HE      TRP  43  -5.438   3.237   6.080
  325    HE3  TRP  43           3HE      TRP  43  -2.805   7.880   5.988
  326    HZ2  TRP  43           2HZ      TRP  43  -5.454   4.452   3.532
  327    HZ3  TRP  43           3HZ      TRP  43  -3.313   8.138   3.601
  328    HH2  TRP  43           HH       TRP  43  -4.608   6.456   2.394
  329    H    THR  44           H        THR  44  -0.840   5.793  10.960
  330    HA   THR  44           HA       THR  44  -1.435   8.165  12.607
  331    HB   THR  44           HB       THR  44   0.434   7.419  14.073
  332    HG1  THR  44           1HG      THR  44   0.364   5.115  12.427
  333   1HG2  THR  44          1HG2      THR  44  -1.761   5.399  13.700
  334   2HG2  THR  44          2HG2      THR  44  -1.766   6.790  14.784
  335   3HG2  THR  44          3HG2      THR  44  -0.658   5.448  15.076
  336    H    TYR  45           H        TYR  45  -0.003   9.902  12.520
  337    HA   TYR  45           HA       TYR  45   1.930   9.772  10.305
  338   1HB   TYR  45          2HB       TYR  45   0.103  11.367   9.972
  339   2HB   TYR  45          1HB       TYR  45   0.511  12.166  11.486
  340    HD1  TYR  45           1HD      TYR  45   2.818  10.954   8.830
  341    HD2  TYR  45           2HD      TYR  45   1.122  14.319  10.807
  342    HE1  TYR  45           1HE      TYR  45   4.364  12.436   7.622
  343    HE2  TYR  45           2HE      TYR  45   2.663  15.810   9.603
  344    HH   TYR  45           HH       TYR  45   4.846  15.682   8.477
  345    H    ASP  46           H        ASP  46   4.004  10.491  10.529
  346    HA   ASP  46           HA       ASP  46   4.854  11.280  13.238
  347   1HB   ASP  46          2HB       ASP  46   5.547   8.971  12.767
  348   2HB   ASP  46          1HB       ASP  46   6.347   9.503  11.291
  349    H    ASP  47           H        ASP  47   4.644  13.471  12.504
  350    HA   ASP  47           HA       ASP  47   5.739  14.657  10.296
  351   1HB   ASP  47          2HB       ASP  47   5.660  15.787  13.100
  352   2HB   ASP  47          1HB       ASP  47   5.884  16.732  11.631
  353    H    ALA  48           H        ALA  48   7.407  13.690  13.238
  354    HA   ALA  48           HA       ALA  48   9.800  15.005  13.006
  355   1HB   ALA  48          1HB       ALA  48  10.650  12.594  13.906
  356   2HB   ALA  48          2HB       ALA  48   8.919  12.491  14.233
  357   3HB   ALA  48          3HB       ALA  48   9.866  13.816  14.907
  358    H    THR  49           H        THR  49   8.671  12.289  11.098
  359    HA   THR  49           HA       THR  49  11.151  12.477   9.521
  360    HB   THR  49           HB       THR  49  10.990  10.050   9.079
  361    HG1  THR  49           1HG      THR  49   8.696   9.942   9.586
  362   1HG2  THR  49          1HG2      THR  49  12.354   9.706  10.777
  363   2HG2  THR  49          2HG2      THR  49  11.003   9.734  11.908
  364   3HG2  THR  49          3HG2      THR  49  11.830  11.232  11.486
  365    H    LYS  50           H        LYS  50   8.160  13.410   9.339
  366    HA   LYS  50           HA       LYS  50   6.578  13.680   7.698
  367   1HB   LYS  50          2HB       LYS  50   9.098  13.363   6.069
  368   2HB   LYS  50          1HB       LYS  50   7.549  13.758   5.341
  369   1HG   LYS  50          2HG       LYS  50   8.862  15.410   7.484
  370   2HG   LYS  50          1HG       LYS  50   9.043  15.706   5.753
  371   1HD   LYS  50          2HD       LYS  50   6.557  15.897   5.604
  372   2HD   LYS  50          1HD       LYS  50   6.496  15.791   7.364
  373   1HE   LYS  50          2HE       LYS  50   6.403  18.112   6.614
  374   2HE   LYS  50          1HE       LYS  50   7.867  17.797   7.543
  375   1HZ   LYS  50          1HZ       LYS  50   9.086  18.458   5.836
  376   2HZ   LYS  50          2HZ       LYS  50   7.680  18.860   4.988
  377   3HZ   LYS  50          3HZ       LYS  50   8.365  17.324   4.807
  378    H    THR  51           H        THR  51   6.958  10.983   8.703
  379    HA   THR  51           HA       THR  51   6.134   9.464   6.320
  380    HB   THR  51           HB       THR  51   7.638   8.472   8.745
  381    HG1  THR  51           1HG      THR  51   9.260   8.077   7.144
  382   1HG2  THR  51          1HG2      THR  51   7.006   6.422   8.242
  383   2HG2  THR  51          2HG2      THR  51   7.744   6.606   6.650
  384   3HG2  THR  51          3HG2      THR  51   6.044   7.014   6.888
  385    H    PHE  52           H        PHE  52   4.387   8.168   6.433
  386    HA   PHE  52           HA       PHE  52   2.739   8.355   8.871
  387   1HB   PHE  52          2HB       PHE  52   1.812   7.804   6.042
  388   2HB   PHE  52          1HB       PHE  52   0.793   8.088   7.444
  389    HD1  PHE  52           1HD      PHE  52  -0.245  10.117   7.477
  390    HD2  PHE  52           2HD      PHE  52   3.630   9.838   5.737
  391    HE1  PHE  52           1HE      PHE  52  -0.326  12.514   6.916
  392    HE2  PHE  52           2HE      PHE  52   3.558  12.232   5.187
  393    HZ   PHE  52           HZ       PHE  52   1.581  13.572   5.776
  394    H    THR  53           H        THR  53   1.704   6.461   9.635
  395    HA   THR  53           HA       THR  53   2.612   3.961   8.389
  396    HB   THR  53           HB       THR  53   2.372   3.042  10.814
  397    HG1  THR  53           1HG      THR  53   2.811   5.797  11.286
  398   1HG2  THR  53          1HG2      THR  53   4.630   4.424   9.554
  399   2HG2  THR  53          2HG2      THR  53   4.510   2.797  10.227
  400   3HG2  THR  53          3HG2      THR  53   4.751   4.182  11.297
  401    H    VAL  54           H        VAL  54   1.117   2.556   7.853
  402    HA   VAL  54           HA       VAL  54  -1.639   3.009   8.794
  403    HB   VAL  54           HB       VAL  54  -0.702   1.616   6.270
  404   1HG1  VAL  54          1HG1      VAL  54  -3.363   1.925   7.559
  405   2HG1  VAL  54          2HG1      VAL  54  -2.697   0.573   6.647
  406   3HG1  VAL  54          3HG1      VAL  54  -3.271   2.009   5.800
  407   1HG2  VAL  54          1HG2      VAL  54  -0.375   3.812   5.736
  408   2HG2  VAL  54          2HG2      VAL  54  -1.602   4.387   6.866
  409   3HG2  VAL  54          3HG2      VAL  54  -2.085   3.660   5.334
  410    H    THR  55           H        THR  55  -2.190   1.633  10.371
  411    HA   THR  55           HA       THR  55  -1.006  -1.054  10.348
  412    HB   THR  55           HB       THR  55  -2.354   0.381  12.635
  413    HG1  THR  55           1HG      THR  55  -0.525   1.424  12.627
  414   1HG2  THR  55          1HG2      THR  55  -2.423  -1.982  13.004
  415   2HG2  THR  55          2HG2      THR  55  -1.163  -1.286  14.023
  416   3HG2  THR  55          3HG2      THR  55  -0.729  -2.147  12.546
  417    H    GLU  56           H        GLU  56  -2.212  -2.687   9.685
  418    HA   GLU  56           HA       GLU  56  -4.981  -2.445   9.153
  419   1HB   GLU  56          2HB       GLU  56  -3.580  -3.953   7.865
  420   2HB   GLU  56          1HB       GLU  56  -3.199  -4.882   9.308
  421   1HG   GLU  56          2HG       GLU  56  -5.512  -5.593   9.490
  422   2HG   GLU  56          1HG       GLU  56  -5.939  -4.617   8.085
  423   1H    MET   1          1HT       MET   1   5.809  19.901  -1.691
  424   2H    MET   1          2HT       MET   1   4.667  18.677  -1.453
  425   3H    MET   1          3HT       MET   1   5.753  18.578  -2.746
  426    HA   MET   1           HA       MET   1   7.606  18.420  -1.181
  427   1HB   MET   1          2HB       MET   1   5.905  19.551   0.567
  428   2HB   MET   1          1HB       MET   1   5.676  17.869   1.019
  429   1HG   MET   1          2HG       MET   1   8.386  19.151   0.861
  430   2HG   MET   1          1HG       MET   1   7.397  19.180   2.319
  431   1HE   MET   1          1HE       MET   1   6.374  17.268   3.309
  432   2HE   MET   1          2HE       MET   1   7.387  15.909   3.798
  433   3HE   MET   1          3HE       MET   1   6.306  15.749   2.415
  434    H    GLN   2           H        GLN   2   8.339  16.316  -0.587
  435    HA   GLN   2           HA       GLN   2   6.632  14.179  -1.611
  436   1HB   GLN   2          2HB       GLN   2   8.891  14.373  -2.552
  437   2HB   GLN   2          1HB       GLN   2   9.582  14.191  -0.947
  438   1HG   GLN   2          2HG       GLN   2   9.740  12.119  -2.171
  439   2HG   GLN   2          1HG       GLN   2   8.645  11.937  -0.803
  440   1HE2  GLN   2          1HE2      GLN   2   6.910  10.806  -1.248
  441   2HE2  GLN   2          2HE2      GLN   2   6.102  10.726  -2.772
  442    H    TYR   3           H        TYR   3   5.864  12.553  -0.361
  443    HA   TYR   3           HA       TYR   3   6.736  12.491   2.454
  444   1HB   TYR   3          2HB       TYR   3   3.927  12.186   1.374
  445   2HB   TYR   3          1HB       TYR   3   4.389  11.858   3.039
  446    HD1  TYR   3           1HD      TYR   3   4.790  13.644   4.591
  447    HD2  TYR   3           2HD      TYR   3   3.946  14.495   0.509
  448    HE1  TYR   3           1HE      TYR   3   4.425  16.006   5.165
  449    HE2  TYR   3           2HE      TYR   3   3.580  16.860   1.072
  450    HH   TYR   3           HH       TYR   3   4.424  18.442   3.015
  451    H    LYS   4           H        LYS   4   7.034  10.517   3.381
  452    HA   LYS   4           HA       LYS   4   6.835   8.211   1.566
  453   1HB   LYS   4          2HB       LYS   4   9.098   8.682   2.345
  454   2HB   LYS   4          1HB       LYS   4   8.562   8.610   4.018
  455   1HG   LYS   4          2HG       LYS   4   7.968   6.245   3.704
  456   2HG   LYS   4          1HG       LYS   4   8.573   6.329   2.049
  457   1HD   LYS   4          2HD       LYS   4  10.247   6.920   4.488
  458   2HD   LYS   4          1HD       LYS   4  10.171   5.341   3.707
  459   1HE   LYS   4          2HE       LYS   4  12.106   6.419   2.869
  460   2HE   LYS   4          1HE       LYS   4  10.902   6.474   1.584
  461   1HZ   LYS   4          1HZ       LYS   4  10.812   8.770   3.301
  462   2HZ   LYS   4          2HZ       LYS   4  10.891   8.686   1.612
  463   3HZ   LYS   4          3HZ       LYS   4  12.308   8.592   2.530
  464    H    VAL   5           H        VAL   5   5.041   7.077   1.900
  465    HA   VAL   5           HA       VAL   5   3.897   6.964   4.581
  466    HB   VAL   5           HB       VAL   5   2.751   5.973   1.967
  467   1HG1  VAL   5          1HG1      VAL   5   0.870   6.506   4.101
  468   2HG1  VAL   5          2HG1      VAL   5   2.038   5.265   4.554
  469   3HG1  VAL   5          3HG1      VAL   5   1.060   5.067   3.100
  470   1HG2  VAL   5          1HG2      VAL   5   2.532   8.187   1.609
  471   2HG2  VAL   5          2HG2      VAL   5   2.725   8.589   3.315
  472   3HG2  VAL   5          3HG2      VAL   5   1.167   8.023   2.712
  473    H    ILE   6           H        ILE   6   3.816   5.194   5.782
  474    HA   ILE   6           HA       ILE   6   5.101   2.763   4.736
  475    HB   ILE   6           HB       ILE   6   4.935   3.806   7.568
  476   1HG1  ILE   6          2HG1      ILE   6   7.280   3.415   5.700
  477   2HG1  ILE   6          1HG1      ILE   6   6.569   4.960   6.150
  478   1HG2  ILE   6          1HG2      ILE   6   4.924   1.187   6.988
  479   2HG2  ILE   6          2HG2      ILE   6   5.728   1.870   8.398
  480   3HG2  ILE   6          3HG2      ILE   6   6.659   1.497   6.948
  481   1HD1  ILE   6          1HD1      ILE   6   8.150   3.067   7.848
  482   2HD1  ILE   6          2HD1      ILE   6   7.157   4.346   8.547
  483   3HD1  ILE   6          3HD1      ILE   6   8.489   4.754   7.466
  484    H    LEU   7           H        LEU   7   3.959   0.936   4.670
  485    HA   LEU   7           HA       LEU   7   1.287   0.944   5.900
  486   1HB   LEU   7          2HB       LEU   7   2.147  -0.891   3.681
  487   2HB   LEU   7          1HB       LEU   7   0.526  -0.401   4.134
  488    HG   LEU   7           HG       LEU   7   2.587   1.316   2.769
  489   1HD1  LEU   7          1HD1      LEU   7   1.379  -0.470   1.443
  490   2HD1  LEU   7          2HD1      LEU   7   1.226   1.184   0.852
  491   3HD1  LEU   7          3HD1      LEU   7  -0.099   0.439   1.748
  492   1HD2  LEU   7          1HD2      LEU   7   1.107   2.480   4.461
  493   2HD2  LEU   7          2HD2      LEU   7  -0.252   2.063   3.418
  494   3HD2  LEU   7          3HD2      LEU   7   1.043   3.097   2.811
  495    H    ASN   8           H        ASN   8   1.503  -0.014   7.841
  496    HA   ASN   8           HA       ASN   8   3.074  -2.493   8.021
  497   1HB   ASN   8          2HB       ASN   8   2.082  -0.682  10.235
  498   2HB   ASN   8          1HB       ASN   8   3.082  -2.116  10.454
  499   1HD2  ASN   8          1HD2      ASN   8   5.157  -1.743  10.666
  500   2HD2  ASN   8          2HD2      ASN   8   6.017  -0.378  10.048
  501    H    GLY   9           H        GLY   9   1.796  -4.165   7.535
  502   1HA   GLY   9          2HA       GLY   9  -0.759  -4.395   9.003
  503   2HA   GLY   9          1HA       GLY   9  -0.519  -5.031   7.383
  504    H    LYS  10           H        LYS  10  -1.362  -6.409   9.794
  505    HA   LYS  10           HA       LYS  10   0.482  -7.904  11.109
  506   1HB   LYS  10          2HB       LYS  10  -2.148  -8.873   9.979
  507   2HB   LYS  10          1HB       LYS  10  -1.242  -9.668  11.260
  508   1HG   LYS  10          2HG       LYS  10  -1.605  -7.857  12.755
  509   2HG   LYS  10          1HG       LYS  10  -2.269  -6.849  11.468
  510   1HD   LYS  10          2HD       LYS  10  -4.031  -7.766  12.905
  511   2HD   LYS  10          1HD       LYS  10  -4.170  -8.352  11.246
  512   1HE   LYS  10          2HE       LYS  10  -4.545 -10.156  12.833
  513   2HE   LYS  10          1HE       LYS  10  -3.081 -10.442  11.893
  514   1HZ   LYS  10          1HZ       LYS  10  -3.198 -10.641  14.544
  515   2HZ   LYS  10          2HZ       LYS  10  -2.708  -9.029  14.400
  516   3HZ   LYS  10          3HZ       LYS  10  -1.782 -10.260  13.701
  517    H    THR  11           H        THR  11  -1.016  -8.872   8.016
  518    HA   THR  11           HA       THR  11   1.062 -10.878   7.636
  519    HB   THR  11           HB       THR  11  -0.513 -11.423   5.632
  520    HG1  THR  11           1HG      THR  11  -2.717 -10.794   6.271
  521   1HG2  THR  11          1HG2      THR  11  -1.671 -11.866   8.365
  522   2HG2  THR  11          2HG2      THR  11  -0.282 -12.764   7.751
  523   3HG2  THR  11          3HG2      THR  11  -1.837 -12.878   6.930
  524    H    LEU  12           H        LEU  12   0.546  -7.701   6.786
  525    HA   LEU  12           HA       LEU  12   2.340  -8.000   4.492
  526   1HB   LEU  12          2HB       LEU  12   0.096  -7.756   3.590
  527   2HB   LEU  12          1HB       LEU  12  -0.154  -6.306   4.543
  528    HG   LEU  12           HG       LEU  12   1.424  -5.084   3.243
  529   1HD1  LEU  12          1HD1      LEU  12   3.214  -6.205   2.547
  530   2HD1  LEU  12          2HD1      LEU  12   2.232  -6.707   1.170
  531   3HD1  LEU  12          3HD1      LEU  12   2.367  -7.743   2.585
  532   1HD2  LEU  12          1HD2      LEU  12  -0.939  -5.970   2.268
  533   2HD2  LEU  12          2HD2      LEU  12   0.166  -6.498   1.000
  534   3HD2  LEU  12          3HD2      LEU  12   0.096  -4.795   1.457
  535    H    LYS  13           H        LYS  13   3.919  -6.502   4.341
  536    HA   LYS  13           HA       LYS  13   3.754  -4.056   5.925
  537   1HB   LYS  13          2HB       LYS  13   6.027  -6.029   6.223
  538   2HB   LYS  13          1HB       LYS  13   5.953  -4.434   6.959
  539   1HG   LYS  13          2HG       LYS  13   4.005  -5.118   8.259
  540   2HG   LYS  13          1HG       LYS  13   4.067  -6.716   7.515
  541   1HD   LYS  13          2HD       LYS  13   5.094  -6.756   9.722
  542   2HD   LYS  13          1HD       LYS  13   6.299  -7.066   8.469
  543   1HE   LYS  13          2HE       LYS  13   7.161  -5.536  10.163
  544   2HE   LYS  13          1HE       LYS  13   7.034  -4.742   8.595
  545   1HZ   LYS  13          1HZ       LYS  13   4.742  -4.509  10.381
  546   2HZ   LYS  13          2HZ       LYS  13   5.403  -3.373   9.317
  547   3HZ   LYS  13          3HZ       LYS  13   6.134  -3.652  10.818
  548    H    GLY  14           H        GLY  14   5.059  -2.365   5.137
  549   1HA   GLY  14          2HA       GLY  14   7.142  -2.694   3.279
  550   2HA   GLY  14          1HA       GLY  14   5.650  -2.450   2.389
  551    H    GLU  15           H        GLU  15   7.059  -0.605   1.650
  552    HA   GLU  15           HA       GLU  15   6.369   1.758   3.235
  553   1HB   GLU  15          2HB       GLU  15   9.079   1.352   1.953
  554   2HB   GLU  15          1HB       GLU  15   8.545   2.780   2.827
  555   1HG   GLU  15          2HG       GLU  15   9.740   1.776   4.466
  556   2HG   GLU  15          1HG       GLU  15   8.176   1.020   4.762
  557    H    THR  16           H        THR  16   6.092   3.676   1.992
  558    HA   THR  16           HA       THR  16   6.314   3.497  -0.889
  559    HB   THR  16           HB       THR  16   4.190   2.581  -0.866
  560    HG1  THR  16           1HG      THR  16   3.590   5.320  -0.729
  561   1HG2  THR  16          1HG2      THR  16   3.746   2.650   1.515
  562   2HG2  THR  16          2HG2      THR  16   2.359   3.241   0.600
  563   3HG2  THR  16          3HG2      THR  16   3.426   4.381   1.416
  564    H    THR  17           H        THR  17   5.544   5.635  -1.923
  565    HA   THR  17           HA       THR  17   5.812   7.899  -0.092
  566    HB   THR  17           HB       THR  17   7.540   8.940  -1.528
  567    HG1  THR  17           1HG      THR  17   6.997   7.542  -3.377
  568   1HG2  THR  17          1HG2      THR  17   8.223   6.283  -0.312
  569   2HG2  THR  17          2HG2      THR  17   8.410   7.888   0.395
  570   3HG2  THR  17          3HG2      THR  17   9.429   7.396  -0.958
  571    H    THR  18           H        THR  18   4.351   9.375  -0.513
  572    HA   THR  18           HA       THR  18   3.223   9.607  -3.246
  573    HB   THR  18           HB       THR  18   1.609   8.941  -1.468
  574    HG1  THR  18           1HG      THR  18   0.998  10.276  -3.279
  575   1HG2  THR  18          1HG2      THR  18   2.564  10.095   0.448
  576   2HG2  THR  18          2HG2      THR  18   0.881  10.556   0.192
  577   3HG2  THR  18          3HG2      THR  18   2.178  11.649  -0.289
  578    H    GLU  19           H        GLU  19   3.053  11.651  -4.167
  579    HA   GLU  19           HA       GLU  19   4.636  13.765  -2.858
  580   1HB   GLU  19          2HB       GLU  19   5.482  13.065  -5.035
  581   2HB   GLU  19          1HB       GLU  19   3.910  13.345  -5.767
  582   1HG   GLU  19          2HG       GLU  19   5.429  15.139  -6.308
  583   2HG   GLU  19          1HG       GLU  19   4.115  15.732  -5.293
  584    H    ALA  20           H        ALA  20   3.416  15.269  -1.844
  585    HA   ALA  20           HA       ALA  20   1.112  16.359  -3.258
  586   1HB   ALA  20          1HB       ALA  20  -0.481  15.689  -1.835
  587   2HB   ALA  20          2HB       ALA  20   0.549  15.905  -0.421
  588   3HB   ALA  20          3HB       ALA  20   0.678  14.437  -1.390
  589    H    VAL  21           H        VAL  21   0.475  18.400  -2.599
  590    HA   VAL  21           HA       VAL  21   2.427  20.231  -1.987
  591    HB   VAL  21           HB       VAL  21  -0.493  20.588  -1.313
  592   1HG1  VAL  21          1HG1      VAL  21   1.568  22.628  -2.133
  593   2HG1  VAL  21          2HG1      VAL  21   1.063  22.325  -0.471
  594   3HG1  VAL  21          3HG1      VAL  21  -0.101  22.933  -1.648
  595   1HG2  VAL  21          1HG2      VAL  21  -0.395  21.680  -3.694
  596   2HG2  VAL  21          2HG2      VAL  21  -0.643  19.943  -3.510
  597   3HG2  VAL  21          3HG2      VAL  21   0.954  20.567  -3.918
  598    H    ASP  22           H        ASP  22   0.555  18.315   0.238
  599    HA   ASP  22           HA       ASP  22   2.266  19.134   2.405
  600   1HB   ASP  22          2HB       ASP  22   0.363  19.814   3.904
  601   2HB   ASP  22          1HB       ASP  22   0.738  20.950   2.612
  602    H    ALA  23           H        ALA  23   1.452  18.085   4.548
  603    HA   ALA  23           HA       ALA  23   1.464  15.321   4.183
  604   1HB   ALA  23          1HB       ALA  23   2.143  15.615   6.289
  605   2HB   ALA  23          2HB       ALA  23   0.431  15.652   6.714
  606   3HB   ALA  23          3HB       ALA  23   1.304  17.158   6.431
  607    H    ALA  24           H        ALA  24  -1.224  17.520   4.846
  608    HA   ALA  24           HA       ALA  24  -3.206  15.534   5.149
  609   1HB   ALA  24          1HB       ALA  24  -4.724  17.251   5.223
  610   2HB   ALA  24          2HB       ALA  24  -3.933  18.152   3.928
  611   3HB   ALA  24          3HB       ALA  24  -3.246  18.158   5.552
  612    H    THR  25           H        THR  25  -2.442  17.578   2.311
  613    HA   THR  25           HA       THR  25  -4.088  16.338   0.477
  614    HB   THR  25           HB       THR  25  -2.367  17.046  -1.226
  615    HG1  THR  25           1HG      THR  25  -0.990  17.732   1.130
  616   1HG2  THR  25          1HG2      THR  25  -4.006  18.661  -0.799
  617   2HG2  THR  25          2HG2      THR  25  -2.462  19.502  -0.657
  618   3HG2  THR  25          3HG2      THR  25  -3.343  19.026   0.795
  619    H    ALA  26           H        ALA  26  -0.804  15.505   1.490
  620    HA   ALA  26           HA       ALA  26  -0.419  13.303  -0.201
  621   1HB   ALA  26          1HB       ALA  26   1.549  13.837   0.809
  622   2HB   ALA  26          2HB       ALA  26   1.034  12.566   1.918
  623   3HB   ALA  26          3HB       ALA  26   0.777  14.261   2.336
  624    H    GLU  27           H        GLU  27  -1.671  13.482   3.141
  625    HA   GLU  27           HA       GLU  27  -2.161  10.815   3.585
  626   1HB   GLU  27          2HB       GLU  27  -2.497  12.847   5.148
  627   2HB   GLU  27          1HB       GLU  27  -4.113  12.918   4.458
  628   1HG   GLU  27          2HG       GLU  27  -4.277  11.706   6.473
  629   2HG   GLU  27          1HG       GLU  27  -4.425  10.545   5.157
  630    H    LYS  28           H        LYS  28  -4.311  13.217   2.079
  631    HA   LYS  28           HA       LYS  28  -6.428  11.414   1.569
  632   1HB   LYS  28          2HB       LYS  28  -5.692  14.130   0.529
  633   2HB   LYS  28          1HB       LYS  28  -7.020  13.234  -0.198
  634   1HG   LYS  28          2HG       LYS  28  -7.648  14.878   1.601
  635   2HG   LYS  28          1HG       LYS  28  -8.257  13.234   1.810
  636   1HD   LYS  28          2HD       LYS  28  -6.439  12.756   3.375
  637   2HD   LYS  28          1HD       LYS  28  -5.822  14.398   3.163
  638   1HE   LYS  28          2HE       LYS  28  -7.919  15.298   4.055
  639   2HE   LYS  28          1HE       LYS  28  -8.528  13.656   4.271
  640   1HZ   LYS  28          1HZ       LYS  28  -5.986  14.427   5.532
  641   2HZ   LYS  28          2HZ       LYS  28  -7.116  13.266   6.018
  642   3HZ   LYS  28          3HZ       LYS  28  -7.442  14.910   6.247
  643    H    VAL  29           H        VAL  29  -3.795  12.643  -0.516
  644    HA   VAL  29           HA       VAL  29  -4.458  11.334  -2.859
  645    HB   VAL  29           HB       VAL  29  -1.661  11.657  -1.739
  646   1HG1  VAL  29          1HG1      VAL  29  -0.899  10.739  -3.611
  647   2HG1  VAL  29          2HG1      VAL  29  -1.837  11.865  -4.588
  648   3HG1  VAL  29          3HG1      VAL  29  -2.556  10.344  -4.063
  649   1HG2  VAL  29          1HG2      VAL  29  -1.722  13.833  -2.229
  650   2HG2  VAL  29          2HG2      VAL  29  -3.474  13.654  -2.328
  651   3HG2  VAL  29          3HG2      VAL  29  -2.492  13.543  -3.789
  652    H    VAL  30           H        VAL  30  -2.810  10.151   0.002
  653    HA   VAL  30           HA       VAL  30  -2.271   7.530  -0.936
  654    HB   VAL  30           HB       VAL  30  -2.746   8.461   1.907
  655   1HG1  VAL  30          1HG1      VAL  30  -1.672   6.475   2.636
  656   2HG1  VAL  30          2HG1      VAL  30  -1.196   6.048   0.993
  657   3HG1  VAL  30          3HG1      VAL  30  -2.894   5.980   1.465
  658   1HG2  VAL  30          1HG2      VAL  30  -0.011   7.943   0.943
  659   2HG2  VAL  30          2HG2      VAL  30  -0.618   9.196   2.027
  660   3HG2  VAL  30          3HG2      VAL  30  -0.801   9.374   0.280
  661    H    LYS  31           H        LYS  31  -4.962   8.976   0.926
  662    HA   LYS  31           HA       LYS  31  -6.531   6.778   1.403
  663   1HB   LYS  31          2HB       LYS  31  -7.495   9.495   0.487
  664   2HB   LYS  31          1HB       LYS  31  -8.510   8.261   1.207
  665   1HG   LYS  31          2HG       LYS  31  -6.234   9.693   2.550
  666   2HG   LYS  31          1HG       LYS  31  -7.952   9.975   2.815
  667   1HD   LYS  31          2HD       LYS  31  -7.938   7.400   3.370
  668   2HD   LYS  31          1HD       LYS  31  -6.232   7.718   3.685
  669   1HE   LYS  31          2HE       LYS  31  -8.553   9.155   4.955
  670   2HE   LYS  31          1HE       LYS  31  -7.560   7.917   5.722
  671   1HZ   LYS  31          1HZ       LYS  31  -5.761   9.323   5.861
  672   2HZ   LYS  31          2HZ       LYS  31  -7.040  10.392   6.139
  673   3HZ   LYS  31          3HZ       LYS  31  -6.300  10.338   4.619
  674    H    GLN  32           H        GLN  32  -6.565   8.817  -1.493
  675    HA   GLN  32           HA       GLN  32  -8.428   7.356  -2.977
  676   1HB   GLN  32          2HB       GLN  32  -7.642   9.616  -3.593
  677   2HB   GLN  32          1HB       GLN  32  -6.070   8.947  -4.008
  678   1HG   GLN  32          2HG       GLN  32  -7.324   9.310  -6.011
  679   2HG   GLN  32          1HG       GLN  32  -7.135   7.580  -5.752
  680   1HE2  GLN  32          1HE2      GLN  32  -9.408   8.874  -3.613
  681   2HE2  GLN  32          2HE2      GLN  32 -10.832   8.458  -4.491
  682    H    PHE  33           H        PHE  33  -4.944   7.003  -2.647
  683    HA   PHE  33           HA       PHE  33  -4.389   5.148  -4.622
  684   1HB   PHE  33          2HB       PHE  33  -2.774   6.296  -3.014
  685   2HB   PHE  33          1HB       PHE  33  -3.207   5.062  -1.839
  686    HD1  PHE  33           1HD      PHE  33  -2.336   5.097  -5.459
  687    HD2  PHE  33           2HD      PHE  33  -1.597   3.439  -1.600
  688    HE1  PHE  33           1HE      PHE  33  -0.659   3.578  -6.423
  689    HE2  PHE  33           2HE      PHE  33   0.094   1.939  -2.572
  690    HZ   PHE  33           HZ       PHE  33   0.562   2.018  -4.991
  691    H    PHE  34           H        PHE  34  -4.873   4.320  -1.231
  692    HA   PHE  34           HA       PHE  34  -5.376   1.578  -1.710
  693   1HB   PHE  34          2HB       PHE  34  -6.124   3.237   0.705
  694   2HB   PHE  34          1HB       PHE  34  -6.040   1.474   0.643
  695    HD1  PHE  34           1HD      PHE  34  -3.663   0.862  -0.754
  696    HD2  PHE  34           2HD      PHE  34  -4.372   4.045   1.972
  697    HE1  PHE  34           1HE      PHE  34  -1.259   0.970  -0.266
  698    HE2  PHE  34           2HE      PHE  34  -1.966   4.155   2.474
  699    HZ   PHE  34           HZ       PHE  34  -0.413   2.616   1.341
  700    H    ASN  35           H        ASN  35  -7.473   4.368  -1.396
  701    HA   ASN  35           HA       ASN  35  -9.964   3.153  -1.220
  702   1HB   ASN  35          2HB       ASN  35  -9.619   5.582  -1.072
  703   2HB   ASN  35          1HB       ASN  35  -9.182   5.630  -2.776
  704   1HD2  ASN  35          1HD2      ASN  35 -11.450   6.606  -0.905
  705   2HD2  ASN  35          2HD2      ASN  35 -12.868   6.316  -1.849
  706    H    ASP  36           H        ASP  36  -7.903   3.746  -3.982
  707    HA   ASP  36           HA       ASP  36  -9.807   2.544  -5.832
  708   1HB   ASP  36          2HB       ASP  36  -7.092   3.779  -6.330
  709   2HB   ASP  36          1HB       ASP  36  -8.194   3.209  -7.580
  710    H    ASN  37           H        ASN  37  -6.913   1.680  -4.111
  711    HA   ASN  37           HA       ASN  37  -6.284  -0.559  -5.837
  712   1HB   ASN  37          2HB       ASN  37  -5.221   0.134  -3.088
  713   2HB   ASN  37          1HB       ASN  37  -4.572  -1.108  -4.153
  714   1HD2  ASN  37          1HD2      ASN  37  -3.509   1.449  -2.959
  715   2HD2  ASN  37          2HD2      ASN  37  -2.823   2.277  -4.310
  716    H    GLY  38           H        GLY  38  -7.587  -0.053  -2.615
  717   1HA   GLY  38          2HA       GLY  38  -7.966  -2.143  -1.248
  718   2HA   GLY  38          1HA       GLY  38  -9.408  -1.273  -1.715
  719    H    VAL  39           H        VAL  39 -10.961  -2.378  -2.659
  720    HA   VAL  39           HA       VAL  39 -10.370  -5.121  -3.550
  721    HB   VAL  39           HB       VAL  39 -13.006  -3.964  -2.706
  722   1HG1  VAL  39          1HG1      VAL  39 -12.101  -6.617  -3.615
  723   2HG1  VAL  39          2HG1      VAL  39 -13.686  -5.854  -3.737
  724   3HG1  VAL  39          3HG1      VAL  39 -13.186  -6.611  -2.225
  725   1HG2  VAL  39          1HG2      VAL  39 -12.670  -5.021  -0.546
  726   2HG2  VAL  39          2HG2      VAL  39 -11.380  -3.864  -0.869
  727   3HG2  VAL  39          3HG2      VAL  39 -11.080  -5.593  -1.053
  728    H    ASP  40           H        ASP  40 -10.838  -2.239  -5.071
  729    HA   ASP  40           HA       ASP  40 -12.358  -3.538  -7.222
  730   1HB   ASP  40          2HB       ASP  40 -12.503  -0.634  -6.389
  731   2HB   ASP  40          1HB       ASP  40 -13.313  -1.333  -7.787
  732    H    GLY  41           H        GLY  41  -9.375  -2.624  -6.420
  733   1HA   GLY  41          2HA       GLY  41  -8.686  -1.085  -8.775
  734   2HA   GLY  41          1HA       GLY  41  -7.580  -1.639  -7.528
  735    H    GLU  42           H        GLU  42  -6.590  -1.822  -9.918
  736    HA   GLU  42           HA       GLU  42  -6.929  -4.635 -10.732
  737   1HB   GLU  42          2HB       GLU  42  -6.074  -2.272 -12.418
  738   2HB   GLU  42          1HB       GLU  42  -6.055  -3.943 -12.962
  739   1HG   GLU  42          2HG       GLU  42  -8.019  -3.154 -13.856
  740   2HG   GLU  42          1HG       GLU  42  -8.569  -3.917 -12.367
  741    H    TRP  43           H        TRP  43  -5.249  -5.894 -10.266
  742    HA   TRP  43           HA       TRP  43  -2.585  -4.640 -10.016
  743   1HB   TRP  43          2HB       TRP  43  -3.454  -7.138  -8.569
  744   2HB   TRP  43          1HB       TRP  43  -2.007  -6.185  -8.293
  745    HD1  TRP  43           HD       TRP  43  -4.462  -3.572  -8.402
  746    HE1  TRP  43           1HE      TRP  43  -5.428  -3.052  -6.068
  747    HE3  TRP  43           3HE      TRP  43  -2.911  -7.759  -5.939
  748    HZ2  TRP  43           2HZ      TRP  43  -5.508  -4.267  -3.520
  749    HZ3  TRP  43           3HZ      TRP  43  -3.458  -8.003  -3.559
  750    HH2  TRP  43           HH       TRP  43  -4.730  -6.289  -2.371
  751    H    THR  44           H        THR  44  -0.826  -5.720 -10.883
  752    HA   THR  44           HA       THR  44  -1.455  -8.077 -12.538
  753    HB   THR  44           HB       THR  44   0.452  -7.377 -13.976
  754    HG1  THR  44           1HG      THR  44   0.416  -5.071 -12.332
  755   1HG2  THR  44          1HG2      THR  44  -1.698  -5.304 -13.635
  756   2HG2  THR  44          2HG2      THR  44  -1.721  -6.695 -14.718
  757   3HG2  THR  44          3HG2      THR  44  -0.578  -5.381 -14.995
  758    H    TYR  45           H        TYR  45  -0.066  -9.847 -12.432
  759    HA   TYR  45           HA       TYR  45   1.838  -9.766 -10.188
  760   1HB   TYR  45          2HB       TYR  45  -0.032 -11.315  -9.883
  761   2HB   TYR  45          1HB       TYR  45   0.378 -12.125 -11.391
  762    HD1  TYR  45           1HD      TYR  45   2.675 -10.968  -8.702
  763    HD2  TYR  45           2HD      TYR  45   0.926 -14.291 -10.703
  764    HE1  TYR  45           1HE      TYR  45   4.167 -12.487  -7.473
  765    HE2  TYR  45           2HE      TYR  45   2.413 -15.818  -9.478
  766    HH   TYR  45           HH       TYR  45   4.583 -15.742  -8.322
  767    H    ASP  46           H        ASP  46   3.896 -10.535 -10.384
  768    HA   ASP  46           HA       ASP  46   4.764 -11.346 -13.080
  769   1HB   ASP  46          2HB       ASP  46   5.507  -9.052 -12.599
  770   2HB   ASP  46          1HB       ASP  46   6.274  -9.605 -11.112
  771    H    ASP  47           H        ASP  47   4.492 -13.530 -12.349
  772    HA   ASP  47           HA       ASP  47   5.526 -14.742 -10.127
  773   1HB   ASP  47          2HB       ASP  47   5.459 -15.871 -12.933
  774   2HB   ASP  47          1HB       ASP  47   5.640 -16.819 -11.460
  775    H    ALA  48           H        ALA  48   7.259 -13.816 -13.045
  776    HA   ALA  48           HA       ALA  48   9.616 -15.189 -12.779
  777   1HB   ALA  48          1HB       ALA  48  10.535 -12.799 -13.666
  778   2HB   ALA  48          2HB       ALA  48   8.813 -12.654 -14.019
  779   3HB   ALA  48          3HB       ALA  48   9.737 -14.002 -14.679
  780    H    THR  49           H        THR  49   8.527 -12.445 -10.887
  781    HA   THR  49           HA       THR  49  10.978 -12.695  -9.275
  782    HB   THR  49           HB       THR  49  10.869 -10.263  -8.836
  783    HG1  THR  49           1HG      THR  49   8.588 -10.100  -9.374
  784   1HG2  THR  49          1HG2      THR  49  12.267  -9.953 -10.513
  785   2HG2  THR  49          2HG2      THR  49  10.930  -9.948 -11.664
  786   3HG2  THR  49          3HG2      THR  49  11.715 -11.467 -11.230
  787    H    LYS  50           H        LYS  50   7.964 -13.554  -9.136
  788    HA   LYS  50           HA       LYS  50   6.351 -13.784  -7.517
  789   1HB   LYS  50          2HB       LYS  50   8.856 -13.528  -5.853
  790   2HB   LYS  50          1HB       LYS  50   7.287 -13.886  -5.147
  791   1HG   LYS  50          2HG       LYS  50   8.590 -15.569  -7.271
  792   2HG   LYS  50          1HG       LYS  50   8.739 -15.869  -5.538
  793   1HD   LYS  50          2HD       LYS  50   6.247 -16.000  -5.425
  794   2HD   LYS  50          1HD       LYS  50   6.214 -15.893  -7.185
  795   1HE   LYS  50          2HE       LYS  50   6.054 -18.211  -6.436
  796   2HE   LYS  50          1HE       LYS  50   7.538 -17.932  -7.345
  797   1HZ   LYS  50          1HZ       LYS  50   8.717 -18.622  -5.621
  798   2HZ   LYS  50          2HZ       LYS  50   7.290 -18.990  -4.793
  799   3HZ   LYS  50          3HZ       LYS  50   8.008 -17.471  -4.603
  800    H    THR  51           H        THR  51   6.811 -11.097  -8.518
  801    HA   THR  51           HA       THR  51   5.991  -9.559  -6.145
  802    HB   THR  51           HB       THR  51   7.552  -8.603  -8.547
  803    HG1  THR  51           1HG      THR  51   9.161  -8.248  -6.924
  804   1HG2  THR  51          1HG2      THR  51   6.964  -6.538  -8.054
  805   2HG2  THR  51          2HG2      THR  51   7.674  -6.741  -6.452
  806   3HG2  THR  51          3HG2      THR  51   5.969  -7.108  -6.714
  807    H    PHE  52           H        PHE  52   4.278  -8.221  -6.282
  808    HA   PHE  52           HA       PHE  52   2.661  -8.368  -8.744
  809   1HB   PHE  52          2HB       PHE  52   1.708  -7.794  -5.928
  810   2HB   PHE  52          1HB       PHE  52   0.701  -8.053  -7.344
  811    HD1  PHE  52           1HD      PHE  52  -0.386 -10.058  -7.392
  812    HD2  PHE  52           2HD      PHE  52   3.470  -9.872  -5.598
  813    HE1  PHE  52           1HE      PHE  52  -0.531 -12.451  -6.833
  814    HE2  PHE  52           2HE      PHE  52   3.333 -12.263  -5.049
  815    HZ   PHE  52           HZ       PHE  52   1.332 -13.556  -5.666
  816    H    THR  53           H        THR  53   1.682  -6.450  -9.522
  817    HA   THR  53           HA       THR  53   2.633  -3.972  -8.262
  818    HB   THR  53           HB       THR  53   2.449  -3.049 -10.691
  819    HG1  THR  53           1HG      THR  53   2.828  -5.813 -11.157
  820   1HG2  THR  53          1HG2      THR  53   4.655  -4.484  -9.398
  821   2HG2  THR  53          2HG2      THR  53   4.586  -2.855 -10.074
  822   3HG2  THR  53          3HG2      THR  53   4.807  -4.245 -11.139
  823    H    VAL  54           H        VAL  54   1.165  -2.530  -7.748
  824    HA   VAL  54           HA       VAL  54  -1.586  -2.916  -8.728
  825    HB   VAL  54           HB       VAL  54  -0.653  -1.547  -6.189
  826   1HG1  VAL  54          1HG1      VAL  54  -3.303  -1.792  -7.517
  827   2HG1  VAL  54          2HG1      VAL  54  -2.616  -0.455  -6.595
  828   3HG1  VAL  54          3HG1      VAL  54  -3.237  -1.877  -5.757
  829   1HG2  VAL  54          1HG2      VAL  54  -0.387  -3.751  -5.651
  830   2HG2  VAL  54          2HG2      VAL  54  -1.610  -4.296  -6.799
  831   3HG2  VAL  54          3HG2      VAL  54  -2.098  -3.556  -5.274
  832    H    THR  55           H        THR  55  -2.082  -1.528 -10.312
  833    HA   THR  55           HA       THR  55  -0.833   1.128 -10.272
  834    HB   THR  55           HB       THR  55  -2.184  -0.273 -12.579
  835    HG1  THR  55           1HG      THR  55  -0.382  -1.360 -12.543
  836   1HG2  THR  55          1HG2      THR  55  -2.191   2.090 -12.948
  837   2HG2  THR  55          2HG2      THR  55  -0.934   1.365 -13.949
  838   3HG2  THR  55          3HG2      THR  55  -0.498   2.214 -12.465
  839    H    GLU  56           H        GLU  56  -2.009   2.791  -9.625
  840    HA   GLU  56           HA       GLU  56  -4.791   2.617  -9.133
  841   1HB   GLU  56          2HB       GLU  56  -3.372   4.090  -7.824
  842   2HB   GLU  56          1HB       GLU  56  -2.948   5.011  -9.260
  843   1HG   GLU  56          2HG       GLU  56  -5.240   5.778  -9.476
  844   2HG   GLU  56          1HG       GLU  56  -5.710   4.810  -8.079
  Start of MODEL   38
    1   1H    MET   1          1HT       MET   1   6.361 -19.986   2.369
    2   2H    MET   1          2HT       MET   1   5.184 -19.252   1.401
    3   3H    MET   1          3HT       MET   1   5.525 -18.628   2.935
    4    HA   MET   1           HA       MET   1   7.907 -18.354   2.027
    5   1HB   MET   1          2HB       MET   1   7.388 -19.624  -0.032
    6   2HB   MET   1          1HB       MET   1   6.225 -18.390  -0.492
    7   1HG   MET   1          2HG       MET   1   7.956 -16.762  -0.752
    8   2HG   MET   1          1HG       MET   1   9.159 -17.870  -0.096
    9   1HE   MET   1          1HE       MET   1   6.257 -18.840  -2.575
   10   2HE   MET   1          2HE       MET   1   7.026 -18.538  -4.133
   11   3HE   MET   1          3HE       MET   1   6.672 -17.193  -3.047
   12    H    GLN   2           H        GLN   2   8.409 -16.141   1.081
   13    HA   GLN   2           HA       GLN   2   6.359 -14.251   1.993
   14   1HB   GLN   2          2HB       GLN   2   8.522 -14.090   3.137
   15   2HB   GLN   2          1HB       GLN   2   9.333 -13.857   1.594
   16   1HG   GLN   2          2HG       GLN   2   8.128 -11.760   1.271
   17   2HG   GLN   2          1HG       GLN   2   7.305 -11.994   2.813
   18   1HE2  GLN   2          1HE2      GLN   2   8.123 -10.821   4.380
   19   2HE2  GLN   2          2HE2      GLN   2   9.779 -10.370   4.569
   20    H    TYR   3           H        TYR   3   5.705 -12.536   0.695
   21    HA   TYR   3           HA       TYR   3   6.711 -12.551  -2.067
   22   1HB   TYR   3          2HB       TYR   3   3.810 -12.379  -1.228
   23   2HB   TYR   3          1HB       TYR   3   4.401 -12.181  -2.873
   24    HD1  TYR   3           1HD      TYR   3   4.168 -14.006  -4.252
   25    HD2  TYR   3           2HD      TYR   3   4.735 -14.664  -0.087
   26    HE1  TYR   3           1HE      TYR   3   3.972 -16.429  -4.615
   27    HE2  TYR   3           2HE      TYR   3   4.547 -17.090  -0.440
   28    HH   TYR   3           HH       TYR   3   3.527 -18.433  -3.472
   29    H    LYS   4           H        LYS   4   6.657 -10.571  -3.150
   30    HA   LYS   4           HA       LYS   4   6.345  -8.254  -1.373
   31   1HB   LYS   4          2HB       LYS   4   8.610  -8.496  -2.174
   32   2HB   LYS   4          1HB       LYS   4   8.052  -8.632  -3.835
   33   1HG   LYS   4          2HG       LYS   4   7.530  -6.370  -3.975
   34   2HG   LYS   4          1HG       LYS   4   7.507  -6.172  -2.225
   35   1HD   LYS   4          2HD       LYS   4   9.501  -5.158  -3.273
   36   2HD   LYS   4          1HD       LYS   4   9.909  -6.427  -2.119
   37   1HE   LYS   4          2HE       LYS   4   9.703  -6.904  -5.086
   38   2HE   LYS   4          1HE       LYS   4  11.203  -6.428  -4.293
   39   1HZ   LYS   4          1HZ       LYS   4  11.500  -8.619  -4.071
   40   2HZ   LYS   4          2HZ       LYS   4   9.870  -8.987  -4.324
   41   3HZ   LYS   4          3HZ       LYS   4  10.401  -8.510  -2.790
   42    H    VAL   5           H        VAL   5   5.342  -6.366  -2.187
   43    HA   VAL   5           HA       VAL   5   3.750  -6.730  -4.625
   44    HB   VAL   5           HB       VAL   5   2.652  -5.700  -2.003
   45   1HG1  VAL   5          1HG1      VAL   5   1.121  -6.236  -4.534
   46   2HG1  VAL   5          2HG1      VAL   5   1.766  -4.647  -4.127
   47   3HG1  VAL   5          3HG1      VAL   5   0.570  -5.409  -3.078
   48   1HG2  VAL   5          1HG2      VAL   5   1.667  -8.140  -3.419
   49   2HG2  VAL   5          2HG2      VAL   5   1.517  -7.692  -1.720
   50   3HG2  VAL   5          3HG2      VAL   5   3.069  -8.239  -2.355
   51    H    ILE   6           H        ILE   6   4.040  -5.095  -5.963
   52    HA   ILE   6           HA       ILE   6   5.146  -2.589  -4.941
   53    HB   ILE   6           HB       ILE   6   4.845  -3.616  -7.766
   54   1HG1  ILE   6          2HG1      ILE   6   7.294  -3.139  -6.056
   55   2HG1  ILE   6          1HG1      ILE   6   6.593  -4.713  -6.409
   56   1HG2  ILE   6          1HG2      ILE   6   4.603  -1.204  -7.754
   57   2HG2  ILE   6          2HG2      ILE   6   6.166  -1.652  -8.438
   58   3HG2  ILE   6          3HG2      ILE   6   6.069  -1.040  -6.787
   59   1HD1  ILE   6          1HD1      ILE   6   8.554  -4.244  -7.785
   60   2HD1  ILE   6          2HD1      ILE   6   7.746  -2.820  -8.442
   61   3HD1  ILE   6          3HD1      ILE   6   7.098  -4.428  -8.763
   62    H    LEU   7           H        LEU   7   3.918  -0.853  -4.660
   63    HA   LEU   7           HA       LEU   7   1.217  -0.871  -5.818
   64   1HB   LEU   7          2HB       LEU   7   2.138   0.921  -3.585
   65   2HB   LEU   7          1HB       LEU   7   0.503   0.430  -3.989
   66    HG   LEU   7           HG       LEU   7   2.628  -1.337  -2.785
   67   1HD1  LEU   7          1HD1      LEU   7   1.336  -1.264  -0.787
   68   2HD1  LEU   7          2HD1      LEU   7   0.050  -0.354  -1.581
   69   3HD1  LEU   7          3HD1      LEU   7   1.619   0.398  -1.297
   70   1HD2  LEU   7          1HD2      LEU   7   0.988  -3.061  -2.714
   71   2HD2  LEU   7          2HD2      LEU   7   1.058  -2.469  -4.372
   72   3HD2  LEU   7          3HD2      LEU   7  -0.266  -1.977  -3.317
   73    H    ASN   8           H        ASN   8   1.855  -0.060  -7.868
   74    HA   ASN   8           HA       ASN   8   3.094   2.574  -7.967
   75   1HB   ASN   8          2HB       ASN   8   2.402   0.558 -10.099
   76   2HB   ASN   8          1HB       ASN   8   3.001   2.168 -10.472
   77   1HD2  ASN   8          1HD2      ASN   8   4.478   1.404  -7.664
   78   2HD2  ASN   8          2HD2      ASN   8   5.920   0.689  -8.276
   79    H    GLY   9           H        GLY   9   1.745   4.269  -7.719
   80   1HA   GLY   9          2HA       GLY   9  -0.870   4.127  -9.092
   81   2HA   GLY   9          1HA       GLY   9  -0.600   5.019  -7.606
   82    H    LYS  10           H        LYS  10  -1.625   6.727  -8.896
   83    HA   LYS  10           HA       LYS  10  -0.166   7.907 -11.058
   84   1HB   LYS  10          2HB       LYS  10  -2.320   9.203  -9.387
   85   2HB   LYS  10          1HB       LYS  10  -1.859   9.604 -11.033
   86   1HG   LYS  10          2HG       LYS  10  -3.214   7.081 -10.109
   87   2HG   LYS  10          1HG       LYS  10  -3.944   8.398 -11.028
   88   1HD   LYS  10          2HD       LYS  10  -1.599   6.806 -12.039
   89   2HD   LYS  10          1HD       LYS  10  -3.273   6.342 -12.346
   90   1HE   LYS  10          2HE       LYS  10  -2.493   7.570 -14.236
   91   2HE   LYS  10          1HE       LYS  10  -3.634   8.588 -13.362
   92   1HZ   LYS  10          1HZ       LYS  10  -2.056  10.085 -12.898
   93   2HZ   LYS  10          2HZ       LYS  10  -1.197   9.371 -14.166
   94   3HZ   LYS  10          3HZ       LYS  10  -0.875   8.918 -12.571
   95    H    THR  11           H        THR  11  -0.937   9.025  -7.762
   96    HA   THR  11           HA       THR  11   1.404  10.785  -7.850
   97    HB   THR  11           HB       THR  11   0.160  11.799  -5.819
   98    HG1  THR  11           1HG      THR  11  -2.018  10.493  -7.056
   99   1HG2  THR  11          1HG2      THR  11   0.282  12.908  -8.024
  100   2HG2  THR  11          2HG2      THR  11  -1.232  13.206  -7.168
  101   3HG2  THR  11          3HG2      THR  11  -1.183  12.047  -8.496
  102    H    LEU  12           H        LEU  12   0.817   7.783  -6.904
  103    HA   LEU  12           HA       LEU  12   2.590   8.032  -4.598
  104   1HB   LEU  12          2HB       LEU  12   0.325   7.909  -3.708
  105   2HB   LEU  12          1HB       LEU  12   0.030   6.437  -4.616
  106    HG   LEU  12           HG       LEU  12   1.599   5.218  -3.269
  107   1HD1  LEU  12          1HD1      LEU  12   3.378   6.341  -2.547
  108   2HD1  LEU  12          2HD1      LEU  12   2.364   6.887  -1.211
  109   3HD1  LEU  12          3HD1      LEU  12   2.545   7.884  -2.651
  110   1HD2  LEU  12          1HD2      LEU  12   0.117   4.934  -1.633
  111   2HD2  LEU  12          2HD2      LEU  12  -0.766   6.302  -2.314
  112   3HD2  LEU  12          3HD2      LEU  12   0.390   6.562  -1.009
  113    H    LYS  13           H        LYS  13   4.045   6.438  -4.360
  114    HA   LYS  13           HA       LYS  13   3.833   4.002  -5.947
  115   1HB   LYS  13          2HB       LYS  13   6.315   5.719  -6.096
  116   2HB   LYS  13          1HB       LYS  13   5.990   4.236  -6.981
  117   1HG   LYS  13          2HG       LYS  13   5.595   5.801  -8.596
  118   2HG   LYS  13          1HG       LYS  13   3.972   5.596  -7.931
  119   1HD   LYS  13          2HD       LYS  13   4.343   7.575  -6.498
  120   2HD   LYS  13          1HD       LYS  13   5.928   7.786  -7.239
  121   1HE   LYS  13          2HE       LYS  13   3.277   7.872  -8.673
  122   2HE   LYS  13          1HE       LYS  13   4.269   9.266  -8.249
  123   1HZ   LYS  13          1HZ       LYS  13   5.322   9.008 -10.164
  124   2HZ   LYS  13          2HZ       LYS  13   4.450   7.602 -10.514
  125   3HZ   LYS  13          3HZ       LYS  13   5.898   7.502  -9.648
  126    H    GLY  14           H        GLY  14   5.071   2.267  -5.095
  127   1HA   GLY  14          2HA       GLY  14   7.045   2.551  -3.119
  128   2HA   GLY  14          1HA       GLY  14   5.499   2.361  -2.315
  129    H    GLU  15           H        GLU  15   6.644   0.472  -1.433
  130    HA   GLU  15           HA       GLU  15   5.963  -1.889  -2.985
  131   1HB   GLU  15          2HB       GLU  15   8.738  -1.469  -1.856
  132   2HB   GLU  15          1HB       GLU  15   8.148  -2.953  -2.589
  133   1HG   GLU  15          2HG       GLU  15   7.869  -1.800  -4.718
  134   2HG   GLU  15          1HG       GLU  15   8.442  -0.303  -3.985
  135    H    THR  16           H        THR  16   5.741  -3.782  -1.709
  136    HA   THR  16           HA       THR  16   6.048  -3.584   1.161
  137    HB   THR  16           HB       THR  16   3.928  -2.659   1.190
  138    HG1  THR  16           1HG      THR  16   3.322  -5.399   1.117
  139   1HG2  THR  16          1HG2      THR  16   3.047  -2.542  -0.894
  140   2HG2  THR  16          2HG2      THR  16   2.055  -3.842  -0.229
  141   3HG2  THR  16          3HG2      THR  16   3.427  -4.222  -1.267
  142    H    THR  17           H        THR  17   5.299  -5.734   2.225
  143    HA   THR  17           HA       THR  17   5.576  -7.985   0.368
  144    HB   THR  17           HB       THR  17   7.278  -9.019   1.887
  145    HG1  THR  17           1HG      THR  17   7.165  -6.442   3.037
  146   1HG2  THR  17          1HG2      THR  17   7.780  -6.669   0.191
  147   2HG2  THR  17          2HG2      THR  17   8.467  -8.291   0.128
  148   3HG2  THR  17          3HG2      THR  17   9.073  -7.122   1.300
  149    H    THR  18           H        THR  18   4.059  -9.406   0.736
  150    HA   THR  18           HA       THR  18   2.931  -9.710   3.451
  151    HB   THR  18           HB       THR  18   1.368  -9.037   1.618
  152    HG1  THR  18           1HG      THR  18   0.670 -10.269   3.438
  153   1HG2  THR  18          1HG2      THR  18   2.067 -11.736   0.498
  154   2HG2  THR  18          2HG2      THR  18   2.215 -10.166  -0.294
  155   3HG2  THR  18          3HG2      THR  18   0.619 -10.828   0.061
  156    H    GLU  19           H        GLU  19   2.831 -11.712   4.398
  157    HA   GLU  19           HA       GLU  19   4.443 -13.834   3.161
  158   1HB   GLU  19          2HB       GLU  19   5.164 -13.208   5.373
  159   2HB   GLU  19          1HB       GLU  19   3.529 -13.339   6.002
  160   1HG   GLU  19          2HG       GLU  19   4.878 -15.214   6.710
  161   2HG   GLU  19          1HG       GLU  19   3.578 -15.749   5.649
  162    H    ALA  20           H        ALA  20   3.239 -15.258   1.973
  163    HA   ALA  20           HA       ALA  20   0.892 -16.428   3.242
  164   1HB   ALA  20          1HB       ALA  20   0.509 -15.715   0.402
  165   2HB   ALA  20          2HB       ALA  20   0.450 -14.394   1.568
  166   3HB   ALA  20          3HB       ALA  20  -0.650 -15.763   1.731
  167    H    VAL  21           H        VAL  21   0.372 -18.458   2.542
  168    HA   VAL  21           HA       VAL  21   2.369 -20.197   1.820
  169    HB   VAL  21           HB       VAL  21  -0.544 -20.654   1.187
  170   1HG1  VAL  21          1HG1      VAL  21  -0.087 -22.947   1.300
  171   2HG1  VAL  21          2HG1      VAL  21   1.477 -22.688   2.077
  172   3HG1  VAL  21          3HG1      VAL  21   1.256 -22.276   0.375
  173   1HG2  VAL  21          1HG2      VAL  21  -0.714 -20.057   3.390
  174   2HG2  VAL  21          2HG2      VAL  21   0.923 -20.591   3.777
  175   3HG2  VAL  21          3HG2      VAL  21  -0.362 -21.778   3.554
  176    H    ASP  22           H        ASP  22   0.174 -18.482  -0.329
  177    HA   ASP  22           HA       ASP  22   1.915 -19.151  -2.563
  178   1HB   ASP  22          2HB       ASP  22   0.146 -19.971  -4.006
  179   2HB   ASP  22          1HB       ASP  22   0.232 -20.962  -2.555
  180    H    ALA  23           H        ALA  23   1.072 -18.026  -4.642
  181    HA   ALA  23           HA       ALA  23   1.070 -15.283  -4.182
  182   1HB   ALA  23          1HB       ALA  23   1.841 -16.013  -6.276
  183   2HB   ALA  23          2HB       ALA  23   0.342 -15.151  -6.618
  184   3HB   ALA  23          3HB       ALA  23   0.361 -16.914  -6.601
  185    H    ALA  24           H        ALA  24  -1.636 -17.451  -4.891
  186    HA   ALA  24           HA       ALA  24  -3.603 -15.438  -5.078
  187   1HB   ALA  24          1HB       ALA  24  -4.327 -17.472  -5.912
  188   2HB   ALA  24          2HB       ALA  24  -5.145 -17.420  -4.351
  189   3HB   ALA  24          3HB       ALA  24  -3.680 -18.383  -4.549
  190    H    THR  25           H        THR  25  -2.729 -17.556  -2.338
  191    HA   THR  25           HA       THR  25  -4.400 -16.425  -0.433
  192    HB   THR  25           HB       THR  25  -2.765 -17.283   1.219
  193    HG1  THR  25           1HG      THR  25  -0.785 -17.452   0.680
  194   1HG2  THR  25          1HG2      THR  25  -2.563 -19.664   0.296
  195   2HG2  THR  25          2HG2      THR  25  -3.508 -19.054  -1.062
  196   3HG2  THR  25          3HG2      THR  25  -4.173 -18.998   0.570
  197    H    ALA  26           H        ALA  26  -1.111 -15.573  -1.417
  198    HA   ALA  26           HA       ALA  26  -0.717 -13.430   0.358
  199   1HB   ALA  26          1HB       ALA  26   1.192 -12.995  -0.828
  200   2HB   ALA  26          2HB       ALA  26   0.413 -13.254  -2.388
  201   3HB   ALA  26          3HB       ALA  26   0.880 -14.636  -1.396
  202    H    GLU  27           H        GLU  27  -1.829 -13.450  -3.040
  203    HA   GLU  27           HA       GLU  27  -2.401 -10.806  -3.401
  204   1HB   GLU  27          2HB       GLU  27  -2.596 -12.483  -5.168
  205   2HB   GLU  27          1HB       GLU  27  -3.992 -13.187  -4.362
  206   1HG   GLU  27          2HG       GLU  27  -5.258 -11.151  -4.728
  207   2HG   GLU  27          1HG       GLU  27  -3.856 -10.399  -5.489
  208    H    LYS  28           H        LYS  28  -4.533 -13.294  -2.020
  209    HA   LYS  28           HA       LYS  28  -6.713 -11.603  -1.479
  210   1HB   LYS  28          2HB       LYS  28  -5.838 -14.128  -0.057
  211   2HB   LYS  28          1HB       LYS  28  -7.407 -13.357   0.135
  212   1HG   LYS  28          2HG       LYS  28  -6.301 -14.596  -2.373
  213   2HG   LYS  28          1HG       LYS  28  -7.611 -15.215  -1.367
  214   1HD   LYS  28          2HD       LYS  28  -8.949 -13.240  -1.894
  215   2HD   LYS  28          1HD       LYS  28  -7.636 -12.614  -2.893
  216   1HE   LYS  28          2HE       LYS  28  -9.353 -13.673  -4.264
  217   2HE   LYS  28          1HE       LYS  28  -7.826 -14.548  -4.368
  218   1HZ   LYS  28          1HZ       LYS  28  -8.696 -16.353  -3.384
  219   2HZ   LYS  28          2HZ       LYS  28 -10.173 -15.715  -3.901
  220   3HZ   LYS  28          3HZ       LYS  28  -9.655 -15.463  -2.312
  221    H    VAL  29           H        VAL  29  -3.937 -12.590   0.484
  222    HA   VAL  29           HA       VAL  29  -4.628 -11.267   2.844
  223    HB   VAL  29           HB       VAL  29  -1.861 -11.770   1.727
  224   1HG1  VAL  29          1HG1      VAL  29  -2.831 -10.736   4.337
  225   2HG1  VAL  29          2HG1      VAL  29  -1.384 -10.320   3.420
  226   3HG1  VAL  29          3HG1      VAL  29  -1.443 -11.826   4.335
  227   1HG2  VAL  29          1HG2      VAL  29  -2.790 -13.483   3.891
  228   2HG2  VAL  29          2HG2      VAL  29  -2.031 -13.907   2.356
  229   3HG2  VAL  29          3HG2      VAL  29  -3.771 -13.626   2.432
  230    H    VAL  30           H        VAL  30  -2.974 -10.145  -0.056
  231    HA   VAL  30           HA       VAL  30  -2.335  -7.558   0.959
  232    HB   VAL  30           HB       VAL  30  -2.662  -8.479  -1.907
  233   1HG1  VAL  30          1HG1      VAL  30  -1.625  -6.505  -2.618
  234   2HG1  VAL  30          2HG1      VAL  30  -1.071  -6.104  -0.992
  235   3HG1  VAL  30          3HG1      VAL  30  -2.781  -5.965  -1.400
  236   1HG2  VAL  30          1HG2      VAL  30  -0.897  -9.567  -0.354
  237   2HG2  VAL  30          2HG2      VAL  30  -0.047  -8.030  -0.526
  238   3HG2  VAL  30          3HG2      VAL  30  -0.405  -9.004  -1.953
  239    H    LYS  31           H        LYS  31  -4.918  -8.792  -1.201
  240    HA   LYS  31           HA       LYS  31  -6.334  -6.453  -1.555
  241   1HB   LYS  31          2HB       LYS  31  -7.203  -9.318  -1.405
  242   2HB   LYS  31          1HB       LYS  31  -8.396  -8.039  -1.592
  243   1HG   LYS  31          2HG       LYS  31  -7.284  -7.293  -3.629
  244   2HG   LYS  31          1HG       LYS  31  -6.088  -8.576  -3.446
  245   1HD   LYS  31          2HD       LYS  31  -7.749 -10.264  -3.756
  246   2HD   LYS  31          1HD       LYS  31  -9.049  -9.074  -3.681
  247   1HE   LYS  31          2HE       LYS  31  -8.609  -9.766  -5.983
  248   2HE   LYS  31          1HE       LYS  31  -8.256  -8.055  -5.746
  249   1HZ   LYS  31          1HZ       LYS  31  -6.525 -10.150  -6.583
  250   2HZ   LYS  31          2HZ       LYS  31  -5.893  -9.356  -5.231
  251   3HZ   LYS  31          3HZ       LYS  31  -6.279  -8.477  -6.623
  252    H    GLN  32           H        GLN  32  -6.428  -8.715   1.141
  253    HA   GLN  32           HA       GLN  32  -8.520  -7.438   2.568
  254   1HB   GLN  32          2HB       GLN  32  -7.719  -9.738   3.073
  255   2HB   GLN  32          1HB       GLN  32  -6.208  -9.061   3.664
  256   1HG   GLN  32          2HG       GLN  32  -7.593  -9.589   5.531
  257   2HG   GLN  32          1HG       GLN  32  -7.469  -7.840   5.396
  258   1HE2  GLN  32          1HE2      GLN  32  -9.500  -9.035   2.992
  259   2HE2  GLN  32          2HE2      GLN  32 -11.007  -8.759   3.781
  260    H    PHE  33           H        PHE  33  -5.053  -7.019   2.404
  261    HA   PHE  33           HA       PHE  33  -4.596  -5.284   4.522
  262   1HB   PHE  33          2HB       PHE  33  -2.875  -6.356   3.019
  263   2HB   PHE  33          1HB       PHE  33  -3.280  -5.158   1.796
  264    HD1  PHE  33           1HD      PHE  33  -2.223  -5.386   5.350
  265    HD2  PHE  33           2HD      PHE  33  -2.023  -3.221   1.678
  266    HE1  PHE  33           1HE      PHE  33  -0.596  -3.826   6.340
  267    HE2  PHE  33           2HE      PHE  33  -0.393  -1.675   2.682
  268    HZ   PHE  33           HZ       PHE  33   0.314  -1.987   5.023
  269    H    PHE  34           H        PHE  34  -5.115  -4.406   1.132
  270    HA   PHE  34           HA       PHE  34  -5.531  -1.638   1.667
  271   1HB   PHE  34          2HB       PHE  34  -6.178  -3.256  -0.798
  272   2HB   PHE  34          1HB       PHE  34  -6.157  -1.492  -0.705
  273    HD1  PHE  34           1HD      PHE  34  -3.860  -0.814   0.781
  274    HD2  PHE  34           2HD      PHE  34  -4.347  -3.988  -2.003
  275    HE1  PHE  34           1HE      PHE  34  -1.437  -0.833   0.390
  276    HE2  PHE  34           2HE      PHE  34  -1.919  -4.007  -2.410
  277    HZ   PHE  34           HZ       PHE  34  -0.470  -2.428  -1.200
  278    H    ASN  35           H        ASN  35  -7.681  -4.365   1.113
  279    HA   ASN  35           HA       ASN  35 -10.129  -3.101   0.924
  280   1HB   ASN  35          2HB       ASN  35  -9.827  -5.530   0.719
  281   2HB   ASN  35          1HB       ASN  35  -9.452  -5.640   2.434
  282   1HD2  ASN  35          1HD2      ASN  35 -11.683  -6.464   0.423
  283   2HD2  ASN  35          2HD2      ASN  35 -13.123  -6.187   1.337
  284    H    ASP  36           H        ASP  36  -8.171  -3.803   3.718
  285    HA   ASP  36           HA       ASP  36 -10.105  -2.581   5.531
  286   1HB   ASP  36          2HB       ASP  36  -7.517  -4.039   6.082
  287   2HB   ASP  36          1HB       ASP  36  -8.563  -3.366   7.329
  288    H    ASN  37           H        ASN  37  -7.104  -1.769   3.964
  289    HA   ASN  37           HA       ASN  37  -6.476   0.348   5.841
  290   1HB   ASN  37          2HB       ASN  37  -5.323  -0.326   3.124
  291   2HB   ASN  37          1HB       ASN  37  -4.759   1.008   4.123
  292   1HD2  ASN  37          1HD2      ASN  37  -3.606  -1.642   3.130
  293   2HD2  ASN  37          2HD2      ASN  37  -2.910  -2.329   4.556
  294    H    GLY  38           H        GLY  38  -7.695   0.066   2.553
  295   1HA   GLY  38          2HA       GLY  38  -8.104   2.137   1.251
  296   2HA   GLY  38          1HA       GLY  38  -9.576   1.399   1.843
  297    H    VAL  39           H        VAL  39 -10.963   2.719   2.740
  298    HA   VAL  39           HA       VAL  39 -10.048   5.384   3.543
  299    HB   VAL  39           HB       VAL  39 -12.853   4.439   3.026
  300   1HG1  VAL  39          1HG1      VAL  39 -13.046   6.997   2.536
  301   2HG1  VAL  39          2HG1      VAL  39 -11.617   7.102   3.566
  302   3HG1  VAL  39          3HG1      VAL  39 -13.110   6.405   4.196
  303   1HG2  VAL  39          1HG2      VAL  39 -12.600   5.548   0.823
  304   2HG2  VAL  39          2HG2      VAL  39 -11.569   4.131   1.018
  305   3HG2  VAL  39          3HG2      VAL  39 -10.881   5.748   1.160
  306    H    ASP  40           H        ASP  40 -10.772   2.578   5.273
  307    HA   ASP  40           HA       ASP  40 -11.762   4.228   7.497
  308   1HB   ASP  40          2HB       ASP  40 -12.525   1.374   6.856
  309   2HB   ASP  40          1HB       ASP  40 -13.018   2.254   8.299
  310    H    GLY  41           H        GLY  41  -9.020   3.083   6.588
  311   1HA   GLY  41          2HA       GLY  41  -8.326   1.264   8.708
  312   2HA   GLY  41          1HA       GLY  41  -7.224   1.984   7.548
  313    H    GLU  42           H        GLU  42  -6.410   1.698  10.108
  314    HA   GLU  42           HA       GLU  42  -6.769   4.281  11.444
  315   1HB   GLU  42          2HB       GLU  42  -5.284   1.806  12.359
  316   2HB   GLU  42          1HB       GLU  42  -5.532   3.260  13.314
  317   1HG   GLU  42          2HG       GLU  42  -7.116   1.717  14.082
  318   2HG   GLU  42          1HG       GLU  42  -8.009   2.848  13.067
  319    H    TRP  43           H        TRP  43  -5.552   5.760  10.361
  320    HA   TRP  43           HA       TRP  43  -2.802   5.075   9.642
  321   1HB   TRP  43          2HB       TRP  43  -4.488   7.479   8.951
  322   2HB   TRP  43          1HB       TRP  43  -2.862   7.176   8.354
  323    HD1  TRP  43           HD       TRP  43  -5.383   4.284   8.465
  324    HE1  TRP  43           1HE      TRP  43  -5.975   3.649   6.029
  325    HE3  TRP  43           3HE      TRP  43  -3.034   8.103   6.023
  326    HZ2  TRP  43           2HZ      TRP  43  -5.510   4.634   3.443
  327    HZ3  TRP  43           3HZ      TRP  43  -3.152   8.185   3.573
  328    HH2  TRP  43           HH       TRP  43  -4.364   6.485   2.306
  329    H    THR  44           H        THR  44  -1.133   5.684  10.833
  330    HA   THR  44           HA       THR  44  -1.449   7.958  12.678
  331    HB   THR  44           HB       THR  44   0.461   6.955  13.928
  332    HG1  THR  44           1HG      THR  44   0.077   4.724  12.226
  333   1HG2  THR  44          1HG2      THR  44  -2.098   6.260  14.185
  334   2HG2  THR  44          2HG2      THR  44  -0.806   5.564  15.162
  335   3HG2  THR  44          3HG2      THR  44  -1.418   4.689  13.757
  336    H    TYR  45           H        TYR  45  -0.070   9.680  12.480
  337    HA   TYR  45           HA       TYR  45   1.787   9.576  10.207
  338   1HB   TYR  45          2HB       TYR  45   0.024  11.264  10.050
  339   2HB   TYR  45          1HB       TYR  45   0.534  11.959  11.585
  340    HD1  TYR  45           1HD      TYR  45   2.431  10.872   8.554
  341    HD2  TYR  45           2HD      TYR  45   1.448  14.046  11.209
  342    HE1  TYR  45           1HE      TYR  45   3.998  12.345   7.363
  343    HE2  TYR  45           2HE      TYR  45   3.009  15.530  10.022
  344    HH   TYR  45           HH       TYR  45   4.000  15.618   7.619
  345    H    ASP  46           H        ASP  46   3.896  10.274  10.349
  346    HA   ASP  46           HA       ASP  46   4.913  10.808  13.064
  347   1HB   ASP  46          2HB       ASP  46   5.533   8.543  12.360
  348   2HB   ASP  46          1HB       ASP  46   6.245   9.183  10.883
  349    H    ASP  47           H        ASP  47   4.697  13.048  12.535
  350    HA   ASP  47           HA       ASP  47   5.679  14.447  10.412
  351   1HB   ASP  47          2HB       ASP  47   5.854  15.276  13.314
  352   2HB   ASP  47          1HB       ASP  47   5.962  16.363  11.934
  353    H    ALA  48           H        ALA  48   7.537  13.153  13.106
  354    HA   ALA  48           HA       ALA  48   9.932  14.451  12.839
  355   1HB   ALA  48          1HB       ALA  48  10.757  12.903  14.248
  356   2HB   ALA  48          2HB       ALA  48  10.171  11.551  13.280
  357   3HB   ALA  48          3HB       ALA  48   9.067  12.408  14.357
  358    H    THR  49           H        THR  49   8.682  11.886  10.781
  359    HA   THR  49           HA       THR  49  11.031  12.273   9.046
  360    HB   THR  49           HB       THR  49  10.895   9.883   8.421
  361    HG1  THR  49           1HG      THR  49   9.277   8.737   9.053
  362   1HG2  THR  49          1HG2      THR  49  11.521  10.738  11.173
  363   2HG2  THR  49          2HG2      THR  49  12.538   9.959   9.961
  364   3HG2  THR  49          3HG2      THR  49  11.377   9.004  10.883
  365    H    LYS  50           H        LYS  50   8.050  13.178   9.126
  366    HA   LYS  50           HA       LYS  50   6.361  13.552   7.625
  367   1HB   LYS  50          2HB       LYS  50   8.666  13.202   5.695
  368   2HB   LYS  50          1HB       LYS  50   7.088  13.837   5.252
  369   1HG   LYS  50          2HG       LYS  50   8.931  15.084   7.279
  370   2HG   LYS  50          1HG       LYS  50   8.789  15.586   5.593
  371   1HD   LYS  50          2HD       LYS  50   6.399  16.065   5.966
  372   2HD   LYS  50          1HD       LYS  50   6.597  15.633   7.666
  373   1HE   LYS  50          2HE       LYS  50   8.001  17.877   6.218
  374   2HE   LYS  50          1HE       LYS  50   6.677  18.049   7.369
  375   1HZ   LYS  50          1HZ       LYS  50   8.390  16.676   8.844
  376   2HZ   LYS  50          2HZ       LYS  50   8.388  18.367   8.783
  377   3HZ   LYS  50          3HZ       LYS  50   9.492  17.490   7.849
  378    H    THR  51           H        THR  51   6.816  10.822   8.490
  379    HA   THR  51           HA       THR  51   6.000   9.293   6.122
  380    HB   THR  51           HB       THR  51   7.057   8.360   8.795
  381    HG1  THR  51           1HG      THR  51   8.238   8.202   6.227
  382   1HG2  THR  51          1HG2      THR  51   5.524   6.706   7.847
  383   2HG2  THR  51          2HG2      THR  51   7.197   6.146   7.852
  384   3HG2  THR  51          3HG2      THR  51   6.460   6.713   6.353
  385    H    PHE  52           H        PHE  52   4.203   7.866   6.237
  386    HA   PHE  52           HA       PHE  52   2.325   8.458   8.428
  387   1HB   PHE  52          2HB       PHE  52   1.593   8.025   5.535
  388   2HB   PHE  52          1HB       PHE  52   0.474   8.316   6.858
  389    HD1  PHE  52           1HD      PHE  52  -0.209  10.474   7.329
  390    HD2  PHE  52           2HD      PHE  52   3.349   9.862   5.077
  391    HE1  PHE  52           1HE      PHE  52  -0.064  12.893   6.907
  392    HE2  PHE  52           2HE      PHE  52   3.502  12.278   4.657
  393    HZ   PHE  52           HZ       PHE  52   1.796  13.798   5.570
  394    H    THR  53           H        THR  53   2.656   6.651   9.549
  395    HA   THR  53           HA       THR  53   2.712   4.046   8.355
  396    HB   THR  53           HB       THR  53   2.410   3.312  10.839
  397    HG1  THR  53           1HG      THR  53   3.331   5.942  11.265
  398   1HG2  THR  53          1HG2      THR  53   4.815   4.584   9.630
  399   2HG2  THR  53          2HG2      THR  53   4.490   2.881   9.976
  400   3HG2  THR  53          3HG2      THR  53   4.849   4.001  11.295
  401    H    VAL  54           H        VAL  54   1.133   2.783   7.816
  402    HA   VAL  54           HA       VAL  54  -1.584   3.367   8.789
  403    HB   VAL  54           HB       VAL  54  -0.763   1.892   6.269
  404   1HG1  VAL  54          1HG1      VAL  54  -2.811   0.986   6.566
  405   2HG1  VAL  54          2HG1      VAL  54  -3.358   2.531   5.915
  406   3HG1  VAL  54          3HG1      VAL  54  -3.337   2.266   7.658
  407   1HG2  VAL  54          1HG2      VAL  54  -0.984   3.797   5.082
  408   2HG2  VAL  54          2HG2      VAL  54  -0.591   4.556   6.626
  409   3HG2  VAL  54          3HG2      VAL  54  -2.273   4.419   6.114
  410    H    THR  55           H        THR  55  -1.727   2.128  10.582
  411    HA   THR  55           HA       THR  55  -0.783  -0.620  10.501
  412    HB   THR  55           HB       THR  55  -2.110   0.689  12.861
  413    HG1  THR  55           1HG      THR  55   0.568   0.913  11.965
  414   1HG2  THR  55          1HG2      THR  55  -1.669  -1.703  13.046
  415   2HG2  THR  55          2HG2      THR  55  -0.652  -0.770  14.144
  416   3HG2  THR  55          3HG2      THR  55   0.028  -1.421  12.652
  417    H    GLU  56           H        GLU  56  -2.041  -2.189   9.832
  418    HA   GLU  56           HA       GLU  56  -4.713  -2.028   9.177
  419   1HB   GLU  56          2HB       GLU  56  -3.158  -3.824   8.462
  420   2HB   GLU  56          1HB       GLU  56  -3.218  -4.499  10.085
  421   1HG   GLU  56          2HG       GLU  56  -5.586  -4.227   8.243
  422   2HG   GLU  56          1HG       GLU  56  -4.641  -5.695   8.472
  423   1H    MET   1          1HT       MET   1   6.878  19.878  -2.184
  424   2H    MET   1          2HT       MET   1   5.669  19.174  -1.232
  425   3H    MET   1          3HT       MET   1   6.017  18.541  -2.761
  426    HA   MET   1           HA       MET   1   8.378  18.209  -1.820
  427   1HB   MET   1          2HB       MET   1   7.862  19.492   0.233
  428   2HB   MET   1          1HB       MET   1   6.661  18.287   0.675
  429   1HG   MET   1          2HG       MET   1   8.351  16.616   0.958
  430   2HG   MET   1          1HG       MET   1   9.590  17.696   0.319
  431   1HE   MET   1          1HE       MET   1   6.675  18.734   2.759
  432   2HE   MET   1          2HE       MET   1   7.414  18.413   4.326
  433   3HE   MET   1          3HE       MET   1   7.044  17.078   3.236
  434    H    GLN   2           H        GLN   2   8.814  15.984  -0.868
  435    HA   GLN   2           HA       GLN   2   6.732  14.145  -1.810
  436   1HB   GLN   2          2HB       GLN   2   8.906  13.929  -2.924
  437   2HB   GLN   2          1HB       GLN   2   9.689  13.679  -1.370
  438   1HG   GLN   2          2HG       GLN   2   8.430  11.612  -1.062
  439   2HG   GLN   2          1HG       GLN   2   7.635  11.864  -2.615
  440   1HE2  GLN   2          1HE2      GLN   2   8.444  10.673  -4.172
  441   2HE2  GLN   2          2HE2      GLN   2  10.092  10.181  -4.336
  442    H    TYR   3           H        TYR   3   6.016  12.447  -0.522
  443    HA   TYR   3           HA       TYR   3   6.984  12.437   2.254
  444   1HB   TYR   3          2HB       TYR   3   4.091  12.335   1.374
  445   2HB   TYR   3          1HB       TYR   3   4.656  12.124   3.028
  446    HD1  TYR   3           1HD      TYR   3   4.447  13.954   4.404
  447    HD2  TYR   3           2HD      TYR   3   5.089  14.598   0.247
  448    HE1  TYR   3           1HE      TYR   3   4.305  16.380   4.765
  449    HE2  TYR   3           2HE      TYR   3   4.953  17.028   0.599
  450    HH   TYR   3           HH       TYR   3   3.923  18.395   3.615
  451    H    LYS   4           H        LYS   4   6.868  10.458   3.335
  452    HA   LYS   4           HA       LYS   4   6.524   8.148   1.554
  453   1HB   LYS   4          2HB       LYS   4   8.782   8.337   2.387
  454   2HB   LYS   4          1HB       LYS   4   8.204   8.486   4.040
  455   1HG   LYS   4          2HG       LYS   4   7.625   6.238   4.173
  456   2HG   LYS   4          1HG       LYS   4   7.623   6.040   2.422
  457   1HD   LYS   4          2HD       LYS   4   9.575   4.977   3.497
  458   2HD   LYS   4          1HD       LYS   4  10.033   6.237   2.352
  459   1HE   LYS   4          2HE       LYS   4   9.794   6.717   5.315
  460   2HE   LYS   4          1HE       LYS   4  11.294   6.206   4.543
  461   1HZ   LYS   4          1HZ       LYS   4  11.647   8.388   4.326
  462   2HZ   LYS   4          2HZ       LYS   4  10.023   8.796   4.554
  463   3HZ   LYS   4          3HZ       LYS   4  10.565   8.307   3.029
  464    H    VAL   5           H        VAL   5   5.464   6.286   2.355
  465    HA   VAL   5           HA       VAL   5   3.846   6.689   4.770
  466    HB   VAL   5           HB       VAL   5   2.764   5.685   2.131
  467   1HG1  VAL   5          1HG1      VAL   5   1.208   6.260   4.636
  468   2HG1  VAL   5          2HG1      VAL   5   1.820   4.654   4.239
  469   3HG1  VAL   5          3HG1      VAL   5   0.658   5.445   3.174
  470   1HG2  VAL   5          1HG2      VAL   5   1.815   8.149   3.532
  471   2HG2  VAL   5          2HG2      VAL   5   1.680   7.705   1.831
  472   3HG2  VAL   5          3HG2      VAL   5   3.236   8.214   2.489
  473    H    ILE   6           H        ILE   6   4.077   5.048   6.110
  474    HA   ILE   6           HA       ILE   6   5.136   2.517   5.104
  475    HB   ILE   6           HB       ILE   6   4.822   3.550   7.926
  476   1HG1  ILE   6          2HG1      ILE   6   7.281   3.017   6.248
  477   2HG1  ILE   6          1HG1      ILE   6   6.612   4.605   6.594
  478   1HG2  ILE   6          1HG2      ILE   6   4.521   1.145   7.909
  479   2HG2  ILE   6          2HG2      ILE   6   6.084   1.555   8.614
  480   3HG2  ILE   6          3HG2      ILE   6   5.996   0.946   6.962
  481   1HD1  ILE   6          1HD1      ILE   6   8.543   4.086   7.995
  482   2HD1  ILE   6          2HD1      ILE   6   7.692   2.683   8.640
  483   3HD1  ILE   6          3HD1      ILE   6   7.080   4.307   8.955
  484    H    LEU   7           H        LEU   7   3.872   0.810   4.806
  485    HA   LEU   7           HA       LEU   7   1.156   0.893   5.924
  486   1HB   LEU   7          2HB       LEU   7   2.065  -0.921   3.703
  487   2HB   LEU   7          1HB       LEU   7   0.438  -0.389   4.084
  488    HG   LEU   7           HG       LEU   7   2.621   1.325   2.911
  489   1HD1  LEU   7          1HD1      LEU   7   1.355   1.284   0.895
  490   2HD1  LEU   7          2HD1      LEU   7   0.037   0.405   1.671
  491   3HD1  LEU   7          3HD1      LEU   7   1.591  -0.385   1.408
  492   1HD2  LEU   7          1HD2      LEU   7   1.024   3.090   2.817
  493   2HD2  LEU   7          2HD2      LEU   7   1.055   2.495   4.476
  494   3HD2  LEU   7          3HD2      LEU   7  -0.265   2.035   3.402
  495    H    ASN   8           H        ASN   8   1.745   0.068   7.983
  496    HA   ASN   8           HA       ASN   8   2.918  -2.595   8.098
  497   1HB   ASN   8          2HB       ASN   8   2.245  -0.561  10.220
  498   2HB   ASN   8          1HB       ASN   8   2.798  -2.186  10.602
  499   1HD2  ASN   8          1HD2      ASN   8   4.333  -1.458   7.815
  500   2HD2  ASN   8          2HD2      ASN   8   5.784  -0.781   8.447
  501    H    GLY   9           H        GLY   9   1.532  -4.258   7.830
  502   1HA   GLY   9          2HA       GLY   9  -1.098  -4.051   9.166
  503   2HA   GLY   9          1HA       GLY   9  -0.832  -4.949   7.683
  504    H    LYS  10           H        LYS  10  -1.913  -6.631   8.959
  505    HA   LYS  10           HA       LYS  10  -0.514  -7.847  11.142
  506   1HB   LYS  10          2HB       LYS  10  -2.674  -9.089   9.439
  507   2HB   LYS  10          1HB       LYS  10  -2.247  -9.503  11.091
  508   1HG   LYS  10          2HG       LYS  10  -3.528  -6.948  10.150
  509   2HG   LYS  10          1HG       LYS  10  -4.302  -8.248  11.055
  510   1HD   LYS  10          2HD       LYS  10  -1.933  -6.714  12.102
  511   2HD   LYS  10          1HD       LYS  10  -3.599  -6.209  12.386
  512   1HE   LYS  10          2HE       LYS  10  -2.878  -7.456  14.287
  513   2HE   LYS  10          1HE       LYS  10  -4.030  -8.445  13.394
  514   1HZ   LYS  10          1HZ       LYS  10  -2.483  -9.981  12.952
  515   2HZ   LYS  10          2HZ       LYS  10  -1.626  -9.288  14.233
  516   3HZ   LYS  10          3HZ       LYS  10  -1.271  -8.844  12.641
  517    H    THR  11           H        THR  11  -1.266  -8.946   7.835
  518    HA   THR  11           HA       THR  11   1.029 -10.763   7.956
  519    HB   THR  11           HB       THR  11  -0.210 -11.745   5.906
  520    HG1  THR  11           1HG      THR  11  -2.374 -10.389   7.115
  521   1HG2  THR  11          1HG2      THR  11  -0.145 -12.857   8.112
  522   2HG2  THR  11          2HG2      THR  11  -1.653 -13.119   7.235
  523   3HG2  THR  11          3HG2      THR  11  -1.596 -11.963   8.564
  524    H    LEU  12           H        LEU  12   0.530  -7.748   7.003
  525    HA   LEU  12           HA       LEU  12   2.327  -8.040   4.721
  526   1HB   LEU  12          2HB       LEU  12   0.079  -7.861   3.799
  527   2HB   LEU  12          1HB       LEU  12  -0.192  -6.384   4.703
  528    HG   LEU  12           HG       LEU  12   1.424  -5.202   3.380
  529   1HD1  LEU  12          1HD1      LEU  12   3.186  -6.368   2.683
  530   2HD1  LEU  12          2HD1      LEU  12   2.178  -6.889   1.333
  531   3HD1  LEU  12          3HD1      LEU  12   2.313  -7.890   2.773
  532   1HD2  LEU  12          1HD2      LEU  12  -0.028  -4.883   1.723
  533   2HD2  LEU  12          2HD2      LEU  12  -0.952  -6.227   2.390
  534   3HD2  LEU  12          3HD2      LEU  12   0.216  -6.516   1.101
  535    H    LYS  13           H        LYS  13   3.825  -6.482   4.505
  536    HA   LYS  13           HA       LYS  13   3.649  -4.042   6.090
  537   1HB   LYS  13          2HB       LYS  13   6.086  -5.819   6.273
  538   2HB   LYS  13          1HB       LYS  13   5.786  -4.328   7.154
  539   1HG   LYS  13          2HG       LYS  13   5.329  -5.884   8.761
  540   2HG   LYS  13          1HG       LYS  13   3.723  -5.640   8.075
  541   1HD   LYS  13          2HD       LYS  13   4.064  -7.625   6.646
  542   2HD   LYS  13          1HD       LYS  13   5.634  -7.876   7.408
  543   1HE   LYS  13          2HE       LYS  13   2.961  -7.897   8.804
  544   2HE   LYS  13          1HE       LYS  13   3.926  -9.316   8.394
  545   1HZ   LYS  13          1HZ       LYS  13   4.957  -9.083  10.323
  546   2HZ   LYS  13          2HZ       LYS  13   4.114  -7.657  10.662
  547   3HZ   LYS  13          3HZ       LYS  13   5.577  -7.591   9.817
  548    H    GLY  14           H        GLY  14   4.942  -2.336   5.256
  549   1HA   GLY  14          2HA       GLY  14   6.935  -2.669   3.306
  550   2HA   GLY  14          1HA       GLY  14   5.404  -2.441   2.481
  551    H    GLU  15           H        GLU  15   6.610  -0.581   1.615
  552    HA   GLU  15           HA       GLU  15   5.964   1.796   3.156
  553   1HB   GLU  15          2HB       GLU  15   8.744   1.310   2.068
  554   2HB   GLU  15          1HB       GLU  15   8.178   2.807   2.795
  555   1HG   GLU  15          2HG       GLU  15   7.842   1.660   4.918
  556   2HG   GLU  15          1HG       GLU  15   8.391   0.149   4.193
  557    H    THR  16           H        THR  16   5.806   3.693   1.879
  558    HA   THR  16           HA       THR  16   6.149   3.488  -0.986
  559    HB   THR  16           HB       THR  16   4.007   2.614  -1.044
  560    HG1  THR  16           1HG      THR  16   3.469   5.371  -0.980
  561   1HG2  THR  16          1HG2      THR  16   3.095   2.519   1.028
  562   2HG2  THR  16          2HG2      THR  16   2.144   3.843   0.350
  563   3HG2  THR  16          3HG2      THR  16   3.509   4.189   1.406
  564    H    THR  17           H        THR  17   5.467   5.656  -2.060
  565    HA   THR  17           HA       THR  17   5.774   7.900  -0.198
  566    HB   THR  17           HB       THR  17   7.521   8.890  -1.693
  567    HG1  THR  17           1HG      THR  17   7.362   6.319  -2.844
  568   1HG2  THR  17          1HG2      THR  17   7.942   6.529   0.010
  569   2HG2  THR  17          2HG2      THR  17   8.667   8.135   0.083
  570   3HG2  THR  17          3HG2      THR  17   9.262   6.952  -1.081
  571    H    THR  18           H        THR  18   4.296   9.358  -0.587
  572    HA   THR  18           HA       THR  18   3.214   9.688  -3.317
  573    HB   THR  18           HB       THR  18   1.610   9.052  -1.507
  574    HG1  THR  18           1HG      THR  18   0.967  10.302  -3.337
  575   1HG2  THR  18          1HG2      THR  18   2.359  11.734  -0.376
  576   2HG2  THR  18          2HG2      THR  18   2.457  10.160   0.415
  577   3HG2  THR  18          3HG2      THR  18   0.884  10.861   0.040
  578    H    GLU  19           H        GLU  19   3.176  11.694  -4.265
  579    HA   GLU  19           HA       GLU  19   4.821  13.774  -3.005
  580   1HB   GLU  19          2HB       GLU  19   5.558  13.131  -5.204
  581   2HB   GLU  19          1HB       GLU  19   3.937  13.302  -5.858
  582   1HG   GLU  19          2HG       GLU  19   5.341  15.144  -6.546
  583   2HG   GLU  19          1HG       GLU  19   4.039  15.710  -5.503
  584    H    ALA  20           H        ALA  20   3.637  15.227  -1.833
  585    HA   ALA  20           HA       ALA  20   1.337  16.454  -3.135
  586   1HB   ALA  20          1HB       ALA  20   0.899  15.752  -0.301
  587   2HB   ALA  20          2HB       ALA  20   0.824  14.432  -1.467
  588   3HB   ALA  20          3HB       ALA  20  -0.240  15.825  -1.646
  589    H    VAL  21           H        VAL  21   0.854  18.495  -2.443
  590    HA   VAL  21           HA       VAL  21   2.884  20.186  -1.694
  591    HB   VAL  21           HB       VAL  21  -0.025  20.713  -1.099
  592   1HG1  VAL  21          1HG1      VAL  21   0.489  22.993  -1.204
  593   2HG1  VAL  21          2HG1      VAL  21   2.055  22.697  -1.957
  594   3HG1  VAL  21          3HG1      VAL  21   1.801  22.289  -0.261
  595   1HG2  VAL  21          1HG2      VAL  21  -0.179  20.122  -3.308
  596   2HG2  VAL  21          2HG2      VAL  21   1.475  20.617  -3.670
  597   3HG2  VAL  21          3HG2      VAL  21   0.217  21.835  -3.462
  598    H    ASP  22           H        ASP  22   0.615  18.526   0.426
  599    HA   ASP  22           HA       ASP  22   2.341  19.153   2.682
  600   1HB   ASP  22          2HB       ASP  22   0.574  20.016   4.102
  601   2HB   ASP  22          1HB       ASP  22   0.704  21.003   2.651
  602    H    ALA  23           H        ALA  23   1.442  18.048   4.750
  603    HA   ALA  23           HA       ALA  23   1.381  15.307   4.291
  604   1HB   ALA  23          1HB       ALA  23   2.140  16.018   6.394
  605   2HB   ALA  23          2HB       ALA  23   0.615  15.192   6.716
  606   3HB   ALA  23          3HB       ALA  23   0.677  16.954   6.699
  607    H    ALA  24           H        ALA  24  -1.282  17.539   4.961
  608    HA   ALA  24           HA       ALA  24  -3.299  15.574   5.121
  609   1HB   ALA  24          1HB       ALA  24  -3.986  17.624   5.944
  610   2HB   ALA  24          2HB       ALA  24  -4.781  17.591   4.372
  611   3HB   ALA  24          3HB       ALA  24  -3.298  18.520   4.590
  612    H    THR  25           H        THR  25  -2.336  17.671   2.393
  613    HA   THR  25           HA       THR  25  -4.006  16.580   0.462
  614    HB   THR  25           HB       THR  25  -2.328  17.400  -1.164
  615    HG1  THR  25           1HG      THR  25  -0.351  17.520  -0.597
  616   1HG2  THR  25          1HG2      THR  25  -2.081  19.774  -0.237
  617   2HG2  THR  25          2HG2      THR  25  -3.058  19.185   1.107
  618   3HG2  THR  25          3HG2      THR  25  -3.702  19.148  -0.535
  619    H    ALA  26           H        ALA  26  -0.754  15.650   1.494
  620    HA   ALA  26           HA       ALA  26  -0.386  13.499  -0.275
  621   1HB   ALA  26          1HB       ALA  26   1.495  13.016   0.937
  622   2HB   ALA  26          2HB       ALA  26   0.700  13.294   2.486
  623   3HB   ALA  26          3HB       ALA  26   1.217  14.663   1.502
  624    H    GLU  27           H        GLU  27  -1.546  13.545   3.106
  625    HA   GLU  27           HA       GLU  27  -2.184  10.915   3.458
  626   1HB   GLU  27          2HB       GLU  27  -2.364  12.594   5.223
  627   2HB   GLU  27          1HB       GLU  27  -3.730  13.332   4.400
  628   1HG   GLU  27          2HG       GLU  27  -5.051  11.328   4.747
  629   2HG   GLU  27          1HG       GLU  27  -3.679  10.543   5.525
  630    H    LYS  28           H        LYS  28  -4.236  13.451   2.048
  631    HA   LYS  28           HA       LYS  28  -6.450  11.816   1.478
  632   1HB   LYS  28          2HB       LYS  28  -5.492  14.318   0.069
  633   2HB   LYS  28          1HB       LYS  28  -7.077  13.586  -0.148
  634   1HG   LYS  28          2HG       LYS  28  -5.978  14.799   2.377
  635   2HG   LYS  28          1HG       LYS  28  -7.260  15.448   1.350
  636   1HD   LYS  28          2HD       LYS  28  -8.651  13.507   1.861
  637   2HD   LYS  28          1HD       LYS  28  -7.368  12.848   2.877
  638   1HE   LYS  28          2HE       LYS  28  -9.077  13.948   4.226
  639   2HE   LYS  28          1HE       LYS  28  -7.531  14.786   4.352
  640   1HZ   LYS  28          1HZ       LYS  28  -8.344  16.612   3.357
  641   2HZ   LYS  28          2HZ       LYS  28  -9.843  16.009   3.852
  642   3HZ   LYS  28          3HZ       LYS  28  -9.309  15.746   2.270
  643    H    VAL  29           H        VAL  29  -3.624  12.736  -0.449
  644    HA   VAL  29           HA       VAL  29  -4.312  11.427  -2.817
  645    HB   VAL  29           HB       VAL  29  -1.550  11.863  -1.660
  646   1HG1  VAL  29          1HG1      VAL  29  -2.507  10.855  -4.287
  647   2HG1  VAL  29          2HG1      VAL  29  -1.084  10.402  -3.348
  648   3HG1  VAL  29          3HG1      VAL  29  -1.093  11.910  -4.262
  649   1HG2  VAL  29          1HG2      VAL  29  -2.407  13.598  -3.835
  650   2HG2  VAL  29          2HG2      VAL  29  -1.659  14.003  -2.290
  651   3HG2  VAL  29          3HG2      VAL  29  -3.404  13.764  -2.390
  652    H    VAL  30           H        VAL  30  -2.726  10.266   0.105
  653    HA   VAL  30           HA       VAL  30  -2.136   7.665  -0.901
  654    HB   VAL  30           HB       VAL  30  -2.481   8.596   1.960
  655   1HG1  VAL  30          1HG1      VAL  30  -1.505   6.596   2.685
  656   2HG1  VAL  30          2HG1      VAL  30  -0.937   6.181   1.067
  657   3HG1  VAL  30          3HG1      VAL  30  -2.655   6.084   1.451
  658   1HG2  VAL  30          1HG2      VAL  30  -0.669   9.639   0.434
  659   2HG2  VAL  30          2HG2      VAL  30   0.141   8.083   0.615
  660   3HG2  VAL  30          3HG2      VAL  30  -0.213   9.064   2.037
  661    H    LYS  31           H        LYS  31  -4.720   8.960   1.223
  662    HA   LYS  31           HA       LYS  31  -6.199   6.657   1.557
  663   1HB   LYS  31          2HB       LYS  31  -6.994   9.543   1.395
  664   2HB   LYS  31          1HB       LYS  31  -8.220   8.295   1.562
  665   1HG   LYS  31          2HG       LYS  31  -7.158   7.521   3.617
  666   2HG   LYS  31          1HG       LYS  31  -5.926   8.773   3.451
  667   1HD   LYS  31          2HD       LYS  31  -7.548  10.503   3.740
  668   2HD   LYS  31          1HD       LYS  31  -8.877   9.348   3.644
  669   1HE   LYS  31          2HE       LYS  31  -8.453  10.023   5.952
  670   2HE   LYS  31          1HE       LYS  31  -8.137   8.306   5.718
  671   1HZ   LYS  31          1HZ       LYS  31  -6.369  10.358   6.581
  672   2HZ   LYS  31          2HZ       LYS  31  -5.738   9.549   5.237
  673   3HZ   LYS  31          3HZ       LYS  31  -6.163   8.679   6.622
  674    H    GLN  32           H        GLN  32  -6.197   8.921  -1.139
  675    HA   GLN  32           HA       GLN  32  -8.299   7.695  -2.596
  676   1HB   GLN  32          2HB       GLN  32  -7.436   9.974  -3.089
  677   2HB   GLN  32          1HB       GLN  32  -5.934   9.262  -3.658
  678   1HG   GLN  32          2HG       GLN  32  -7.280   9.826  -5.545
  679   2HG   GLN  32          1HG       GLN  32  -7.199   8.073  -5.410
  680   1HE2  GLN  32          1HE2      GLN  32  -9.234   9.316  -3.034
  681   2HE2  GLN  32          2HE2      GLN  32 -10.737   9.077  -3.844
  682    H    PHE  33           H        PHE  33  -4.847   7.193  -2.385
  683    HA   PHE  33           HA       PHE  33  -4.401   5.446  -4.496
  684   1HB   PHE  33          2HB       PHE  33  -2.677   6.476  -2.969
  685   2HB   PHE  33          1HB       PHE  33  -3.127   5.289  -1.752
  686    HD1  PHE  33           1HD      PHE  33  -2.015   5.489  -5.290
  687    HD2  PHE  33           2HD      PHE  33  -1.921   3.322  -1.615
  688    HE1  PHE  33           1HE      PHE  33  -0.414   3.890  -6.258
  689    HE2  PHE  33           2HE      PHE  33  -0.317   1.735  -2.597
  690    HZ   PHE  33           HZ       PHE  33   0.431   2.030  -4.928
  691    H    PHE  34           H        PHE  34  -4.989   4.581  -1.112
  692    HA   PHE  34           HA       PHE  34  -5.466   1.823  -1.655
  693   1HB   PHE  34          2HB       PHE  34  -6.108   3.456   0.802
  694   2HB   PHE  34          1HB       PHE  34  -6.128   1.692   0.708
  695    HD1  PHE  34           1HD      PHE  34  -3.830   0.959  -0.746
  696    HD2  PHE  34           2HD      PHE  34  -4.275   4.145   2.033
  697    HE1  PHE  34           1HE      PHE  34  -1.411   0.920  -0.323
  698    HE2  PHE  34           2HE      PHE  34  -1.855   4.105   2.471
  699    HZ   PHE  34           HZ       PHE  34  -0.428   2.492   1.281
  700    H    ASN  35           H        ASN  35  -7.556   4.601  -1.132
  701    HA   ASN  35           HA       ASN  35 -10.037   3.396  -0.979
  702   1HB   ASN  35          2HB       ASN  35  -9.678   5.819  -0.766
  703   2HB   ASN  35          1HB       ASN  35  -9.276   5.917  -2.476
  704   1HD2  ASN  35          1HD2      ASN  35 -11.513   6.800  -0.500
  705   2HD2  ASN  35          2HD2      ASN  35 -12.947   6.560  -1.434
  706    H    ASP  36           H        ASP  36  -8.022   4.053  -3.744
  707    HA   ASP  36           HA       ASP  36  -9.961   2.879  -5.583
  708   1HB   ASP  36          2HB       ASP  36  -7.330   4.274  -6.099
  709   2HB   ASP  36          1HB       ASP  36  -8.375   3.626  -7.359
  710    H    ASN  37           H        ASN  37  -7.002   1.992  -3.974
  711    HA   ASN  37           HA       ASN  37  -6.400  -0.139  -5.841
  712   1HB   ASN  37          2HB       ASN  37  -5.270   0.508  -3.109
  713   2HB   ASN  37          1HB       ASN  37  -4.723  -0.839  -4.100
  714   1HD2  ASN  37          1HD2      ASN  37  -3.519   1.783  -3.093
  715   2HD2  ASN  37          2HD2      ASN  37  -2.789   2.451  -4.512
  716    H    GLY  38           H        GLY  38  -7.660   0.171  -2.573
  717   1HA   GLY  38          2HA       GLY  38  -8.137  -1.893  -1.280
  718   2HA   GLY  38          1HA       GLY  38  -9.581  -1.117  -1.891
  719    H    VAL  39           H        VAL  39 -10.987  -2.399  -2.805
  720    HA   VAL  39           HA       VAL  39 -10.126  -5.083  -3.596
  721    HB   VAL  39           HB       VAL  39 -12.914  -4.072  -3.120
  722   1HG1  VAL  39          1HG1      VAL  39 -13.172  -6.627  -2.636
  723   2HG1  VAL  39          2HG1      VAL  39 -11.732  -6.763  -3.642
  724   3HG1  VAL  39          3HG1      VAL  39 -13.199  -6.032  -4.295
  725   1HG2  VAL  39          1HG2      VAL  39 -12.718  -5.187  -0.915
  726   2HG2  VAL  39          2HG2      VAL  39 -11.650  -3.796  -1.094
  727   3HG2  VAL  39          3HG2      VAL  39 -10.999  -5.429  -1.230
  728    H    ASP  40           H        ASP  40 -10.758  -2.259  -5.335
  729    HA   ASP  40           HA       ASP  40 -11.752  -3.889  -7.573
  730   1HB   ASP  40          2HB       ASP  40 -12.458  -1.016  -6.949
  731   2HB   ASP  40          1HB       ASP  40 -12.950  -1.889  -8.396
  732    H    GLY  41           H        GLY  41  -8.998  -2.809  -6.626
  733   1HA   GLY  41          2HA       GLY  41  -8.228  -1.009  -8.735
  734   2HA   GLY  41          1HA       GLY  41  -7.160  -1.757  -7.561
  735    H    GLU  42           H        GLU  42  -6.304  -1.492 -10.110
  736    HA   GLU  42           HA       GLU  42  -6.707  -4.064 -11.451
  737   1HB   GLU  42          2HB       GLU  42  -5.152  -1.624 -12.341
  738   2HB   GLU  42          1HB       GLU  42  -5.418  -3.070 -13.303
  739   1HG   GLU  42          2HG       GLU  42  -6.957  -1.493 -14.092
  740   2HG   GLU  42          1HG       GLU  42  -7.891  -2.601 -13.089
  741    H    TRP  43           H        TRP  43  -5.542  -5.574 -10.357
  742    HA   TRP  43           HA       TRP  43  -2.789  -4.955  -9.597
  743   1HB   TRP  43          2HB       TRP  43  -4.542  -7.317  -8.925
  744   2HB   TRP  43          1HB       TRP  43  -2.919  -7.051  -8.306
  745    HD1  TRP  43           HD       TRP  43  -5.367  -4.100  -8.452
  746    HE1  TRP  43           1HE      TRP  43  -5.978  -3.451  -6.022
  747    HE3  TRP  43           3HE      TRP  43  -3.144  -7.975  -5.978
  748    HZ2  TRP  43           2HZ      TRP  43  -5.573  -4.448  -3.431
  749    HZ3  TRP  43           3HZ      TRP  43  -3.298  -8.054  -3.532
  750    HH2  TRP  43           HH       TRP  43  -4.488  -6.327  -2.280
  751    H    THR  44           H        THR  44  -1.121  -5.604 -10.760
  752    HA   THR  44           HA       THR  44  -1.462  -7.869 -12.611
  753    HB   THR  44           HB       THR  44   0.489  -6.911 -13.832
  754    HG1  THR  44           1HG      THR  44   0.137  -4.672 -12.136
  755   1HG2  THR  44          1HG2      THR  44  -2.049  -6.156 -14.124
  756   2HG2  THR  44          2HG2      THR  44  -0.727  -5.490 -15.085
  757   3HG2  THR  44          3HG2      THR  44  -1.337  -4.602 -13.689
  758    H    TYR  45           H        TYR  45  -0.129  -9.624 -12.395
  759    HA   TYR  45           HA       TYR  45   1.697  -9.567 -10.093
  760   1HB   TYR  45          2HB       TYR  45  -0.108 -11.211  -9.961
  761   2HB   TYR  45          1HB       TYR  45   0.406 -11.917 -11.490
  762    HD1  TYR  45           1HD      TYR  45   2.286 -10.876  -8.434
  763    HD2  TYR  45           2HD      TYR  45   1.263 -14.026 -11.102
  764    HE1  TYR  45           1HE      TYR  45   3.801 -12.386  -7.221
  765    HE2  TYR  45           2HE      TYR  45   2.770 -15.547  -9.894
  766    HH   TYR  45           HH       TYR  45   3.728 -15.658  -7.479
  767    H    ASP  46           H        ASP  46   3.791 -10.316 -10.207
  768    HA   ASP  46           HA       ASP  46   4.832 -10.873 -12.907
  769   1HB   ASP  46          2HB       ASP  46   5.497  -8.624 -12.193
  770   2HB   ASP  46          1HB       ASP  46   6.173  -9.283 -10.706
  771    H    ASP  47           H        ASP  47   4.555 -13.108 -12.383
  772    HA   ASP  47           HA       ASP  47   5.471 -14.530 -10.245
  773   1HB   ASP  47          2HB       ASP  47   5.669 -15.364 -13.145
  774   2HB   ASP  47          1HB       ASP  47   5.728 -16.452 -11.762
  775    H    ALA  48           H        ALA  48   7.399 -13.283 -12.912
  776    HA   ALA  48           HA       ALA  48   9.758 -14.637 -12.613
  777   1HB   ALA  48          1HB       ALA  48  10.639 -13.111 -14.010
  778   2HB   ALA  48          2HB       ALA  48  10.073 -11.745 -13.049
  779   3HB   ALA  48          3HB       ALA  48   8.963 -12.574 -14.142
  780    H    THR  49           H        THR  49   8.542 -12.043 -10.571
  781    HA   THR  49           HA       THR  49  10.856 -12.487  -8.804
  782    HB   THR  49           HB       THR  49  10.769 -10.095  -8.180
  783    HG1  THR  49           1HG      THR  49   9.189  -8.909  -8.836
  784   1HG2  THR  49          1HG2      THR  49  11.414 -10.964 -10.925
  785   2HG2  THR  49          2HG2      THR  49  12.431 -10.209  -9.698
  786   3HG2  THR  49          3HG2      THR  49  11.307  -9.227 -10.635
  787    H    LYS  50           H        LYS  50   7.856 -13.318  -8.926
  788    HA   LYS  50           HA       LYS  50   6.137 -13.652  -7.449
  789   1HB   LYS  50          2HB       LYS  50   8.423 -13.357  -5.488
  790   2HB   LYS  50          1HB       LYS  50   6.824 -13.951  -5.066
  791   1HG   LYS  50          2HG       LYS  50   8.662 -15.246  -7.068
  792   2HG   LYS  50          1HG       LYS  50   8.487 -15.744  -5.384
  793   1HD   LYS  50          2HD       LYS  50   6.091 -16.166  -5.789
  794   2HD   LYS  50          1HD       LYS  50   6.321 -15.738  -7.486
  795   1HE   LYS  50          2HE       LYS  50   7.652 -18.015  -6.020
  796   2HE   LYS  50          1HE       LYS  50   6.339 -18.155  -7.190
  797   1HZ   LYS  50          1HZ       LYS  50   8.106 -16.824  -8.639
  798   2HZ   LYS  50          2HZ       LYS  50   8.062 -18.513  -8.579
  799   3HZ   LYS  50          3HZ       LYS  50   9.174 -17.664  -7.630
  800    H    THR  51           H        THR  51   6.673 -10.933  -8.308
  801    HA   THR  51           HA       THR  51   5.860  -9.384  -5.952
  802    HB   THR  51           HB       THR  51   6.973  -8.477  -8.610
  803    HG1  THR  51           1HG      THR  51   8.122  -8.346  -6.026
  804   1HG2  THR  51          1HG2      THR  51   5.468  -6.787  -7.682
  805   2HG2  THR  51          2HG2      THR  51   7.152  -6.267  -7.662
  806   3HG2  THR  51          3HG2      THR  51   6.381  -6.818  -6.175
  807    H    PHE  52           H        PHE  52   4.102  -7.913  -6.091
  808    HA   PHE  52           HA       PHE  52   2.238  -8.460  -8.308
  809   1HB   PHE  52          2HB       PHE  52   1.479  -8.010  -5.425
  810   2HB   PHE  52          1HB       PHE  52   0.371  -8.274  -6.763
  811    HD1  PHE  52           1HD      PHE  52  -0.359 -10.414  -7.245
  812    HD2  PHE  52           2HD      PHE  52   3.181  -9.890  -4.944
  813    HE1  PHE  52           1HE      PHE  52  -0.279 -12.836  -6.822
  814    HE2  PHE  52           2HE      PHE  52   3.268 -12.310  -4.521
  815    HZ   PHE  52           HZ       PHE  52   1.538 -13.785  -5.460
  816    H    THR  53           H        THR  53   2.629  -6.661  -9.423
  817    HA   THR  53           HA       THR  53   2.731  -4.058  -8.228
  818    HB   THR  53           HB       THR  53   2.481  -3.318 -10.716
  819    HG1  THR  53           1HG      THR  53   3.345  -5.968 -11.130
  820   1HG2  THR  53          1HG2      THR  53   4.839  -4.647  -9.472
  821   2HG2  THR  53          2HG2      THR  53   4.559  -2.937  -9.823
  822   3HG2  THR  53          3HG2      THR  53   4.909  -4.066 -11.137
  823    H    VAL  54           H        VAL  54   1.177  -2.756  -7.712
  824    HA   VAL  54           HA       VAL  54  -1.540  -3.275  -8.723
  825    HB   VAL  54           HB       VAL  54  -0.720  -1.821  -6.191
  826   1HG1  VAL  54          1HG1      VAL  54  -2.741  -0.865  -6.516
  827   2HG1  VAL  54          2HG1      VAL  54  -3.335  -2.397  -5.874
  828   3HG1  VAL  54          3HG1      VAL  54  -3.284  -2.132  -7.616
  829   1HG2  VAL  54          1HG2      VAL  54  -1.003  -3.721  -5.009
  830   2HG2  VAL  54          2HG2      VAL  54  -0.608  -4.487  -6.547
  831   3HG2  VAL  54          3HG2      VAL  54  -2.293  -4.311  -6.058
  832    H    THR  55           H        THR  55  -1.628  -2.033 -10.517
  833    HA   THR  55           HA       THR  55  -0.620   0.690 -10.421
  834    HB   THR  55           HB       THR  55  -1.943  -0.585 -12.800
  835    HG1  THR  55           1HG      THR  55   0.716  -0.876 -11.867
  836   1HG2  THR  55          1HG2      THR  55  -1.442   1.796 -12.979
  837   2HG2  THR  55          2HG2      THR  55  -0.433   0.838 -14.064
  838   3HG2  THR  55          3HG2      THR  55   0.242   1.472 -12.559
  839    H    GLU  56           H        GLU  56  -1.848   2.289  -9.767
  840    HA   GLU  56           HA       GLU  56  -4.532   2.194  -9.153
  841   1HB   GLU  56          2HB       GLU  56  -2.944   3.951  -8.415
  842   2HB   GLU  56          1HB       GLU  56  -2.965   4.626 -10.037
  843   1HG   GLU  56          2HG       GLU  56  -5.363   4.412  -8.230
  844   2HG   GLU  56          1HG       GLU  56  -4.381   5.859  -8.447
  Start of MODEL   39
    1   1H    MET   1          1HT       MET   1   7.188 -18.245   3.435
    2   2H    MET   1          2HT       MET   1   6.618 -19.517   2.478
    3   3H    MET   1          3HT       MET   1   5.608 -18.206   2.830
    4    HA   MET   1           HA       MET   1   8.140 -17.916   1.331
    5   1HB   MET   1          2HB       MET   1   6.291 -19.488   0.362
    6   2HB   MET   1          1HB       MET   1   5.415 -17.997   0.063
    7   1HG   MET   1          2HG       MET   1   8.157 -18.635  -0.998
    8   2HG   MET   1          1HG       MET   1   6.653 -18.797  -1.901
    9   1HE   MET   1          1HE       MET   1   8.020 -15.896  -3.806
   10   2HE   MET   1          2HE       MET   1   8.108 -17.641  -3.562
   11   3HE   MET   1          3HE       MET   1   9.328 -16.588  -2.845
   12    H    GLN   2           H        GLN   2   8.578 -15.826   0.840
   13    HA   GLN   2           HA       GLN   2   6.652 -13.802   1.736
   14   1HB   GLN   2          2HB       GLN   2   8.833 -13.734   2.851
   15   2HB   GLN   2          1HB       GLN   2   9.634 -13.584   1.293
   16   1HG   GLN   2          2HG       GLN   2   8.535 -11.431   0.933
   17   2HG   GLN   2          1HG       GLN   2   7.736 -11.582   2.499
   18   1HE2  GLN   2          1HE2      GLN   2   8.649 -10.413   4.012
   19   2HE2  GLN   2          2HE2      GLN   2  10.334 -10.058   4.157
   20    H    TYR   3           H        TYR   3   5.922 -12.236   0.396
   21    HA   TYR   3           HA       TYR   3   6.873 -12.318  -2.393
   22   1HB   TYR   3          2HB       TYR   3   4.049 -11.844  -1.413
   23   2HB   TYR   3          1HB       TYR   3   4.571 -11.746  -3.092
   24    HD1  TYR   3           1HD      TYR   3   4.324 -13.614  -4.433
   25    HD2  TYR   3           2HD      TYR   3   4.589 -14.134  -0.221
   26    HE1  TYR   3           1HE      TYR   3   3.892 -16.017  -4.708
   27    HE2  TYR   3           2HE      TYR   3   4.166 -16.539  -0.487
   28    HH   TYR   3           HH       TYR   3   4.317 -18.265  -2.154
   29    H    LYS   4           H        LYS   4   6.952 -10.360  -3.526
   30    HA   LYS   4           HA       LYS   4   6.948  -7.987  -1.779
   31   1HB   LYS   4          2HB       LYS   4   9.135  -8.576  -2.772
   32   2HB   LYS   4          1HB       LYS   4   8.434  -8.425  -4.377
   33   1HG   LYS   4          2HG       LYS   4   8.006  -6.062  -3.987
   34   2HG   LYS   4          1HG       LYS   4   8.667  -6.205  -2.357
   35   1HD   LYS   4          2HD       LYS   4  10.834  -6.868  -3.313
   36   2HD   LYS   4          1HD       LYS   4  10.166  -6.675  -4.935
   37   1HE   LYS   4          2HE       LYS   4  11.457  -4.713  -4.296
   38   2HE   LYS   4          1HE       LYS   4   9.751  -4.306  -4.480
   39   1HZ   LYS   4          1HZ       LYS   4  11.153  -4.797  -1.907
   40   2HZ   LYS   4          2HZ       LYS   4   9.510  -4.432  -2.070
   41   3HZ   LYS   4          3HZ       LYS   4  10.677  -3.287  -2.505
   42    H    VAL   5           H        VAL   5   5.027  -7.014  -1.986
   43    HA   VAL   5           HA       VAL   5   3.762  -6.889  -4.610
   44    HB   VAL   5           HB       VAL   5   2.706  -6.021  -1.915
   45   1HG1  VAL   5          1HG1      VAL   5   1.586  -4.740  -3.566
   46   2HG1  VAL   5          2HG1      VAL   5   0.498  -6.061  -3.142
   47   3HG1  VAL   5          3HG1      VAL   5   1.429  -6.131  -4.638
   48   1HG2  VAL   5          1HG2      VAL   5   2.540  -8.239  -1.617
   49   2HG2  VAL   5          2HG2      VAL   5   2.755  -8.587  -3.333
   50   3HG2  VAL   5          3HG2      VAL   5   1.170  -8.113  -2.720
   51    H    ILE   6           H        ILE   6   4.015  -5.252  -5.871
   52    HA   ILE   6           HA       ILE   6   5.061  -2.719  -4.853
   53    HB   ILE   6           HB       ILE   6   4.801  -3.782  -7.669
   54   1HG1  ILE   6          2HG1      ILE   6   7.215  -3.242  -5.927
   55   2HG1  ILE   6          1HG1      ILE   6   6.565  -4.829  -6.322
   56   1HG2  ILE   6          1HG2      ILE   6   6.471  -1.634  -7.844
   57   2HG2  ILE   6          2HG2      ILE   6   5.273  -1.068  -6.679
   58   3HG2  ILE   6          3HG2      ILE   6   4.760  -1.626  -8.272
   59   1HD1  ILE   6          1HD1      ILE   6   8.492  -4.384  -7.678
   60   2HD1  ILE   6          2HD1      ILE   6   7.798  -2.861  -8.233
   61   3HD1  ILE   6          3HD1      ILE   6   7.055  -4.391  -8.701
   62    H    LEU   7           H        LEU   7   3.819  -0.996  -4.613
   63    HA   LEU   7           HA       LEU   7   1.122  -1.014  -5.786
   64   1HB   LEU   7          2HB       LEU   7   2.102   0.795  -3.583
   65   2HB   LEU   7          1HB       LEU   7   0.444   0.405  -4.009
   66    HG   LEU   7           HG       LEU   7   2.427  -1.472  -2.737
   67   1HD1  LEU   7          1HD1      LEU   7   1.237  -1.219  -0.746
   68   2HD1  LEU   7          2HD1      LEU   7  -0.136  -0.457  -1.554
   69   3HD1  LEU   7          3HD1      LEU   7   1.381   0.423  -1.370
   70   1HD2  LEU   7          1HD2      LEU   7  -0.494  -1.985  -3.214
   71   2HD2  LEU   7          2HD2      LEU   7   0.769  -3.130  -2.755
   72   3HD2  LEU   7          3HD2      LEU   7   0.741  -2.451  -4.381
   73    H    ASN   8           H        ASN   8   1.564  -0.180  -7.827
   74    HA   ASN   8           HA       ASN   8   3.012   2.353  -7.992
   75   1HB   ASN   8          2HB       ASN   8   3.624   0.405  -9.450
   76   2HB   ASN   8          1HB       ASN   8   2.060   0.576 -10.238
   77   1HD2  ASN   8          1HD2      ASN   8   5.132   1.113 -10.743
   78   2HD2  ASN   8          2HD2      ASN   8   5.082   2.570 -11.672
   79    H    GLY   9           H        GLY   9   1.774   4.124  -7.768
   80   1HA   GLY   9          2HA       GLY   9  -0.810   4.153  -9.198
   81   2HA   GLY   9          1HA       GLY   9  -0.536   5.007  -7.690
   82    H    LYS  10           H        LYS  10  -1.408   6.799  -9.011
   83    HA   LYS  10           HA       LYS  10   0.290   7.895 -11.054
   84   1HB   LYS  10          2HB       LYS  10  -2.234   8.821  -9.710
   85   2HB   LYS  10          1HB       LYS  10  -1.345   9.879 -10.789
   86   1HG   LYS  10          2HG       LYS  10  -2.396   7.171 -11.563
   87   2HG   LYS  10          1HG       LYS  10  -3.236   8.689 -11.861
   88   1HD   LYS  10          2HD       LYS  10  -0.451   8.136 -12.857
   89   2HD   LYS  10          1HD       LYS  10  -1.896   7.735 -13.788
   90   1HE   LYS  10          2HE       LYS  10  -1.197   9.843 -14.569
   91   2HE   LYS  10          1HE       LYS  10  -2.576  10.151 -13.518
   92   1HZ   LYS  10          1HZ       LYS  10  -1.325  11.305 -12.092
   93   2HZ   LYS  10          2HZ       LYS  10  -0.211  11.419 -13.361
   94   3HZ   LYS  10          3HZ       LYS  10  -0.024  10.226 -12.177
   95    H    THR  11           H        THR  11  -0.780   9.057  -7.857
   96    HA   THR  11           HA       THR  11   1.541  10.831  -7.752
   97    HB   THR  11           HB       THR  11   0.194  11.749  -5.748
   98    HG1  THR  11           1HG      THR  11  -1.236   9.894  -5.744
   99   1HG2  THR  11          1HG2      THR  11   0.309  13.045  -7.759
  100   2HG2  THR  11          2HG2      THR  11  -1.358  13.028  -7.182
  101   3HG2  THR  11          3HG2      THR  11  -0.885  12.008  -8.540
  102    H    LEU  12           H        LEU  12   0.869   7.780  -6.867
  103    HA   LEU  12           HA       LEU  12   2.620   7.981  -4.537
  104   1HB   LEU  12          2HB       LEU  12   0.349   7.829  -3.679
  105   2HB   LEU  12          1HB       LEU  12   0.065   6.387  -4.635
  106    HG   LEU  12           HG       LEU  12   1.606   5.120  -3.314
  107   1HD1  LEU  12          1HD1      LEU  12   3.381   6.165  -2.494
  108   2HD1  LEU  12          2HD1      LEU  12   2.342   6.764  -1.200
  109   3HD1  LEU  12          3HD1      LEU  12   2.606   7.736  -2.644
  110   1HD2  LEU  12          1HD2      LEU  12   0.124   4.796  -1.687
  111   2HD2  LEU  12          2HD2      LEU  12  -0.761   6.169  -2.351
  112   3HD2  LEU  12          3HD2      LEU  12   0.380   6.411  -1.028
  113    H    LYS  13           H        LYS  13   4.086   6.418  -4.316
  114    HA   LYS  13           HA       LYS  13   3.916   3.989  -5.921
  115   1HB   LYS  13          2HB       LYS  13   6.248   5.910  -6.086
  116   2HB   LYS  13          1HB       LYS  13   6.212   4.302  -6.795
  117   1HG   LYS  13          2HG       LYS  13   4.395   4.966  -8.263
  118   2HG   LYS  13          1HG       LYS  13   4.366   6.568  -7.526
  119   1HD   LYS  13          2HD       LYS  13   6.697   5.363  -9.019
  120   2HD   LYS  13          1HD       LYS  13   5.575   6.562  -9.664
  121   1HE   LYS  13          2HE       LYS  13   6.267   8.130  -7.902
  122   2HE   LYS  13          1HE       LYS  13   7.411   6.932  -7.297
  123   1HZ   LYS  13          1HZ       LYS  13   7.480   8.061 -10.042
  124   2HZ   LYS  13          2HZ       LYS  13   8.636   7.054  -9.328
  125   3HZ   LYS  13          3HZ       LYS  13   8.421   8.630  -8.755
  126    H    GLY  14           H        GLY  14   5.059   2.256  -5.015
  127   1HA   GLY  14          2HA       GLY  14   7.022   2.574  -2.998
  128   2HA   GLY  14          1HA       GLY  14   5.454   2.309  -2.254
  129    H    GLU  15           H        GLU  15   6.919   0.485  -1.457
  130    HA   GLU  15           HA       GLU  15   6.270  -1.877  -3.046
  131   1HB   GLU  15          2HB       GLU  15   8.997  -1.453  -1.808
  132   2HB   GLU  15          1HB       GLU  15   8.464  -2.868  -2.700
  133   1HG   GLU  15          2HG       GLU  15   9.619  -1.826  -4.342
  134   2HG   GLU  15          1HG       GLU  15   8.048  -1.066  -4.591
  135    H    THR  16           H        THR  16   5.582  -3.554  -1.850
  136    HA   THR  16           HA       THR  16   5.991  -3.479   1.048
  137    HB   THR  16           HB       THR  16   3.866  -2.580   1.022
  138    HG1  THR  16           1HG      THR  16   3.275  -5.321   0.882
  139   1HG2  THR  16          1HG2      THR  16   3.113  -4.378  -1.262
  140   2HG2  THR  16          2HG2      THR  16   3.426  -2.647  -1.360
  141   3HG2  THR  16          3HG2      THR  16   2.040  -3.245  -0.447
  142    H    THR  17           H        THR  17   5.294  -5.610   2.092
  143    HA   THR  17           HA       THR  17   5.556  -7.872   0.258
  144    HB   THR  17           HB       THR  17   7.309  -8.881   1.722
  145    HG1  THR  17           1HG      THR  17   7.028  -7.649   3.575
  146   1HG2  THR  17          1HG2      THR  17   9.165  -7.274   1.044
  147   2HG2  THR  17          2HG2      THR  17   7.893  -6.336   0.263
  148   3HG2  THR  17          3HG2      THR  17   8.196  -7.999  -0.239
  149    H    THR  18           H        THR  18   4.046  -9.288   0.680
  150    HA   THR  18           HA       THR  18   3.017  -9.597   3.437
  151    HB   THR  18           HB       THR  18   1.355  -8.937   1.712
  152    HG1  THR  18           1HG      THR  18   0.765 -10.287   3.493
  153   1HG2  THR  18          1HG2      THR  18   2.145  -9.933  -0.286
  154   2HG2  THR  18          2HG2      THR  18   0.604 -10.697   0.108
  155   3HG2  THR  18          3HG2      THR  18   2.117 -11.544   0.432
  156    H    GLU  19           H        GLU  19   2.900 -11.654   4.344
  157    HA   GLU  19           HA       GLU  19   4.522 -13.722   3.010
  158   1HB   GLU  19          2HB       GLU  19   5.285 -13.013   5.238
  159   2HB   GLU  19          1HB       GLU  19   3.715 -13.420   5.916
  160   1HG   GLU  19          2HG       GLU  19   5.233 -15.169   6.451
  161   2HG   GLU  19          1HG       GLU  19   4.100 -15.779   5.244
  162    H    ALA  20           H        ALA  20   3.333 -15.244   1.954
  163    HA   ALA  20           HA       ALA  20   1.048 -16.403   3.335
  164   1HB   ALA  20          1HB       ALA  20   0.684 -15.506   0.499
  165   2HB   ALA  20          2HB       ALA  20   0.294 -14.461   1.864
  166   3HB   ALA  20          3HB       ALA  20  -0.538 -16.003   1.670
  167    H    VAL  21           H        VAL  21   0.404 -18.414   2.582
  168    HA   VAL  21           HA       VAL  21   2.358 -20.219   1.907
  169    HB   VAL  21           HB       VAL  21  -0.553 -20.568   1.197
  170   1HG1  VAL  21          1HG1      VAL  21   1.037 -22.805   2.249
  171   2HG1  VAL  21          2HG1      VAL  21   1.503 -22.232   0.647
  172   3HG1  VAL  21          3HG1      VAL  21  -0.151 -22.766   0.947
  173   1HG2  VAL  21          1HG2      VAL  21  -0.734 -19.958   3.404
  174   2HG2  VAL  21          2HG2      VAL  21   0.854 -20.600   3.827
  175   3HG2  VAL  21          3HG2      VAL  21  -0.498 -21.700   3.555
  176    H    ASP  22           H        ASP  22   0.270 -18.430  -0.291
  177    HA   ASP  22           HA       ASP  22   2.046 -19.150  -2.483
  178   1HB   ASP  22          2HB       ASP  22   0.289 -19.905  -3.975
  179   2HB   ASP  22          1HB       ASP  22   0.301 -20.899  -2.522
  180    H    ALA  23           H        ALA  23   1.316 -17.983  -4.575
  181    HA   ALA  23           HA       ALA  23   1.388 -15.241  -4.099
  182   1HB   ALA  23          1HB       ALA  23   1.932 -15.245  -6.248
  183   2HB   ALA  23          2HB       ALA  23   0.287 -15.708  -6.683
  184   3HB   ALA  23          3HB       ALA  23   1.491 -16.949  -6.347
  185    H    ALA  24           H        ALA  24  -1.347 -17.330  -4.906
  186    HA   ALA  24           HA       ALA  24  -3.262 -15.276  -5.170
  187   1HB   ALA  24          1HB       ALA  24  -4.768 -17.351  -4.312
  188   2HB   ALA  24          2HB       ALA  24  -3.321 -18.208  -4.837
  189   3HB   ALA  24          3HB       ALA  24  -4.195 -17.177  -5.970
  190    H    THR  25           H        THR  25  -2.565 -17.424  -2.406
  191    HA   THR  25           HA       THR  25  -4.255 -16.260  -0.557
  192    HB   THR  25           HB       THR  25  -2.589 -17.096   1.145
  193    HG1  THR  25           1HG      THR  25  -0.724 -16.794  -0.156
  194   1HG2  THR  25          1HG2      THR  25  -2.558 -19.530  -0.004
  195   2HG2  THR  25          2HG2      THR  25  -3.857 -18.753  -0.911
  196   3HG2  THR  25          3HG2      THR  25  -3.944 -18.850   0.848
  197    H    ALA  26           H        ALA  26  -0.942 -15.407  -1.460
  198    HA   ALA  26           HA       ALA  26  -0.604 -13.280   0.348
  199   1HB   ALA  26          1HB       ALA  26   0.851 -14.426  -1.809
  200   2HB   ALA  26          2HB       ALA  26   1.425 -13.309  -0.571
  201   3HB   ALA  26          3HB       ALA  26   0.760 -12.686  -2.080
  202    H    GLU  27           H        GLU  27  -1.676 -13.321  -3.062
  203    HA   GLU  27           HA       GLU  27  -2.172 -10.651  -3.431
  204   1HB   GLU  27          2HB       GLU  27  -2.316 -12.319  -5.214
  205   2HB   GLU  27          1HB       GLU  27  -3.768 -12.989  -4.482
  206   1HG   GLU  27          2HG       GLU  27  -4.946 -10.891  -4.877
  207   2HG   GLU  27          1HG       GLU  27  -3.489 -10.209  -5.602
  208    H    LYS  28           H        LYS  28  -4.426 -13.113  -2.171
  209    HA   LYS  28           HA       LYS  28  -6.553 -11.310  -1.715
  210   1HB   LYS  28          2HB       LYS  28  -5.895 -14.067  -0.731
  211   2HB   LYS  28          1HB       LYS  28  -7.259 -13.188  -0.049
  212   1HG   LYS  28          2HG       LYS  28  -7.708 -14.782  -1.995
  213   2HG   LYS  28          1HG       LYS  28  -8.416 -13.169  -2.070
  214   1HD   LYS  28          2HD       LYS  28  -6.610 -12.426  -3.530
  215   2HD   LYS  28          1HD       LYS  28  -5.865 -14.024  -3.435
  216   1HE   LYS  28          2HE       LYS  28  -7.123 -13.757  -5.511
  217   2HE   LYS  28          1HE       LYS  28  -7.826 -15.015  -4.494
  218   1HZ   LYS  28          1HZ       LYS  28  -9.485 -13.409  -3.744
  219   2HZ   LYS  28          2HZ       LYS  28  -9.541 -13.614  -5.421
  220   3HZ   LYS  28          3HZ       LYS  28  -8.825 -12.232  -4.764
  221    H    VAL  29           H        VAL  29  -3.981 -12.546   0.411
  222    HA   VAL  29           HA       VAL  29  -4.803 -11.315   2.770
  223    HB   VAL  29           HB       VAL  29  -1.974 -11.789   1.801
  224   1HG1  VAL  29          1HG1      VAL  29  -1.402 -11.734   4.227
  225   2HG1  VAL  29          2HG1      VAL  29  -3.029 -11.127   4.543
  226   3HG1  VAL  29          3HG1      VAL  29  -1.910 -10.177   3.569
  227   1HG2  VAL  29          1HG2      VAL  29  -3.094 -13.509   3.891
  228   2HG2  VAL  29          2HG2      VAL  29  -2.150 -13.926   2.462
  229   3HG2  VAL  29          3HG2      VAL  29  -3.887 -13.660   2.325
  230    H    VAL  30           H        VAL  30  -2.935 -10.086   0.052
  231    HA   VAL  30           HA       VAL  30  -2.371  -7.538   1.170
  232    HB   VAL  30           HB       VAL  30  -2.681  -8.172  -1.769
  233   1HG1  VAL  30          1HG1      VAL  30  -2.440  -5.759  -0.789
  234   2HG1  VAL  30          2HG1      VAL  30  -1.504  -6.236  -2.205
  235   3HG1  VAL  30          3HG1      VAL  30  -0.746  -6.214  -0.614
  236   1HG2  VAL  30          1HG2      VAL  30  -0.924  -9.413  -0.003
  237   2HG2  VAL  30          2HG2      VAL  30   0.043  -8.168  -0.796
  238   3HG2  VAL  30          3HG2      VAL  30  -0.806  -9.374  -1.762
  239    H    LYS  31           H        LYS  31  -4.944  -8.756  -1.002
  240    HA   LYS  31           HA       LYS  31  -6.370  -6.461  -1.465
  241   1HB   LYS  31          2HB       LYS  31  -7.438  -9.216  -0.848
  242   2HB   LYS  31          1HB       LYS  31  -8.432  -7.892  -1.432
  243   1HG   LYS  31          2HG       LYS  31  -7.132  -7.802  -3.480
  244   2HG   LYS  31          1HG       LYS  31  -6.108  -9.113  -2.895
  245   1HD   LYS  31          2HD       LYS  31  -7.652 -10.184  -4.287
  246   2HD   LYS  31          1HD       LYS  31  -8.286 -10.447  -2.658
  247   1HE   LYS  31          2HE       LYS  31  -9.185  -8.202  -4.455
  248   2HE   LYS  31          1HE       LYS  31  -9.986  -9.770  -4.387
  249   1HZ   LYS  31          1HZ       LYS  31  -9.903  -9.120  -1.801
  250   2HZ   LYS  31          2HZ       LYS  31 -11.205  -8.757  -2.818
  251   3HZ   LYS  31          3HZ       LYS  31 -10.036  -7.580  -2.491
  252    H    GLN  32           H        GLN  32  -6.628  -8.637   1.292
  253    HA   GLN  32           HA       GLN  32  -8.590  -7.250   2.722
  254   1HB   GLN  32          2HB       GLN  32  -7.564  -9.594   3.108
  255   2HB   GLN  32          1HB       GLN  32  -6.341  -8.748   4.044
  256   1HG   GLN  32          2HG       GLN  32  -7.909  -8.021   5.633
  257   2HG   GLN  32          1HG       GLN  32  -9.273  -8.451   4.598
  258   1HE2  GLN  32          1HE2      GLN  32  -9.924 -10.563   4.448
  259   2HE2  GLN  32          2HE2      GLN  32  -9.375 -11.796   5.528
  260    H    PHE  33           H        PHE  33  -5.112  -6.894   2.549
  261    HA   PHE  33           HA       PHE  33  -4.609  -5.143   4.641
  262   1HB   PHE  33          2HB       PHE  33  -2.938  -6.255   3.094
  263   2HB   PHE  33          1HB       PHE  33  -3.335  -5.032   1.895
  264    HD1  PHE  33           1HD      PHE  33  -2.190  -5.342   5.417
  265    HD2  PHE  33           2HD      PHE  33  -2.058  -3.120   1.780
  266    HE1  PHE  33           1HE      PHE  33  -0.487  -3.850   6.380
  267    HE2  PHE  33           2HE      PHE  33  -0.354  -1.634   2.751
  268    HZ   PHE  33           HZ       PHE  33   0.428  -2.008   5.057
  269    H    PHE  34           H        PHE  34  -5.031  -4.225   1.249
  270    HA   PHE  34           HA       PHE  34  -5.485  -1.472   1.771
  271   1HB   PHE  34          2HB       PHE  34  -6.195  -3.078  -0.689
  272   2HB   PHE  34          1HB       PHE  34  -6.080  -1.317  -0.595
  273    HD1  PHE  34           1HD      PHE  34  -3.759  -0.702   0.808
  274    HD2  PHE  34           2HD      PHE  34  -4.404  -3.969  -1.838
  275    HE1  PHE  34           1HE      PHE  34  -1.339  -0.854   0.421
  276    HE2  PHE  34           2HE      PHE  34  -1.981  -4.123  -2.238
  277    HZ   PHE  34           HZ       PHE  34  -0.452  -2.568  -1.087
  278    H    ASN  35           H        ASN  35  -7.616  -4.210   1.272
  279    HA   ASN  35           HA       ASN  35 -10.083  -2.990   1.067
  280   1HB   ASN  35          2HB       ASN  35  -9.688  -5.431   0.931
  281   2HB   ASN  35          1HB       ASN  35  -9.378  -5.467   2.662
  282   1HD2  ASN  35          1HD2      ASN  35 -11.482  -6.487   0.652
  283   2HD2  ASN  35          2HD2      ASN  35 -12.974  -6.192   1.474
  284    H    ASP  36           H        ASP  36  -8.105  -3.619   3.870
  285    HA   ASP  36           HA       ASP  36 -10.038  -2.373   5.668
  286   1HB   ASP  36          2HB       ASP  36  -7.419  -3.765   6.261
  287   2HB   ASP  36          1HB       ASP  36  -8.526  -3.131   7.476
  288    H    ASN  37           H        ASN  37  -7.069  -1.583   4.048
  289    HA   ASN  37           HA       ASN  37  -6.420   0.568   5.879
  290   1HB   ASN  37          2HB       ASN  37  -5.246  -0.145   3.181
  291   2HB   ASN  37          1HB       ASN  37  -4.639   1.127   4.235
  292   1HD2  ASN  37          1HD2      ASN  37  -3.599  -1.565   3.196
  293   2HD2  ASN  37          2HD2      ASN  37  -2.980  -2.316   4.627
  294    H    GLY  38           H        GLY  38  -7.611   0.236   2.580
  295   1HA   GLY  38          2HA       GLY  38  -7.911   2.349   1.268
  296   2HA   GLY  38          1HA       GLY  38  -9.407   1.585   1.754
  297    H    VAL  39           H        VAL  39 -10.855   2.819   2.699
  298    HA   VAL  39           HA       VAL  39 -10.020   5.482   3.646
  299    HB   VAL  39           HB       VAL  39 -12.754   4.589   2.801
  300   1HG1  VAL  39          1HG1      VAL  39 -11.585   7.137   3.718
  301   2HG1  VAL  39          2HG1      VAL  39 -13.235   6.529   3.855
  302   3HG1  VAL  39          3HG1      VAL  39 -12.682   7.243   2.340
  303   1HG2  VAL  39          1HG2      VAL  39 -10.807   6.145   1.114
  304   2HG2  VAL  39          2HG2      VAL  39 -12.363   5.464   0.634
  305   3HG2  VAL  39          3HG2      VAL  39 -11.007   4.397   0.997
  306    H    ASP  40           H        ASP  40 -10.767   2.633   5.139
  307    HA   ASP  40           HA       ASP  40 -12.216   4.050   7.269
  308   1HB   ASP  40          2HB       ASP  40 -12.494   1.150   6.464
  309   2HB   ASP  40          1HB       ASP  40 -13.286   1.900   7.847
  310    H    GLY  41           H        GLY  41  -9.252   3.122   6.615
  311   1HA   GLY  41          2HA       GLY  41  -8.686   1.507   8.956
  312   2HA   GLY  41          1HA       GLY  41  -7.517   2.086   7.781
  313    H    GLU  42           H        GLU  42  -6.566   2.256  10.154
  314    HA   GLU  42           HA       GLU  42  -7.155   4.927  11.230
  315   1HB   GLU  42          2HB       GLU  42  -5.603   2.642  12.469
  316   2HB   GLU  42          1HB       GLU  42  -5.908   4.196  13.234
  317   1HG   GLU  42          2HG       GLU  42  -7.462   2.712  14.164
  318   2HG   GLU  42          1HG       GLU  42  -8.369   3.684  13.008
  319    H    TRP  43           H        TRP  43  -5.958   6.383  10.139
  320    HA   TRP  43           HA       TRP  43  -3.220   5.731   9.392
  321   1HB   TRP  43          2HB       TRP  43  -4.950   8.120   8.746
  322   2HB   TRP  43          1HB       TRP  43  -3.322   7.858   8.128
  323    HD1  TRP  43           HD       TRP  43  -6.440   5.522   8.235
  324    HE1  TRP  43           1HE      TRP  43  -6.776   4.576   5.862
  325    HE3  TRP  43           3HE      TRP  43  -2.605   7.916   5.866
  326    HZ2  TRP  43           2HZ      TRP  43  -5.566   4.820   3.320
  327    HZ3  TRP  43           3HZ      TRP  43  -2.258   7.508   3.471
  328    HH2  TRP  43           HH       TRP  43  -3.710   5.989   2.221
  329    H    THR  44           H        THR  44  -1.575   6.232  10.659
  330    HA   THR  44           HA       THR  44  -1.820   8.552  12.459
  331    HB   THR  44           HB       THR  44  -0.026   7.450  13.803
  332    HG1  THR  44           1HG      THR  44   0.699   6.126  11.982
  333   1HG2  THR  44          1HG2      THR  44  -2.725   6.753  13.731
  334   2HG2  THR  44          2HG2      THR  44  -1.580   6.498  15.049
  335   3HG2  THR  44          3HG2      THR  44  -1.840   5.233  13.847
  336    H    TYR  45           H        TYR  45  -0.278  10.152  12.352
  337    HA   TYR  45           HA       TYR  45   1.701   9.866  10.190
  338   1HB   TYR  45          2HB       TYR  45  -0.044  11.607   9.875
  339   2HB   TYR  45          1HB       TYR  45   0.532  12.410  11.330
  340    HD1  TYR  45           1HD      TYR  45   2.635  10.835   8.713
  341    HD2  TYR  45           2HD      TYR  45   1.244  14.470  10.430
  342    HE1  TYR  45           1HE      TYR  45   4.263  12.087   7.362
  343    HE2  TYR  45           2HE      TYR  45   2.868  15.733   9.081
  344    HH   TYR  45           HH       TYR  45   4.223  14.819   6.500
  345    H    ASP  46           H        ASP  46   3.814  10.535  10.474
  346    HA   ASP  46           HA       ASP  46   4.623  11.140  13.242
  347   1HB   ASP  46          2HB       ASP  46   5.226   8.833  12.655
  348   2HB   ASP  46          1HB       ASP  46   6.089   9.412  11.232
  349    H    ASP  47           H        ASP  47   4.537  13.375  12.644
  350    HA   ASP  47           HA       ASP  47   5.708  14.673  10.555
  351   1HB   ASP  47          2HB       ASP  47   5.732  15.570  13.445
  352   2HB   ASP  47          1HB       ASP  47   5.976  16.616  12.049
  353    H    ALA  48           H        ALA  48   7.340  13.354  13.378
  354    HA   ALA  48           HA       ALA  48   9.793  14.557  13.253
  355   1HB   ALA  48          1HB       ALA  48  10.461  11.965  13.874
  356   2HB   ALA  48          2HB       ALA  48   8.755  12.056  14.309
  357   3HB   ALA  48          3HB       ALA  48   9.905  13.194  15.011
  358    H    THR  49           H        THR  49   8.600  11.971  11.180
  359    HA   THR  49           HA       THR  49  11.032  12.294   9.550
  360    HB   THR  49           HB       THR  49  10.907   9.894   8.978
  361    HG1  THR  49           1HG      THR  49   9.468   8.582   9.945
  362   1HG2  THR  49          1HG2      THR  49  12.029  10.915  11.199
  363   2HG2  THR  49          2HG2      THR  49  12.144   9.222  10.717
  364   3HG2  THR  49          3HG2      THR  49  10.939   9.722  11.905
  365    H    LYS  50           H        LYS  50   8.064  13.229   9.477
  366    HA   LYS  50           HA       LYS  50   6.440  13.577   7.895
  367   1HB   LYS  50          2HB       LYS  50   8.780  13.140   6.025
  368   2HB   LYS  50          1HB       LYS  50   7.251  13.882   5.581
  369   1HG   LYS  50          2HG       LYS  50   9.162  14.978   7.633
  370   2HG   LYS  50          1HG       LYS  50   9.059  15.512   5.955
  371   1HD   LYS  50          2HD       LYS  50   6.845  15.664   8.000
  372   2HD   LYS  50          1HD       LYS  50   7.834  17.015   7.441
  373   1HE   LYS  50          2HE       LYS  50   6.984  16.671   5.163
  374   2HE   LYS  50          1HE       LYS  50   5.971  15.352   5.750
  375   1HZ   LYS  50          1HZ       LYS  50   5.752  18.016   6.980
  376   2HZ   LYS  50          2HZ       LYS  50   4.591  16.793   6.865
  377   3HZ   LYS  50          3HZ       LYS  50   4.985  17.715   5.503
  378    H    THR  51           H        THR  51   6.855  10.865   8.840
  379    HA   THR  51           HA       THR  51   6.078   9.304   6.475
  380    HB   THR  51           HB       THR  51   7.209   8.380   9.122
  381    HG1  THR  51           1HG      THR  51   8.394   8.338   6.553
  382   1HG2  THR  51          1HG2      THR  51   7.230   6.202   8.390
  383   2HG2  THR  51          2HG2      THR  51   7.025   6.656   6.700
  384   3HG2  THR  51          3HG2      THR  51   5.664   6.771   7.814
  385    H    PHE  52           H        PHE  52   4.343   7.871   6.588
  386    HA   PHE  52           HA       PHE  52   2.433   8.362   8.786
  387   1HB   PHE  52          2HB       PHE  52   1.789   7.744   5.891
  388   2HB   PHE  52          1HB       PHE  52   0.618   8.024   7.174
  389    HD1  PHE  52           1HD      PHE  52  -0.185  10.162   7.573
  390    HD2  PHE  52           2HD      PHE  52   3.389   9.658   5.319
  391    HE1  PHE  52           1HE      PHE  52  -0.200  12.559   7.022
  392    HE2  PHE  52           2HE      PHE  52   3.382  12.055   4.766
  393    HZ   PHE  52           HZ       PHE  52   1.587  13.510   5.617
  394    H    THR  53           H        THR  53   1.622   6.568   9.800
  395    HA   THR  53           HA       THR  53   2.411   3.978   8.654
  396    HB   THR  53           HB       THR  53   2.027   3.186  11.105
  397    HG1  THR  53           1HG      THR  53   2.345   4.733  12.631
  398   1HG2  THR  53          1HG2      THR  53   4.180   2.851  10.644
  399   2HG2  THR  53          2HG2      THR  53   4.421   4.307  11.616
  400   3HG2  THR  53          3HG2      THR  53   4.367   4.419   9.857
  401    H    VAL  54           H        VAL  54   0.676   3.554   7.438
  402    HA   VAL  54           HA       VAL  54  -2.007   3.669   8.526
  403    HB   VAL  54           HB       VAL  54  -1.067   2.479   5.906
  404   1HG1  VAL  54          1HG1      VAL  54  -3.205   2.035   5.389
  405   2HG1  VAL  54          2HG1      VAL  54  -3.799   3.516   6.137
  406   3HG1  VAL  54          3HG1      VAL  54  -3.467   2.099   7.131
  407   1HG2  VAL  54          1HG2      VAL  54  -1.771   5.261   6.708
  408   2HG2  VAL  54          2HG2      VAL  54  -2.201   4.705   5.091
  409   3HG2  VAL  54          3HG2      VAL  54  -0.516   4.687   5.611
  410    H    THR  55           H        THR  55  -2.786   2.097   9.786
  411    HA   THR  55           HA       THR  55  -1.398  -0.426   9.917
  412    HB   THR  55           HB       THR  55  -3.858   0.374  11.465
  413    HG1  THR  55           1HG      THR  55  -1.121   0.817  12.068
  414   1HG2  THR  55          1HG2      THR  55  -2.672  -1.085  13.196
  415   2HG2  THR  55          2HG2      THR  55  -1.733  -1.701  11.834
  416   3HG2  THR  55          3HG2      THR  55  -3.488  -1.891  11.856
  417    H    GLU  56           H        GLU  56  -2.520  -2.444   9.959
  418    HA   GLU  56           HA       GLU  56  -4.005  -2.877   7.573
  419   1HB   GLU  56          2HB       GLU  56  -4.334  -5.215   8.556
  420   2HB   GLU  56          1HB       GLU  56  -2.690  -4.690   8.233
  421   1HG   GLU  56          2HG       GLU  56  -2.784  -5.831  10.327
  422   2HG   GLU  56          1HG       GLU  56  -2.425  -4.137  10.609
  423   1H    MET   1          1HT       MET   1   7.677  18.117  -3.241
  424   2H    MET   1          2HT       MET   1   7.123  19.402  -2.293
  425   3H    MET   1          3HT       MET   1   6.088  18.117  -2.659
  426    HA   MET   1           HA       MET   1   8.591  17.766  -1.123
  427   1HB   MET   1          2HB       MET   1   6.766  19.384  -0.181
  428   2HB   MET   1          1HB       MET   1   5.850  17.912   0.106
  429   1HG   MET   1          2HG       MET   1   8.592  18.484   1.206
  430   2HG   MET   1          1HG       MET   1   7.081  18.683   2.088
  431   1HE   MET   1          1HE       MET   1   8.350  15.749   4.011
  432   2HE   MET   1          2HE       MET   1   8.483  17.492   3.769
  433   3HE   MET   1          3HE       MET   1   9.687  16.410   3.068
  434    H    GLN   2           H        GLN   2   8.971  15.665  -0.627
  435    HA   GLN   2           HA       GLN   2   7.008  13.689  -1.550
  436   1HB   GLN   2          2HB       GLN   2   9.203  13.567  -2.633
  437   2HB   GLN   2          1HB       GLN   2   9.980  13.397  -1.065
  438   1HG   GLN   2          2HG       GLN   2   8.822  11.274  -0.723
  439   2HG   GLN   2          1HG       GLN   2   8.050  11.443  -2.297
  440   1HE2  GLN   2          1HE2      GLN   2   8.956  10.253  -3.799
  441   2HE2  GLN   2          2HE2      GLN   2  10.633   9.855  -3.920
  442    H    TYR   3           H        TYR   3   6.222  12.141  -0.221
  443    HA   TYR   3           HA       TYR   3   7.135  12.201   2.581
  444   1HB   TYR   3          2HB       TYR   3   4.316  11.795   1.562
  445   2HB   TYR   3          1HB       TYR   3   4.811  11.685   3.249
  446    HD1  TYR   3           1HD      TYR   3   4.589  13.558   4.585
  447    HD2  TYR   3           2HD      TYR   3   4.927  14.070   0.377
  448    HE1  TYR   3           1HE      TYR   3   4.215  15.971   4.855
  449    HE2  TYR   3           2HE      TYR   3   4.559  16.486   0.637
  450    HH   TYR   3           HH       TYR   3   4.729  18.207   2.308
  451    H    LYS   4           H        LYS   4   7.152  10.241   3.714
  452    HA   LYS   4           HA       LYS   4   7.114   7.870   1.968
  453   1HB   LYS   4          2HB       LYS   4   9.301   8.405   2.992
  454   2HB   LYS   4          1HB       LYS   4   8.573   8.271   4.587
  455   1HG   LYS   4          2HG       LYS   4   8.095   5.920   4.191
  456   2HG   LYS   4          1HG       LYS   4   8.781   6.045   2.569
  457   1HD   LYS   4          2HD       LYS   4  10.951   6.656   3.557
  458   2HD   LYS   4          1HD       LYS   4  10.253   6.479   5.168
  459   1HE   LYS   4          2HE       LYS   4  11.506   4.488   4.547
  460   2HE   LYS   4          1HE       LYS   4   9.788   4.121   4.707
  461   1HZ   LYS   4          1HZ       LYS   4  11.238   4.578   2.154
  462   2HZ   LYS   4          2HZ       LYS   4   9.585   4.252   2.295
  463   3HZ   LYS   4          3HZ       LYS   4  10.717   3.081   2.746
  464    H    VAL   5           H        VAL   5   5.167   6.942   2.148
  465    HA   VAL   5           HA       VAL   5   3.861   6.850   4.752
  466    HB   VAL   5           HB       VAL   5   2.822   6.006   2.045
  467   1HG1  VAL   5          1HG1      VAL   5   1.651   4.754   3.679
  468   2HG1  VAL   5          2HG1      VAL   5   0.601   6.101   3.239
  469   3HG1  VAL   5          3HG1      VAL   5   1.512   6.147   4.748
  470   1HG2  VAL   5          1HG2      VAL   5   2.716   8.228   1.743
  471   2HG2  VAL   5          2HG2      VAL   5   2.915   8.570   3.462
  472   3HG2  VAL   5          3HG2      VAL   5   1.328   8.136   2.827
  473    H    ILE   6           H        ILE   6   4.057   5.206   6.018
  474    HA   ILE   6           HA       ILE   6   5.057   2.649   5.015
  475    HB   ILE   6           HB       ILE   6   4.782   3.717   7.826
  476   1HG1  ILE   6          2HG1      ILE   6   7.209   3.119   6.119
  477   2HG1  ILE   6          1HG1      ILE   6   6.592   4.723   6.505
  478   1HG2  ILE   6          1HG2      ILE   6   6.397   1.531   8.024
  479   2HG2  ILE   6          2HG2      ILE   6   5.203   0.993   6.843
  480   3HG2  ILE   6          3HG2      ILE   6   4.680   1.563   8.428
  481   1HD1  ILE   6          1HD1      ILE   6   8.488   4.229   7.888
  482   2HD1  ILE   6          2HD1      ILE   6   7.748   2.724   8.433
  483   3HD1  ILE   6          3HD1      ILE   6   7.038   4.273   8.890
  484    H    LEU   7           H        LEU   7   3.776   0.958   4.757
  485    HA   LEU   7           HA       LEU   7   1.063   1.041   5.891
  486   1HB   LEU   7          2HB       LEU   7   2.030  -0.793   3.702
  487   2HB   LEU   7          1HB       LEU   7   0.377  -0.364   4.104
  488    HG   LEU   7           HG       LEU   7   2.423   1.466   2.861
  489   1HD1  LEU   7          1HD1      LEU   7   1.255   1.241   0.854
  490   2HD1  LEU   7          2HD1      LEU   7  -0.146   0.513   1.642
  491   3HD1  LEU   7          3HD1      LEU   7   1.351  -0.405   1.479
  492   1HD2  LEU   7          1HD2      LEU   7  -0.491   2.049   3.295
  493   2HD2  LEU   7          2HD2      LEU   7   0.805   3.162   2.856
  494   3HD2  LEU   7          3HD2      LEU   7   0.739   2.485   4.482
  495    H    ASN   8           H        ASN   8   1.456   0.195   7.937
  496    HA   ASN   8           HA       ASN   8   2.841  -2.372   8.122
  497   1HB   ASN   8          2HB       ASN   8   3.480  -0.439   9.590
  498   2HB   ASN   8          1HB       ASN   8   1.900  -0.571  10.355
  499   1HD2  ASN   8          1HD2      ASN   8   4.951  -1.183  10.904
  500   2HD2  ASN   8          2HD2      ASN   8   4.853  -2.638  11.832
  501    H    GLY   9           H        GLY   9   1.563  -4.112   7.880
  502   1HA   GLY   9          2HA       GLY   9  -1.041  -4.078   9.274
  503   2HA   GLY   9          1HA       GLY   9  -0.767  -4.939   7.771
  504    H    LYS  10           H        LYS  10  -1.699  -6.709   9.078
  505    HA   LYS  10           HA       LYS  10  -0.058  -7.844  11.146
  506   1HB   LYS  10          2HB       LYS  10  -2.585  -8.710   9.766
  507   2HB   LYS  10          1HB       LYS  10  -1.736  -9.789  10.857
  508   1HG   LYS  10          2HG       LYS  10  -2.733  -7.056  11.617
  509   2HG   LYS  10          1HG       LYS  10  -3.612  -8.553  11.902
  510   1HD   LYS  10          2HD       LYS  10  -0.830  -8.068  12.938
  511   2HD   LYS  10          1HD       LYS  10  -2.277  -7.632  13.847
  512   1HE   LYS  10          2HE       LYS  10  -1.641  -9.756  14.639
  513   2HE   LYS  10          1HE       LYS  10  -3.013 -10.032  13.568
  514   1HZ   LYS  10          1HZ       LYS  10  -1.770 -11.215  12.160
  515   2HZ   LYS  10          2HZ       LYS  10  -0.678 -11.356  13.444
  516   3HZ   LYS  10          3HZ       LYS  10  -0.445 -10.168  12.263
  517    H    THR  11           H        THR  11  -1.111  -8.981   7.933
  518    HA   THR  11           HA       THR  11   1.166 -10.811   7.860
  519    HB   THR  11           HB       THR  11  -0.171 -11.696   5.837
  520    HG1  THR  11           1HG      THR  11  -1.557  -9.807   5.815
  521   1HG2  THR  11          1HG2      THR  11  -0.118 -12.994   7.849
  522   2HG2  THR  11          2HG2      THR  11  -1.775 -12.938   7.249
  523   3HG2  THR  11          3HG2      THR  11  -1.297 -11.929   8.615
  524    H    LEU  12           H        LEU  12   0.583  -7.745   6.968
  525    HA   LEU  12           HA       LEU  12   2.361  -7.990   4.662
  526   1HB   LEU  12          2HB       LEU  12   0.106  -7.781   3.771
  527   2HB   LEU  12          1HB       LEU  12  -0.156  -6.333   4.724
  528    HG   LEU  12           HG       LEU  12   1.435  -5.104   3.426
  529   1HD1  LEU  12          1HD1      LEU  12   3.196  -6.192   2.630
  530   2HD1  LEU  12          2HD1      LEU  12   2.159  -6.767   1.321
  531   3HD1  LEU  12          3HD1      LEU  12   2.381  -7.744   2.769
  532   1HD2  LEU  12          1HD2      LEU  12  -0.016  -4.743   1.777
  533   2HD2  LEU  12          2HD2      LEU  12  -0.943  -6.096   2.429
  534   3HD2  LEU  12          3HD2      LEU  12   0.208  -6.366   1.122
  535    H    LYS  13           H        LYS  13   3.868  -6.462   4.462
  536    HA   LYS  13           HA       LYS  13   3.733  -4.030   6.065
  537   1HB   LYS  13          2HB       LYS  13   6.017  -6.007   6.262
  538   2HB   LYS  13          1HB       LYS  13   6.009  -4.398   6.972
  539   1HG   LYS  13          2HG       LYS  13   4.157  -5.016   8.413
  540   2HG   LYS  13          1HG       LYS  13   4.100  -6.618   7.675
  541   1HD   LYS  13          2HD       LYS  13   6.436  -5.469   9.200
  542   2HD   LYS  13          1HD       LYS  13   5.277  -6.642   9.831
  543   1HE   LYS  13          2HE       LYS  13   5.955  -8.226   8.078
  544   2HE   LYS  13          1HE       LYS  13   7.136  -7.057   7.489
  545   1HZ   LYS  13          1HZ       LYS  13   7.139  -8.187  10.234
  546   2HZ   LYS  13          2HZ       LYS  13   8.330  -7.207   9.538
  547   3HZ   LYS  13          3HZ       LYS  13   8.084  -8.778   8.961
  548    H    GLY  14           H        GLY  14   4.932  -2.323   5.175
  549   1HA   GLY  14          2HA       GLY  14   6.914  -2.691   3.186
  550   2HA   GLY  14          1HA       GLY  14   5.364  -2.387   2.421
  551    H    GLU  15           H        GLU  15   6.885  -0.600   1.644
  552    HA   GLU  15           HA       GLU  15   6.270   1.776   3.225
  553   1HB   GLU  15          2HB       GLU  15   9.003   1.286   2.024
  554   2HB   GLU  15          1HB       GLU  15   8.492   2.715   2.911
  555   1HG   GLU  15          2HG       GLU  15   9.597   1.646   4.567
  556   2HG   GLU  15          1HG       GLU  15   8.006   0.922   4.795
  557    H    THR  16           H        THR  16   5.641   3.471   2.018
  558    HA   THR  16           HA       THR  16   6.090   3.385  -0.873
  559    HB   THR  16           HB       THR  16   3.941   2.537  -0.877
  560    HG1  THR  16           1HG      THR  16   3.414   5.292  -0.746
  561   1HG2  THR  16          1HG2      THR  16   3.200   4.355   1.396
  562   2HG2  THR  16          2HG2      THR  16   3.469   2.617   1.497
  563   3HG2  THR  16          3HG2      THR  16   2.112   3.247   0.565
  564    H    THR  17           H        THR  17   5.458   5.532  -1.928
  565    HA   THR  17           HA       THR  17   5.750   7.787  -0.089
  566    HB   THR  17           HB       THR  17   7.546   8.754  -1.529
  567    HG1  THR  17           1HG      THR  17   7.263   7.528  -3.384
  568   1HG2  THR  17          1HG2      THR  17   9.353   7.101  -0.825
  569   2HG2  THR  17          2HG2      THR  17   8.048   6.195  -0.060
  570   3HG2  THR  17          3HG2      THR  17   8.384   7.850   0.445
  571    H    THR  18           H        THR  18   4.279   9.239  -0.531
  572    HA   THR  18           HA       THR  18   3.298   9.572  -3.303
  573    HB   THR  18           HB       THR  18   1.597   8.954  -1.602
  574    HG1  THR  18           1HG      THR  18   1.063  10.317  -3.391
  575   1HG2  THR  18          1HG2      THR  18   2.382   9.931   0.408
  576   2HG2  THR  18          2HG2      THR  18   0.866  10.733  -0.008
  577   3HG2  THR  18          3HG2      THR  18   2.404  11.542  -0.310
  578    H    GLU  19           H        GLU  19   3.243  11.632  -4.212
  579    HA   GLU  19           HA       GLU  19   4.897  13.659  -2.854
  580   1HB   GLU  19          2HB       GLU  19   5.673  12.933  -5.071
  581   2HB   GLU  19          1HB       GLU  19   4.123  13.376  -5.771
  582   1HG   GLU  19          2HG       GLU  19   5.690  15.090  -6.284
  583   2HG   GLU  19          1HG       GLU  19   4.555  15.726  -5.093
  584    H    ALA  20           H        ALA  20   3.729  15.210  -1.814
  585    HA   ALA  20           HA       ALA  20   1.494  16.425  -3.227
  586   1HB   ALA  20          1HB       ALA  20   1.068  15.537  -0.397
  587   2HB   ALA  20          2HB       ALA  20   0.671  14.501  -1.768
  588   3HB   ALA  20          3HB       ALA  20  -0.125  16.063  -1.585
  589    H    VAL  21           H        VAL  21   0.889  18.451  -2.484
  590    HA   VAL  21           HA       VAL  21   2.875  20.209  -1.781
  591    HB   VAL  21           HB       VAL  21  -0.035  20.626  -1.110
  592   1HG1  VAL  21          1HG1      VAL  21   1.622  22.826  -2.142
  593   2HG1  VAL  21          2HG1      VAL  21   2.051  22.242  -0.533
  594   3HG1  VAL  21          3HG1      VAL  21   0.414  22.816  -0.855
  595   1HG2  VAL  21          1HG2      VAL  21  -0.200  20.021  -3.321
  596   2HG2  VAL  21          2HG2      VAL  21   1.408  20.625  -3.720
  597   3HG2  VAL  21          3HG2      VAL  21   0.080  21.757  -3.469
  598    H    ASP  22           H        ASP  22   0.714  18.472   0.386
  599    HA   ASP  22           HA       ASP  22   2.476  19.148   2.604
  600   1HB   ASP  22          2HB       ASP  22   0.718  19.944   4.070
  601   2HB   ASP  22          1HB       ASP  22   0.772  20.938   2.620
  602    H    ALA  23           H        ALA  23   1.687  17.999   4.685
  603    HA   ALA  23           HA       ALA  23   1.701  15.257   4.209
  604   1HB   ALA  23          1HB       ALA  23   2.214  15.247   6.367
  605   2HB   ALA  23          2HB       ALA  23   0.574  15.749   6.779
  606   3HB   ALA  23          3HB       ALA  23   1.813  16.962   6.459
  607    H    ALA  24           H        ALA  24  -0.995  17.410   4.980
  608    HA   ALA  24           HA       ALA  24  -2.963  15.405   5.216
  609   1HB   ALA  24          1HB       ALA  24  -4.407  17.515   4.336
  610   2HB   ALA  24          2HB       ALA  24  -2.945  18.337   4.884
  611   3HB   ALA  24          3HB       ALA  24  -3.860  17.326   6.003
  612    H    THR  25           H        THR  25  -2.175  17.535   2.461
  613    HA   THR  25           HA       THR  25  -3.865  16.412   0.588
  614    HB   THR  25           HB       THR  25  -2.156  17.208  -1.089
  615    HG1  THR  25           1HG      THR  25  -0.317  16.859   0.238
  616   1HG2  THR  25          1HG2      THR  25  -2.082  19.638   0.060
  617   2HG2  THR  25          2HG2      THR  25  -3.411  18.893   0.948
  618   3HG2  THR  25          3HG2      THR  25  -3.473  18.993  -0.811
  619    H    ALA  26           H        ALA  26  -0.587  15.479   1.538
  620    HA   ALA  26           HA       ALA  26  -0.276  13.344  -0.264
  621   1HB   ALA  26          1HB       ALA  26   1.175  14.454   1.913
  622   2HB   ALA  26          2HB       ALA  26   1.740  13.323   0.682
  623   3HB   ALA  26          3HB       ALA  26   1.039  12.715   2.182
  624    H    GLU  27           H        GLU  27  -1.394  13.411   3.130
  625    HA   GLU  27           HA       GLU  27  -1.960  10.754   3.491
  626   1HB   GLU  27          2HB       GLU  27  -2.091  12.425   5.273
  627   2HB   GLU  27          1HB       GLU  27  -3.514  13.130   4.520
  628   1HG   GLU  27          2HG       GLU  27  -4.747  11.061   4.898
  629   2HG   GLU  27          1HG       GLU  27  -3.320  10.345   5.643
  630    H    LYS  28           H        LYS  28  -4.138  13.269   2.200
  631    HA   LYS  28           HA       LYS  28  -6.299  11.519   1.713
  632   1HB   LYS  28          2HB       LYS  28  -5.561  14.258   0.739
  633   2HB   LYS  28          1HB       LYS  28  -6.937  13.413   0.038
  634   1HG   LYS  28          2HG       LYS  28  -7.374  15.018   1.978
  635   2HG   LYS  28          1HG       LYS  28  -8.124  13.422   2.042
  636   1HD   LYS  28          2HD       LYS  28  -6.355  12.636   3.528
  637   2HD   LYS  28          1HD       LYS  28  -5.570  14.216   3.442
  638   1HE   LYS  28          2HE       LYS  28  -6.864  13.980   5.501
  639   2HE   LYS  28          1HE       LYS  28  -7.521  15.254   4.475
  640   1HZ   LYS  28          1HZ       LYS  28  -9.207  13.688   3.700
  641   2HZ   LYS  28          2HZ       LYS  28  -9.283  13.896   5.377
  642   3HZ   LYS  28          3HZ       LYS  28  -8.591  12.496   4.730
  643    H    VAL  29           H        VAL  29  -3.669  12.691  -0.375
  644    HA   VAL  29           HA       VAL  29  -4.487  11.478  -2.745
  645    HB   VAL  29           HB       VAL  29  -1.662  11.887  -1.737
  646   1HG1  VAL  29          1HG1      VAL  29  -1.058  11.816  -4.155
  647   2HG1  VAL  29          2HG1      VAL  29  -2.693  11.250  -4.495
  648   3HG1  VAL  29          3HG1      VAL  29  -1.611  10.271  -3.504
  649   1HG2  VAL  29          1HG2      VAL  29  -2.710  13.631  -3.843
  650   2HG2  VAL  29          2HG2      VAL  29  -1.777  14.026  -2.401
  651   3HG2  VAL  29          3HG2      VAL  29  -3.522  13.802  -2.288
  652    H    VAL  30           H        VAL  30  -2.687  10.206  -0.003
  653    HA   VAL  30           HA       VAL  30  -2.171   7.646  -1.113
  654    HB   VAL  30           HB       VAL  30  -2.507   8.287   1.822
  655   1HG1  VAL  30          1HG1      VAL  30  -2.311   5.870   0.844
  656   2HG1  VAL  30          2HG1      VAL  30  -1.383   6.324   2.273
  657   3HG1  VAL  30          3HG1      VAL  30  -0.603   6.283   0.692
  658   1HG2  VAL  30          1HG2      VAL  30  -0.696   9.486   0.082
  659   2HG2  VAL  30          2HG2      VAL  30   0.229   8.218   0.886
  660   3HG2  VAL  30          3HG2      VAL  30  -0.603   9.443   1.842
  661    H    LYS  31           H        LYS  31  -4.743   8.926   1.023
  662    HA   LYS  31           HA       LYS  31  -6.232   6.666   1.465
  663   1HB   LYS  31          2HB       LYS  31  -7.223   9.445   0.833
  664   2HB   LYS  31          1HB       LYS  31  -8.257   8.147   1.403
  665   1HG   LYS  31          2HG       LYS  31  -6.990   8.027   3.469
  666   2HG   LYS  31          1HG       LYS  31  -5.925   9.312   2.899
  667   1HD   LYS  31          2HD       LYS  31  -7.462  10.420   4.269
  668   2HD   LYS  31          1HD       LYS  31  -8.066  10.698   2.632
  669   1HE   LYS  31          2HE       LYS  31  -9.044   8.476   4.416
  670   2HE   LYS  31          1HE       LYS  31  -9.806  10.063   4.336
  671   1HZ   LYS  31          1HZ       LYS  31  -9.702   9.410   1.752
  672   2HZ   LYS  31          2HZ       LYS  31 -11.027   9.081   2.749
  673   3HZ   LYS  31          3HZ       LYS  31  -9.883   7.873   2.440
  674    H    GLN  32           H        GLN  32  -6.398   8.848  -1.295
  675    HA   GLN  32           HA       GLN  32  -8.373   7.509  -2.753
  676   1HB   GLN  32          2HB       GLN  32  -7.285   9.828  -3.124
  677   2HB   GLN  32          1HB       GLN  32  -6.069   8.951  -4.043
  678   1HG   GLN  32          2HG       GLN  32  -7.632   8.264  -5.653
  679   2HG   GLN  32          1HG       GLN  32  -8.999   8.726  -4.639
  680   1HE2  GLN  32          1HE2      GLN  32  -9.600  10.853  -4.496
  681   2HE2  GLN  32          2HE2      GLN  32  -9.006  12.072  -5.569
  682    H    PHE  33           H        PHE  33  -4.908   7.069  -2.530
  683    HA   PHE  33           HA       PHE  33  -4.417   5.305  -4.614
  684   1HB   PHE  33          2HB       PHE  33  -2.742   6.376  -3.045
  685   2HB   PHE  33          1HB       PHE  33  -3.185   5.164  -1.852
  686    HD1  PHE  33           1HD      PHE  33  -1.983   5.447  -5.357
  687    HD2  PHE  33           2HD      PHE  33  -1.955   3.222  -1.719
  688    HE1  PHE  33           1HE      PHE  33  -0.303   3.912  -6.296
  689    HE2  PHE  33           2HE      PHE  33  -0.276   1.695  -2.667
  690    HZ   PHE  33           HZ       PHE  33   0.547   2.050  -4.962
  691    H    PHE  34           H        PHE  34  -4.909   4.398  -1.229
  692    HA   PHE  34           HA       PHE  34  -5.422   1.657  -1.758
  693   1HB   PHE  34          2HB       PHE  34  -6.127   3.280   0.692
  694   2HB   PHE  34          1HB       PHE  34  -6.054   1.517   0.599
  695    HD1  PHE  34           1HD      PHE  34  -3.729   0.844  -0.772
  696    HD2  PHE  34           2HD      PHE  34  -4.331   4.128   1.866
  697    HE1  PHE  34           1HE      PHE  34  -1.312   0.938  -0.349
  698    HE2  PHE  34           2HE      PHE  34  -1.911   4.224   2.300
  699    HZ   PHE  34           HZ       PHE  34  -0.405   2.630   1.171
  700    H    ASN  35           H        ASN  35  -7.493   4.447  -1.289
  701    HA   ASN  35           HA       ASN  35  -9.991   3.286  -1.120
  702   1HB   ASN  35          2HB       ASN  35  -9.539   5.716  -0.978
  703   2HB   ASN  35          1HB       ASN  35  -9.204   5.746  -2.705
  704   1HD2  ASN  35          1HD2      ASN  35 -11.311   6.816  -0.722
  705   2HD2  ASN  35          2HD2      ASN  35 -12.797   6.558  -1.567
  706    H    ASP  36           H        ASP  36  -7.959   3.867  -3.893
  707    HA   ASP  36           HA       ASP  36  -9.896   2.668  -5.720
  708   1HB   ASP  36          2HB       ASP  36  -7.236   3.994  -6.275
  709   2HB   ASP  36          1HB       ASP  36  -8.341   3.388  -7.506
  710    H    ASN  37           H        ASN  37  -6.970   1.806  -4.058
  711    HA   ASN  37           HA       ASN  37  -6.348  -0.361  -5.879
  712   1HB   ASN  37          2HB       ASN  37  -5.196   0.324  -3.166
  713   2HB   ASN  37          1HB       ASN  37  -4.604  -0.963  -4.210
  714   1HD2  ASN  37          1HD2      ASN  37  -3.515   1.705  -3.157
  715   2HD2  ASN  37          2HD2      ASN  37  -2.856   2.440  -4.578
  716    H    GLY  38           H        GLY  38  -7.578   0.003  -2.597
  717   1HA   GLY  38          2HA       GLY  38  -7.947  -2.103  -1.291
  718   2HA   GLY  38          1HA       GLY  38  -9.417  -1.304  -1.798
  719    H    VAL  39           H        VAL  39 -10.881  -2.503  -2.762
  720    HA   VAL  39           HA       VAL  39 -10.098  -5.184  -3.698
  721    HB   VAL  39           HB       VAL  39 -12.822  -4.225  -2.892
  722   1HG1  VAL  39          1HG1      VAL  39 -11.701  -6.801  -3.792
  723   2HG1  VAL  39          2HG1      VAL  39 -13.334  -6.154  -3.954
  724   3HG1  VAL  39          3HG1      VAL  39 -12.820  -6.880  -2.431
  725   1HG2  VAL  39          1HG2      VAL  39 -10.937  -5.829  -1.179
  726   2HG2  VAL  39          2HG2      VAL  39 -12.481  -5.110  -0.721
  727   3HG2  VAL  39          3HG2      VAL  39 -11.094  -4.075  -1.064
  728    H    ASP  40           H        ASP  40 -10.754  -2.319  -5.202
  729    HA   ASP  40           HA       ASP  40 -12.207  -3.700  -7.353
  730   1HB   ASP  40          2HB       ASP  40 -12.425  -0.794  -6.550
  731   2HB   ASP  40          1HB       ASP  40 -13.216  -1.525  -7.945
  732    H    GLY  41           H        GLY  41  -9.230  -2.845  -6.655
  733   1HA   GLY  41          2HA       GLY  41  -8.592  -1.244  -8.988
  734   2HA   GLY  41          1HA       GLY  41  -7.455  -1.852  -7.797
  735    H    GLU  42           H        GLU  42  -6.474  -2.046 -10.156
  736    HA   GLU  42           HA       GLU  42  -7.113  -4.702 -11.241
  737   1HB   GLU  42          2HB       GLU  42  -5.490  -2.454 -12.459
  738   2HB   GLU  42          1HB       GLU  42  -5.820  -4.001 -13.227
  739   1HG   GLU  42          2HG       GLU  42  -7.325  -2.479 -14.180
  740   2HG   GLU  42          1HG       GLU  42  -8.271  -3.430 -13.037
  741    H    TRP  43           H        TRP  43  -5.968  -6.184 -10.133
  742    HA   TRP  43           HA       TRP  43  -3.225  -5.600  -9.349
  743   1HB   TRP  43          2HB       TRP  43  -5.021  -7.947  -8.727
  744   2HB   TRP  43          1HB       TRP  43  -3.398  -7.723  -8.085
  745    HD1  TRP  43           HD       TRP  43  -6.456  -5.313  -8.237
  746    HE1  TRP  43           1HE      TRP  43  -6.801  -4.359  -5.868
  747    HE3  TRP  43           3HE      TRP  43  -2.713  -7.798  -5.813
  748    HZ2  TRP  43           2HZ      TRP  43  -5.634  -4.631  -3.309
  749    HZ3  TRP  43           3HZ      TRP  43  -2.390  -7.399  -3.414
  750    HH2  TRP  43           HH       TRP  43  -3.823  -5.847  -2.185
  751    H    THR  44           H        THR  44  -1.576  -6.141 -10.591
  752    HA   THR  44           HA       THR  44  -1.851  -8.455 -12.395
  753    HB   THR  44           HB       THR  44  -0.012  -7.396 -13.714
  754    HG1  THR  44           1HG      THR  44   0.718  -6.092 -11.882
  755   1HG2  THR  44          1HG2      THR  44  -2.694  -6.634 -13.680
  756   2HG2  THR  44          2HG2      THR  44  -1.524  -6.407 -14.981
  757   3HG2  THR  44          3HG2      THR  44  -1.771  -5.135 -13.785
  758    H    TYR  45           H        TYR  45  -0.350 -10.092 -12.267
  759    HA   TYR  45           HA       TYR  45   1.605  -9.854 -10.077
  760   1HB   TYR  45          2HB       TYR  45  -0.188 -11.552  -9.787
  761   2HB   TYR  45          1HB       TYR  45   0.390 -12.368 -11.234
  762    HD1  TYR  45           1HD      TYR  45   2.494 -10.844  -8.587
  763    HD2  TYR  45           2HD      TYR  45   1.041 -14.446 -10.323
  764    HE1  TYR  45           1HE      TYR  45   4.072 -12.136  -7.213
  765    HE2  TYR  45           2HE      TYR  45   2.613 -15.748  -8.953
  766    HH   TYR  45           HH       TYR  45   3.953 -14.866  -6.353
  767    H    ASP  46           H        ASP  46   3.705 -10.574 -10.332
  768    HA   ASP  46           HA       ASP  46   4.538 -11.198 -13.088
  769   1HB   ASP  46          2HB       ASP  46   5.189  -8.906 -12.492
  770   2HB   ASP  46          1HB       ASP  46   6.017  -9.507 -11.058
  771    H    ASP  47           H        ASP  47   4.389 -13.430 -12.491
  772    HA   ASP  47           HA       ASP  47   5.499 -14.758 -10.387
  773   1HB   ASP  47          2HB       ASP  47   5.543 -15.655 -13.276
  774   2HB   ASP  47          1HB       ASP  47   5.740 -16.706 -11.876
  775    H    ALA  48           H        ALA  48   7.201 -13.478 -13.186
  776    HA   ALA  48           HA       ALA  48   9.623 -14.741 -13.028
  777   1HB   ALA  48          1HB       ALA  48  10.362 -12.165 -13.637
  778   2HB   ALA  48          2HB       ALA  48   8.661 -12.216 -14.097
  779   3HB   ALA  48          3HB       ALA  48   9.792 -13.380 -14.783
  780    H    THR  49           H        THR  49   8.463 -12.126 -10.970
  781    HA   THR  49           HA       THR  49  10.864 -12.509  -9.306
  782    HB   THR  49           HB       THR  49  10.788 -10.104  -8.734
  783    HG1  THR  49           1HG      THR  49   9.396  -8.758  -9.722
  784   1HG2  THR  49          1HG2      THR  49  11.917 -11.154 -10.941
  785   2HG2  THR  49          2HG2      THR  49  12.066  -9.465 -10.457
  786   3HG2  THR  49          3HG2      THR  49  10.867  -9.934 -11.661
  787    H    LYS  50           H        LYS  50   7.874 -13.370  -9.274
  788    HA   LYS  50           HA       LYS  50   6.219 -13.678  -7.716
  789   1HB   LYS  50          2HB       LYS  50   8.542 -13.298  -5.813
  790   2HB   LYS  50          1HB       LYS  50   6.989 -14.003  -5.391
  791   1HG   LYS  50          2HG       LYS  50   8.902 -15.145  -7.416
  792   2HG   LYS  50          1HG       LYS  50   8.762 -15.676  -5.739
  793   1HD   LYS  50          2HD       LYS  50   6.575 -15.774  -7.816
  794   2HD   LYS  50          1HD       LYS  50   7.522 -17.148  -7.243
  795   1HE   LYS  50          2HE       LYS  50   6.650 -16.783  -4.978
  796   2HE   LYS  50          1HE       LYS  50   5.678 -15.442  -5.580
  797   1HZ   LYS  50          1HZ       LYS  50   5.411 -18.099  -6.813
  798   2HZ   LYS  50          2HZ       LYS  50   4.277 -16.847  -6.712
  799   3HZ   LYS  50          3HZ       LYS  50   4.630 -17.778  -5.345
  800    H    THR  51           H        THR  51   6.714 -10.977  -8.656
  801    HA   THR  51           HA       THR  51   5.941  -9.398  -6.302
  802    HB   THR  51           HB       THR  51   7.131  -8.502  -8.933
  803    HG1  THR  51           1HG      THR  51   8.281  -8.487  -6.345
  804   1HG2  THR  51          1HG2      THR  51   7.194  -6.325  -8.199
  805   2HG2  THR  51          2HG2      THR  51   6.956  -6.772  -6.511
  806   3HG2  THR  51          3HG2      THR  51   5.609  -6.855  -7.645
  807    H    PHE  52           H        PHE  52   4.244  -7.923  -6.437
  808    HA   PHE  52           HA       PHE  52   2.354  -8.368  -8.663
  809   1HB   PHE  52          2HB       PHE  52   1.683  -7.733  -5.778
  810   2HB   PHE  52          1HB       PHE  52   0.525  -7.986  -7.077
  811    HD1  PHE  52           1HD      PHE  52  -0.323 -10.103  -7.488
  812    HD2  PHE  52           2HD      PHE  52   3.228  -9.686  -5.183
  813    HE1  PHE  52           1HE      PHE  52  -0.406 -12.500  -6.937
  814    HE2  PHE  52           2HE      PHE  52   3.155 -12.082  -4.631
  815    HZ   PHE  52           HZ       PHE  52   1.336 -13.493  -5.508
  816    H    THR  53           H        THR  53   1.601  -6.555  -9.687
  817    HA   THR  53           HA       THR  53   2.436  -3.984  -8.530
  818    HB   THR  53           HB       THR  53   2.106  -3.183 -10.987
  819    HG1  THR  53           1HG      THR  53   2.407  -4.737 -12.508
  820   1HG2  THR  53          1HG2      THR  53   4.260  -2.902 -10.495
  821   2HG2  THR  53          2HG2      THR  53   4.478  -4.362 -11.464
  822   3HG2  THR  53          3HG2      THR  53   4.397  -4.473  -9.705
  823    H    VAL  54           H        VAL  54   0.695  -3.519  -7.339
  824    HA   VAL  54           HA       VAL  54  -1.976  -3.568  -8.465
  825    HB   VAL  54           HB       VAL  54  -1.043  -2.401  -5.831
  826   1HG1  VAL  54          1HG1      VAL  54  -3.176  -1.905  -5.344
  827   2HG1  VAL  54          2HG1      VAL  54  -3.797  -3.372  -6.101
  828   3HG1  VAL  54          3HG1      VAL  54  -3.417  -1.963  -7.091
  829   1HG2  VAL  54          1HG2      VAL  54  -1.804  -5.165  -6.644
  830   2HG2  VAL  54          2HG2      VAL  54  -2.243  -4.598  -5.033
  831   3HG2  VAL  54          3HG2      VAL  54  -0.550  -4.621  -5.530
  832    H    THR  55           H        THR  55  -2.697  -1.979  -9.736
  833    HA   THR  55           HA       THR  55  -1.246   0.511  -9.847
  834    HB   THR  55           HB       THR  55  -3.704  -0.229 -11.429
  835    HG1  THR  55           1HG      THR  55  -0.971  -0.739 -11.994
  836   1HG2  THR  55          1HG2      THR  55  -2.459   1.200 -13.142
  837   2HG2  THR  55          2HG2      THR  55  -1.524   1.793 -11.768
  838   3HG2  THR  55          3HG2      THR  55  -3.273   2.026 -11.814
  839    H    GLU  56           H        GLU  56  -2.319   2.554  -9.903
  840    HA   GLU  56           HA       GLU  56  -3.827   3.024  -7.540
  841   1HB   GLU  56          2HB       GLU  56  -4.086   5.370  -8.526
  842   2HB   GLU  56          1HB       GLU  56  -2.459   4.805  -8.181
  843   1HG   GLU  56          2HG       GLU  56  -2.494   5.948 -10.275
  844   2HG   GLU  56          1HG       GLU  56  -2.173   4.246 -10.552
  Start of MODEL   40
    1   1H    MET   1          1HT       MET   1   5.603 -18.297   3.119
    2   2H    MET   1          2HT       MET   1   5.554 -19.724   2.212
    3   3H    MET   1          3HT       MET   1   4.285 -18.610   2.104
    4    HA   MET   1           HA       MET   1   7.051 -18.321   1.102
    5   1HB   MET   1          2HB       MET   1   4.316 -18.272  -0.186
    6   2HB   MET   1          1HB       MET   1   5.809 -17.892  -1.034
    7   1HG   MET   1          2HG       MET   1   5.170 -20.525   0.278
    8   2HG   MET   1          1HG       MET   1   5.050 -20.182  -1.447
    9   1HE   MET   1          1HE       MET   1   7.641 -18.278  -1.818
   10   2HE   MET   1          2HE       MET   1   7.132 -19.525  -2.957
   11   3HE   MET   1          3HE       MET   1   8.797 -19.486  -2.379
   12    H    GLN   2           H        GLN   2   7.825 -16.324   0.638
   13    HA   GLN   2           HA       GLN   2   6.276 -14.048   1.645
   14   1HB   GLN   2          2HB       GLN   2   8.511 -14.365   2.608
   15   2HB   GLN   2          1HB       GLN   2   9.223 -14.290   1.001
   16   1HG   GLN   2          2HG       GLN   2   9.524 -12.194   2.161
   17   2HG   GLN   2          1HG       GLN   2   8.462 -11.980   0.770
   18   1HE2  GLN   2          1HE2      GLN   2   8.900 -11.100   3.863
   19   2HE2  GLN   2          2HE2      GLN   2   7.271 -10.755   4.321
   20    H    TYR   3           H        TYR   3   5.567 -12.462   0.329
   21    HA   TYR   3           HA       TYR   3   6.518 -12.471  -2.459
   22   1HB   TYR   3          2HB       TYR   3   3.674 -12.080  -1.506
   23   2HB   TYR   3          1HB       TYR   3   4.217 -11.893  -3.171
   24    HD1  TYR   3           1HD      TYR   3   4.722 -13.820  -4.538
   25    HD2  TYR   3           2HD      TYR   3   3.535 -14.293  -0.480
   26    HE1  TYR   3           1HE      TYR   3   4.343 -16.217  -4.935
   27    HE2  TYR   3           2HE      TYR   3   3.153 -16.691  -0.865
   28    HH   TYR   3           HH       TYR   3   3.100 -18.064  -4.001
   29    H    LYS   4           H        LYS   4   6.751 -10.491  -3.456
   30    HA   LYS   4           HA       LYS   4   6.626  -8.182  -1.638
   31   1HB   LYS   4          2HB       LYS   4   8.856  -8.701  -2.518
   32   2HB   LYS   4          1HB       LYS   4   8.248  -8.573  -4.162
   33   1HG   LYS   4          2HG       LYS   4   7.761  -6.212  -3.809
   34   2HG   LYS   4          1HG       LYS   4   8.343  -6.335  -2.148
   35   1HD   LYS   4          2HD       LYS   4   9.987  -6.834  -4.631
   36   2HD   LYS   4          1HD       LYS   4  10.038  -5.374  -3.640
   37   1HE   LYS   4          2HE       LYS   4  10.771  -6.720  -1.720
   38   2HE   LYS   4          1HE       LYS   4  10.744  -8.164  -2.731
   39   1HZ   LYS   4          1HZ       LYS   4  12.887  -7.657  -3.060
   40   2HZ   LYS   4          2HZ       LYS   4  12.702  -6.042  -2.596
   41   3HZ   LYS   4          3HZ       LYS   4  12.301  -6.520  -4.167
   42    H    VAL   5           H        VAL   5   4.834  -7.028  -1.899
   43    HA   VAL   5           HA       VAL   5   3.615  -6.849  -4.546
   44    HB   VAL   5           HB       VAL   5   2.546  -5.892  -1.885
   45   1HG1  VAL   5          1HG1      VAL   5   1.491  -5.814  -4.671
   46   2HG1  VAL   5          2HG1      VAL   5   1.376  -4.611  -3.388
   47   3HG1  VAL   5          3HG1      VAL   5   0.363  -6.054  -3.335
   48   1HG2  VAL   5          1HG2      VAL   5   0.926  -7.922  -2.649
   49   2HG2  VAL   5          2HG2      VAL   5   2.291  -8.101  -1.547
   50   3HG2  VAL   5          3HG2      VAL   5   2.482  -8.491  -3.256
   51    H    ILE   6           H        ILE   6   3.794  -5.154  -5.770
   52    HA   ILE   6           HA       ILE   6   5.072  -2.730  -4.723
   53    HB   ILE   6           HB       ILE   6   4.770  -3.746  -7.552
   54   1HG1  ILE   6          2HG1      ILE   6   7.201  -3.372  -5.790
   55   2HG1  ILE   6          1HG1      ILE   6   6.457  -4.913  -6.203
   56   1HG2  ILE   6          1HG2      ILE   6   4.626  -1.387  -7.689
   57   2HG2  ILE   6          2HG2      ILE   6   6.277  -1.823  -8.128
   58   3HG2  ILE   6          3HG2      ILE   6   5.933  -1.169  -6.526
   59   1HD1  ILE   6          1HD1      ILE   6   8.188  -3.145  -7.815
   60   2HD1  ILE   6          2HD1      ILE   6   6.913  -4.022  -8.663
   61   3HD1  ILE   6          3HD1      ILE   6   8.121  -4.906  -7.730
   62    H    LEU   7           H        LEU   7   3.945  -0.910  -4.506
   63    HA   LEU   7           HA       LEU   7   1.250  -0.802  -5.671
   64   1HB   LEU   7          2HB       LEU   7   2.255   0.986  -3.476
   65   2HB   LEU   7          1HB       LEU   7   0.602   0.536  -3.856
   66    HG   LEU   7           HG       LEU   7   2.690  -1.219  -2.583
   67   1HD1  LEU   7          1HD1      LEU   7   1.209  -1.188  -0.667
   68   2HD1  LEU   7          2HD1      LEU   7   0.073  -0.155  -1.535
   69   3HD1  LEU   7          3HD1      LEU   7   1.671   0.456  -1.110
   70   1HD2  LEU   7          1HD2      LEU   7   0.957  -2.927  -2.472
   71   2HD2  LEU   7          2HD2      LEU   7   1.318  -2.503  -4.144
   72   3HD2  LEU   7          3HD2      LEU   7  -0.143  -1.886  -3.375
   73    H    ASN   8           H        ASN   8   1.978  -0.076  -7.721
   74    HA   ASN   8           HA       ASN   8   3.379   2.471  -7.859
   75   1HB   ASN   8          2HB       ASN   8   2.470   0.583 -10.034
   76   2HB   ASN   8          1HB       ASN   8   3.333   2.089 -10.327
   77   1HD2  ASN   8          1HD2      ASN   8   3.755  -1.072 -10.266
   78   2HD2  ASN   8          2HD2      ASN   8   5.396  -1.178  -9.739
   79    H    GLY   9           H        GLY   9   2.123   4.157  -7.413
   80   1HA   GLY   9          2HA       GLY   9  -0.401   4.425  -8.928
   81   2HA   GLY   9          1HA       GLY   9  -0.182   5.058  -7.304
   82    H    LYS  10           H        LYS  10  -0.961   6.463  -9.716
   83    HA   LYS  10           HA       LYS  10   0.921   7.943 -11.003
   84   1HB   LYS  10          2HB       LYS  10  -1.704   8.925  -9.874
   85   2HB   LYS  10          1HB       LYS  10  -0.776   9.739 -11.126
   86   1HG   LYS  10          2HG       LYS  10  -1.179   8.015 -12.684
   87   2HG   LYS  10          1HG       LYS  10  -1.789   6.929 -11.436
   88   1HD   LYS  10          2HD       LYS  10  -3.590   7.903 -12.817
   89   2HD   LYS  10          1HD       LYS  10  -3.733   8.331 -11.111
   90   1HE   LYS  10          2HE       LYS  10  -2.717  10.504 -11.571
   91   2HE   LYS  10          1HE       LYS  10  -2.565  10.078 -13.275
   92   1HZ   LYS  10          1HZ       LYS  10  -5.158   9.660 -12.907
   93   2HZ   LYS  10          2HZ       LYS  10  -4.526  11.153 -13.390
   94   3HZ   LYS  10          3HZ       LYS  10  -4.913  10.886 -11.767
   95    H    THR  11           H        THR  11  -0.631   8.956  -7.955
   96    HA   THR  11           HA       THR  11   1.508  10.883  -7.506
   97    HB   THR  11           HB       THR  11  -0.099  11.498  -5.559
   98    HG1  THR  11           1HG      THR  11  -1.352   9.549  -5.883
   99   1HG2  THR  11          1HG2      THR  11  -0.628  11.993  -8.456
  100   2HG2  THR  11          2HG2      THR  11   0.003  13.094  -7.231
  101   3HG2  THR  11          3HG2      THR  11  -1.700  12.640  -7.215
  102    H    LEU  12           H        LEU  12   0.826   7.730  -6.658
  103    HA   LEU  12           HA       LEU  12   2.550   7.970  -4.301
  104   1HB   LEU  12          2HB       LEU  12   0.253   7.750  -3.510
  105   2HB   LEU  12          1HB       LEU  12   0.041   6.300  -4.477
  106    HG   LEU  12           HG       LEU  12   1.509   5.057  -3.093
  107   1HD1  LEU  12          1HD1      LEU  12   2.497   7.704  -2.394
  108   2HD1  LEU  12          2HD1      LEU  12   3.326   6.157  -2.410
  109   3HD1  LEU  12          3HD1      LEU  12   2.347   6.619  -1.015
  110   1HD2  LEU  12          1HD2      LEU  12   0.126   4.842  -1.339
  111   2HD2  LEU  12          2HD2      LEU  12  -0.847   6.034  -2.201
  112   3HD2  LEU  12          3HD2      LEU  12   0.239   6.549  -0.908
  113    H    LYS  13           H        LYS  13   4.128   6.469  -4.149
  114    HA   LYS  13           HA       LYS  13   3.971   4.038  -5.761
  115   1HB   LYS  13          2HB       LYS  13   6.251   6.012  -5.999
  116   2HB   LYS  13          1HB       LYS  13   6.205   4.417  -6.736
  117   1HG   LYS  13          2HG       LYS  13   4.282   5.086  -8.081
  118   2HG   LYS  13          1HG       LYS  13   4.318   6.686  -7.337
  119   1HD   LYS  13          2HD       LYS  13   6.561   7.054  -8.244
  120   2HD   LYS  13          1HD       LYS  13   6.524   5.454  -8.987
  121   1HE   LYS  13          2HE       LYS  13   5.991   7.195 -10.613
  122   2HE   LYS  13          1HE       LYS  13   4.617   6.122 -10.352
  123   1HZ   LYS  13          1HZ       LYS  13   4.030   8.509 -10.425
  124   2HZ   LYS  13          2HZ       LYS  13   4.944   8.757  -9.023
  125   3HZ   LYS  13          3HZ       LYS  13   3.580   7.756  -8.978
  126    H    GLY  14           H        GLY  14   5.224   2.330  -4.962
  127   1HA   GLY  14          2HA       GLY  14   7.292   2.601  -3.081
  128   2HA   GLY  14          1HA       GLY  14   5.787   2.374  -2.209
  129    H    GLU  15           H        GLU  15   7.075   0.481  -1.458
  130    HA   GLU  15           HA       GLU  15   6.345  -1.840  -3.069
  131   1HB   GLU  15          2HB       GLU  15   9.118  -1.408  -1.936
  132   2HB   GLU  15          1HB       GLU  15   8.546  -2.897  -2.679
  133   1HG   GLU  15          2HG       GLU  15   8.226  -1.719  -4.795
  134   2HG   GLU  15          1HG       GLU  15   8.802  -0.229  -4.051
  135    H    THR  16           H        THR  16   5.789  -3.622  -1.878
  136    HA   THR  16           HA       THR  16   6.209  -3.571   1.006
  137    HB   THR  16           HB       THR  16   4.120  -2.579   1.062
  138    HG1  THR  16           1HG      THR  16   3.418  -5.292   0.886
  139   1HG2  THR  16          1HG2      THR  16   2.294  -2.934  -0.389
  140   2HG2  THR  16          2HG2      THR  16   3.063  -4.342  -1.119
  141   3HG2  THR  16          3HG2      THR  16   3.722  -2.733  -1.403
  142    H    THR  17           H        THR  17   5.382  -5.691   2.022
  143    HA   THR  17           HA       THR  17   5.519  -7.931   0.149
  144    HB   THR  17           HB       THR  17   7.229  -9.064   1.551
  145    HG1  THR  17           1HG      THR  17   8.226  -8.003   3.154
  146   1HG2  THR  17          1HG2      THR  17   8.147  -8.109  -0.371
  147   2HG2  THR  17          2HG2      THR  17   9.165  -7.540   0.951
  148   3HG2  THR  17          3HG2      THR  17   7.954  -6.469   0.245
  149    H    THR  18           H        THR  18   3.981  -9.327   0.578
  150    HA   THR  18           HA       THR  18   2.882  -9.529   3.314
  151    HB   THR  18           HB       THR  18   1.278  -8.903   1.519
  152    HG1  THR  18           1HG      THR  18   0.639 -10.202   3.340
  153   1HG2  THR  18          1HG2      THR  18   1.988 -11.584   0.362
  154   2HG2  THR  18          2HG2      THR  18   2.143 -10.005  -0.408
  155   3HG2  THR  18          3HG2      THR  18   0.544 -10.664  -0.063
  156    H    GLU  19           H        GLU  19   2.746 -11.529   4.315
  157    HA   GLU  19           HA       GLU  19   4.325 -13.677   3.069
  158   1HB   GLU  19          2HB       GLU  19   5.129 -12.913   5.247
  159   2HB   GLU  19          1HB       GLU  19   3.553 -13.222   5.960
  160   1HG   GLU  19          2HG       GLU  19   5.110 -14.979   6.533
  161   2HG   GLU  19          1HG       GLU  19   3.816 -15.608   5.513
  162    H    ALA  20           H        ALA  20   3.147 -15.229   2.087
  163    HA   ALA  20           HA       ALA  20   0.852 -16.326   3.492
  164   1HB   ALA  20          1HB       ALA  20   0.265 -14.392   1.795
  165   2HB   ALA  20          2HB       ALA  20  -0.762 -15.813   1.978
  166   3HB   ALA  20          3HB       ALA  20   0.373 -15.711   0.630
  167    H    VAL  21           H        VAL  21   0.237 -18.371   2.833
  168    HA   VAL  21           HA       VAL  21   2.202 -20.180   2.202
  169    HB   VAL  21           HB       VAL  21  -0.711 -20.590   1.537
  170   1HG1  VAL  21          1HG1      VAL  21  -0.147 -22.949   2.220
  171   2HG1  VAL  21          2HG1      VAL  21   1.549 -22.466   2.187
  172   3HG1  VAL  21          3HG1      VAL  21   0.582 -22.395   0.713
  173   1HG2  VAL  21          1HG2      VAL  21  -0.625 -21.616   3.944
  174   2HG2  VAL  21          2HG2      VAL  21  -0.890 -19.885   3.714
  175   3HG2  VAL  21          3HG2      VAL  21   0.711 -20.483   4.155
  176    H    ASP  22           H        ASP  22   0.041 -18.531  -0.032
  177    HA   ASP  22           HA       ASP  22   1.790 -19.323  -2.226
  178   1HB   ASP  22          2HB       ASP  22  -0.019 -20.082  -3.661
  179   2HB   ASP  22          1HB       ASP  22   0.022 -21.044  -2.189
  180    H    ALA  23           H        ALA  23   1.066 -18.202  -4.332
  181    HA   ALA  23           HA       ALA  23   1.189 -15.454  -3.941
  182   1HB   ALA  23          1HB       ALA  23   1.442 -17.133  -6.090
  183   2HB   ALA  23          2HB       ALA  23   1.495 -15.371  -6.156
  184   3HB   ALA  23          3HB       ALA  23  -0.014 -16.221  -6.486
  185    H    ALA  24           H        ALA  24  -1.616 -17.496  -4.633
  186    HA   ALA  24           HA       ALA  24  -3.472 -15.391  -4.916
  187   1HB   ALA  24          1HB       ALA  24  -4.789 -17.102  -5.460
  188   2HB   ALA  24          2HB       ALA  24  -4.776 -17.660  -3.788
  189   3HB   ALA  24          3HB       ALA  24  -3.548 -18.231  -4.918
  190    H    THR  25           H        THR  25  -2.759 -17.477  -2.100
  191    HA   THR  25           HA       THR  25  -4.401 -16.226  -0.258
  192    HB   THR  25           HB       THR  25  -2.816 -17.089   1.444
  193    HG1  THR  25           1HG      THR  25  -0.850 -17.504   0.956
  194   1HG2  THR  25          1HG2      THR  25  -2.626 -19.509   0.346
  195   2HG2  THR  25          2HG2      THR  25  -3.835 -18.796  -0.723
  196   3HG2  THR  25          3HG2      THR  25  -4.126 -18.867   1.016
  197    H    ALA  26           H        ALA  26  -1.065 -15.505  -1.205
  198    HA   ALA  26           HA       ALA  26  -0.652 -13.322   0.518
  199   1HB   ALA  26          1HB       ALA  26   0.523 -13.867  -2.211
  200   2HB   ALA  26          2HB       ALA  26   1.199 -14.362  -0.661
  201   3HB   ALA  26          3HB       ALA  26   1.113 -12.651  -1.080
  202    H    GLU  27           H        GLU  27  -1.683 -13.424  -2.903
  203    HA   GLU  27           HA       GLU  27  -2.147 -10.758  -3.333
  204   1HB   GLU  27          2HB       GLU  27  -2.294 -12.450  -5.088
  205   2HB   GLU  27          1HB       GLU  27  -3.744 -13.114  -4.347
  206   1HG   GLU  27          2HG       GLU  27  -4.928 -11.027  -4.786
  207   2HG   GLU  27          1HG       GLU  27  -3.474 -10.355  -5.522
  208    H    LYS  28           H        LYS  28  -4.407 -13.171  -2.012
  209    HA   LYS  28           HA       LYS  28  -6.597 -11.470  -1.653
  210   1HB   LYS  28          2HB       LYS  28  -5.774 -13.914  -0.076
  211   2HB   LYS  28          1HB       LYS  28  -7.345 -13.134   0.048
  212   1HG   LYS  28          2HG       LYS  28  -6.193 -14.428  -2.413
  213   2HG   LYS  28          1HG       LYS  28  -7.464 -15.083  -1.381
  214   1HD   LYS  28          2HD       LYS  28  -8.892 -13.176  -1.935
  215   2HD   LYS  28          1HD       LYS  28  -7.620 -12.523  -2.969
  216   1HE   LYS  28          2HE       LYS  28  -9.030 -15.163  -3.346
  217   2HE   LYS  28          1HE       LYS  28  -9.327 -13.695  -4.275
  218   1HZ   LYS  28          1HZ       LYS  28  -6.582 -14.261  -4.356
  219   2HZ   LYS  28          2HZ       LYS  28  -7.692 -14.262  -5.632
  220   3HZ   LYS  28          3HZ       LYS  28  -7.418 -15.678  -4.749
  221    H    VAL  29           H        VAL  29  -3.861 -12.207   0.454
  222    HA   VAL  29           HA       VAL  29  -4.710 -10.893   2.756
  223    HB   VAL  29           HB       VAL  29  -1.880 -11.097   1.713
  224   1HG1  VAL  29          1HG1      VAL  29  -2.838 -10.745   4.547
  225   2HG1  VAL  29          2HG1      VAL  29  -2.224  -9.438   3.531
  226   3HG1  VAL  29          3HG1      VAL  29  -1.166 -10.777   3.981
  227   1HG2  VAL  29          1HG2      VAL  29  -3.639 -13.144   2.452
  228   2HG2  VAL  29          2HG2      VAL  29  -2.555 -12.933   3.826
  229   3HG2  VAL  29          3HG2      VAL  29  -1.895 -13.261   2.225
  230    H    VAL  30           H        VAL  30  -3.108  -9.663  -0.126
  231    HA   VAL  30           HA       VAL  30  -2.655  -7.032   0.796
  232    HB   VAL  30           HB       VAL  30  -3.177  -7.947  -2.041
  233   1HG1  VAL  30          1HG1      VAL  30  -3.332  -5.483  -1.587
  234   2HG1  VAL  30          2HG1      VAL  30  -2.096  -5.950  -2.755
  235   3HG1  VAL  30          3HG1      VAL  30  -1.636  -5.537  -1.103
  236   1HG2  VAL  30          1HG2      VAL  30  -1.260  -9.003  -0.602
  237   2HG2  VAL  30          2HG2      VAL  30  -0.450  -7.474  -0.939
  238   3HG2  VAL  30          3HG2      VAL  30  -0.964  -8.512  -2.270
  239    H    LYS  31           H        LYS  31  -5.346  -8.502  -1.047
  240    HA   LYS  31           HA       LYS  31  -6.924  -6.274  -1.431
  241   1HB   LYS  31          2HB       LYS  31  -7.616  -9.157  -0.989
  242   2HB   LYS  31          1HB       LYS  31  -8.887  -7.956  -1.162
  243   1HG   LYS  31          2HG       LYS  31  -8.495  -8.986  -3.284
  244   2HG   LYS  31          1HG       LYS  31  -7.925  -7.318  -3.350
  245   1HD   LYS  31          2HD       LYS  31  -5.626  -8.134  -2.931
  246   2HD   LYS  31          1HD       LYS  31  -6.238  -9.789  -2.987
  247   1HE   LYS  31          2HE       LYS  31  -6.399  -7.779  -5.229
  248   2HE   LYS  31          1HE       LYS  31  -5.237  -9.098  -5.123
  249   1HZ   LYS  31          1HZ       LYS  31  -7.163  -9.600  -6.550
  250   2HZ   LYS  31          2HZ       LYS  31  -8.182  -9.462  -5.208
  251   3HZ   LYS  31          3HZ       LYS  31  -7.011 -10.682  -5.259
  252    H    GLN  32           H        GLN  32  -6.840  -8.423   1.386
  253    HA   GLN  32           HA       GLN  32  -8.804  -7.023   2.862
  254   1HB   GLN  32          2HB       GLN  32  -8.258  -9.286   3.465
  255   2HB   GLN  32          1HB       GLN  32  -6.573  -8.877   3.720
  256   1HG   GLN  32          2HG       GLN  32  -8.792  -7.696   5.361
  257   2HG   GLN  32          1HG       GLN  32  -8.025  -9.225   5.769
  258   1HE2  GLN  32          1HE2      GLN  32  -5.458  -7.807   4.578
  259   2HE2  GLN  32          2HE2      GLN  32  -4.889  -6.918   5.938
  260    H    PHE  33           H        PHE  33  -5.312  -6.791   2.609
  261    HA   PHE  33           HA       PHE  33  -4.736  -5.006   4.646
  262   1HB   PHE  33          2HB       PHE  33  -3.102  -6.198   3.121
  263   2HB   PHE  33          1HB       PHE  33  -3.464  -4.985   1.899
  264    HD1  PHE  33           1HD      PHE  33  -2.618  -5.039   5.524
  265    HD2  PHE  33           2HD      PHE  33  -1.881  -3.323   1.688
  266    HE1  PHE  33           1HE      PHE  33  -0.934  -3.538   6.509
  267    HE2  PHE  33           2HE      PHE  33  -0.185  -1.844   2.679
  268    HZ   PHE  33           HZ       PHE  33   0.286  -1.957   5.096
  269    H    PHE  34           H        PHE  34  -5.339  -4.223   1.258
  270    HA   PHE  34           HA       PHE  34  -5.585  -1.417   1.736
  271   1HB   PHE  34          2HB       PHE  34  -6.360  -3.059  -0.677
  272   2HB   PHE  34          1HB       PHE  34  -6.325  -1.295  -0.625
  273    HD1  PHE  34           1HD      PHE  34  -3.918  -0.803   0.957
  274    HD2  PHE  34           2HD      PHE  34  -4.628  -3.631  -2.141
  275    HE1  PHE  34           1HE      PHE  34  -1.515  -0.847   0.459
  276    HE2  PHE  34           2HE      PHE  34  -2.220  -3.675  -2.648
  277    HZ   PHE  34           HZ       PHE  34  -0.669  -2.285  -1.335
  278    H    ASN  35           H        ASN  35  -7.883  -4.048   1.390
  279    HA   ASN  35           HA       ASN  35 -10.270  -2.658   1.229
  280   1HB   ASN  35          2HB       ASN  35 -10.230  -5.068   1.077
  281   2HB   ASN  35          1HB       ASN  35  -9.605  -5.209   2.717
  282   1HD2  ASN  35          1HD2      ASN  35 -12.232  -5.704   0.974
  283   2HD2  ASN  35          2HD2      ASN  35 -13.468  -5.410   2.142
  284    H    ASP  36           H        ASP  36  -8.251  -3.351   4.000
  285    HA   ASP  36           HA       ASP  36 -10.076  -1.968   5.806
  286   1HB   ASP  36          2HB       ASP  36  -7.514  -3.470   6.370
  287   2HB   ASP  36          1HB       ASP  36  -8.554  -2.753   7.598
  288    H    ASN  37           H        ASN  37  -7.065  -1.375   4.152
  289    HA   ASN  37           HA       ASN  37  -6.294   0.794   5.901
  290   1HB   ASN  37          2HB       ASN  37  -5.285   0.023   3.152
  291   2HB   ASN  37          1HB       ASN  37  -4.592   1.296   4.151
  292   1HD2  ASN  37          1HD2      ASN  37  -3.546  -1.287   3.075
  293   2HD2  ASN  37          2HD2      ASN  37  -2.892  -2.087   4.458
  294    H    GLY  38           H        GLY  38  -7.650   0.407   2.689
  295   1HA   GLY  38          2HA       GLY  38  -8.017   2.427   1.293
  296   2HA   GLY  38          1HA       GLY  38  -9.492   1.762   1.954
  297    H    VAL  39           H        VAL  39 -10.819   3.188   2.710
  298    HA   VAL  39           HA       VAL  39  -9.779   5.794   3.605
  299    HB   VAL  39           HB       VAL  39 -12.521   5.096   2.608
  300   1HG1  VAL  39          1HG1      VAL  39 -12.875   7.032   3.793
  301   2HG1  VAL  39          2HG1      VAL  39 -12.428   7.700   2.224
  302   3HG1  VAL  39          3HG1      VAL  39 -11.238   7.625   3.523
  303   1HG2  VAL  39          1HG2      VAL  39 -11.386   6.730   0.722
  304   2HG2  VAL  39          2HG2      VAL  39 -11.534   4.976   0.607
  305   3HG2  VAL  39          3HG2      VAL  39 -10.039   5.697   1.200
  306    H    ASP  40           H        ASP  40 -10.810   3.054   5.097
  307    HA   ASP  40           HA       ASP  40 -12.139   4.610   7.204
  308   1HB   ASP  40          2HB       ASP  40 -12.771   1.775   6.359
  309   2HB   ASP  40          1HB       ASP  40 -13.487   2.610   7.734
  310    H    GLY  41           H        GLY  41  -9.321   3.275   6.533
  311   1HA   GLY  41          2HA       GLY  41  -8.973   1.585   8.861
  312   2HA   GLY  41          1HA       GLY  41  -7.738   2.017   7.688
  313    H    GLU  42           H        GLU  42  -6.774   2.033  10.069
  314    HA   GLU  42           HA       GLU  42  -6.898   4.815  11.034
  315   1HB   GLU  42          2HB       GLU  42  -6.152   2.312  12.560
  316   2HB   GLU  42          1HB       GLU  42  -6.115   3.946  13.211
  317   1HG   GLU  42          2HG       GLU  42  -8.527   4.135  12.874
  318   2HG   GLU  42          1HG       GLU  42  -8.563   2.495  12.227
  319    H    TRP  43           H        TRP  43  -5.180   5.985  10.526
  320    HA   TRP  43           HA       TRP  43  -2.565   4.632  10.301
  321   1HB   TRP  43          2HB       TRP  43  -3.326   7.134   8.801
  322   2HB   TRP  43          1HB       TRP  43  -1.920   6.116   8.551
  323    HD1  TRP  43           HD       TRP  43  -4.379   3.548   8.660
  324    HE1  TRP  43           1HE      TRP  43  -5.390   3.050   6.330
  325    HE3  TRP  43           3HE      TRP  43  -2.890   7.767   6.199
  326    HZ2  TRP  43           2HZ      TRP  43  -5.528   4.278   3.811
  327    HZ3  TRP  43           3HZ      TRP  43  -3.491   8.026   3.833
  328    HH2  TRP  43           HH       TRP  43  -4.784   6.318   2.660
  329    H    THR  44           H        THR  44  -0.764   5.710  11.128
  330    HA   THR  44           HA       THR  44  -1.354   8.088  12.767
  331    HB   THR  44           HB       THR  44   0.519   7.358  14.232
  332    HG1  THR  44           1HG      THR  44   0.468   5.073  12.562
  333   1HG2  THR  44          1HG2      THR  44  -1.988   6.514  14.418
  334   2HG2  THR  44          2HG2      THR  44  -0.719   5.978  15.518
  335   3HG2  THR  44          3HG2      THR  44  -1.199   4.958  14.162
  336    H    TYR  45           H        TYR  45   0.073   9.826  12.654
  337    HA   TYR  45           HA       TYR  45   2.009   9.665  10.441
  338   1HB   TYR  45          2HB       TYR  45   0.120  11.252  10.151
  339   2HB   TYR  45          1HB       TYR  45   0.663  12.122  11.581
  340    HD1  TYR  45           1HD      TYR  45   2.829  10.688   8.935
  341    HD2  TYR  45           2HD      TYR  45   1.176  14.222  10.633
  342    HE1  TYR  45           1HE      TYR  45   4.314  12.051   7.527
  343    HE2  TYR  45           2HE      TYR  45   2.656  15.594   9.227
  344    HH   TYR  45           HH       TYR  45   4.720  15.423   8.010
  345    H    ASP  46           H        ASP  46   4.071  10.474  10.655
  346    HA   ASP  46           HA       ASP  46   4.907  11.219  13.380
  347   1HB   ASP  46          2HB       ASP  46   5.653   8.941  12.844
  348   2HB   ASP  46          1HB       ASP  46   6.433   9.533  11.380
  349    H    ASP  47           H        ASP  47   4.677  13.428  12.745
  350    HA   ASP  47           HA       ASP  47   5.685  14.742  10.583
  351   1HB   ASP  47          2HB       ASP  47   5.771  15.701  13.450
  352   2HB   ASP  47          1HB       ASP  47   5.914  16.730  12.030
  353    H    ALA  48           H        ALA  48   7.500  13.641  13.398
  354    HA   ALA  48           HA       ALA  48   9.886  14.952  13.087
  355   1HB   ALA  48          1HB       ALA  48   9.016  13.022  14.739
  356   2HB   ALA  48          2HB       ALA  48  10.706  13.512  14.613
  357   3HB   ALA  48          3HB       ALA  48  10.133  12.089  13.742
  358    H    THR  49           H        THR  49   8.665  12.270  11.179
  359    HA   THR  49           HA       THR  49  11.049  12.515   9.468
  360    HB   THR  49           HB       THR  49  10.885  10.095   8.987
  361    HG1  THR  49           1HG      THR  49   8.899  10.163  11.008
  362   1HG2  THR  49          1HG2      THR  49  11.075  10.555  11.950
  363   2HG2  THR  49          2HG2      THR  49  12.374  10.886  10.805
  364   3HG2  THR  49          3HG2      THR  49  11.786   9.238  11.020
  365    H    LYS  50           H        LYS  50   8.041  13.412   9.489
  366    HA   LYS  50           HA       LYS  50   6.335  13.661   7.981
  367   1HB   LYS  50          2HB       LYS  50   8.677  13.530   6.084
  368   2HB   LYS  50          1HB       LYS  50   7.070  14.116   5.670
  369   1HG   LYS  50          2HG       LYS  50   7.675  15.599   7.886
  370   2HG   LYS  50          1HG       LYS  50   9.242  15.442   7.090
  371   1HD   LYS  50          2HD       LYS  50   6.723  16.333   5.710
  372   2HD   LYS  50          1HD       LYS  50   7.913  17.441   6.393
  373   1HE   LYS  50          2HE       LYS  50   8.330  17.230   4.039
  374   2HE   LYS  50          1HE       LYS  50   9.630  16.422   4.913
  375   1HZ   LYS  50          1HZ       LYS  50   8.868  14.345   4.294
  376   2HZ   LYS  50          2HZ       LYS  50   8.569  15.257   2.901
  377   3HZ   LYS  50          3HZ       LYS  50   7.301  14.889   3.956
  378    H    THR  51           H        THR  51   6.745  10.981   8.800
  379    HA   THR  51           HA       THR  51   5.972   9.531   6.357
  380    HB   THR  51           HB       THR  51   7.463   8.481   8.767
  381    HG1  THR  51           1HG      THR  51   8.903   9.505   7.496
  382   1HG2  THR  51          1HG2      THR  51   7.023   6.405   8.164
  383   2HG2  THR  51          2HG2      THR  51   7.509   6.737   6.501
  384   3HG2  THR  51          3HG2      THR  51   5.846   7.030   7.010
  385    H    PHE  52           H        PHE  52   4.207   8.242   6.417
  386    HA   PHE  52           HA       PHE  52   2.555   8.377   8.854
  387   1HB   PHE  52          2HB       PHE  52   1.643   7.784   6.028
  388   2HB   PHE  52          1HB       PHE  52   0.622   8.092   7.424
  389    HD1  PHE  52           1HD      PHE  52  -0.373  10.149   7.512
  390    HD2  PHE  52           2HD      PHE  52   3.410   9.784   5.593
  391    HE1  PHE  52           1HE      PHE  52  -0.447  12.535   6.912
  392    HE2  PHE  52           2HE      PHE  52   3.344  12.169   4.999
  393    HZ   PHE  52           HZ       PHE  52   1.413  13.547   5.658
  394    H    THR  53           H        THR  53   1.594   6.459   9.646
  395    HA   THR  53           HA       THR  53   2.548   3.985   8.377
  396    HB   THR  53           HB       THR  53   2.387   3.056  10.804
  397    HG1  THR  53           1HG      THR  53   2.789   4.580  12.377
  398   1HG2  THR  53          1HG2      THR  53   4.603   4.715   9.698
  399   2HG2  THR  53          2HG2      THR  53   4.499   2.964   9.901
  400   3HG2  THR  53          3HG2      THR  53   4.725   4.005  11.308
  401    H    VAL  54           H        VAL  54   1.098   2.527   7.885
  402    HA   VAL  54           HA       VAL  54  -1.666   2.920   8.817
  403    HB   VAL  54           HB       VAL  54  -0.661   1.485   6.350
  404   1HG1  VAL  54          1HG1      VAL  54  -3.116   1.533   5.739
  405   2HG1  VAL  54          2HG1      VAL  54  -3.432   1.934   7.426
  406   3HG1  VAL  54          3HG1      VAL  54  -2.649   0.409   7.015
  407   1HG2  VAL  54          1HG2      VAL  54  -2.398   3.843   6.089
  408   2HG2  VAL  54          2HG2      VAL  54  -0.989   3.358   5.147
  409   3HG2  VAL  54          3HG2      VAL  54  -0.776   4.166   6.700
  410    H    THR  55           H        THR  55  -2.123   1.583  10.480
  411    HA   THR  55           HA       THR  55  -0.897  -1.079  10.478
  412    HB   THR  55           HB       THR  55  -2.349   0.265  12.755
  413    HG1  THR  55           1HG      THR  55  -0.272   0.791  13.499
  414   1HG2  THR  55          1HG2      THR  55  -0.511  -2.107  12.608
  415   2HG2  THR  55          2HG2      THR  55  -2.189  -2.067  13.155
  416   3HG2  THR  55          3HG2      THR  55  -0.930  -1.283  14.111
  417    H    GLU  56           H        GLU  56  -2.061  -2.684   9.700
  418    HA   GLU  56           HA       GLU  56  -4.710  -2.634   8.957
  419   1HB   GLU  56          2HB       GLU  56  -3.023  -4.355   8.305
  420   2HB   GLU  56          1HB       GLU  56  -3.181  -5.067   9.903
  421   1HG   GLU  56          2HG       GLU  56  -5.395  -4.832   7.875
  422   2HG   GLU  56          1HG       GLU  56  -4.448  -6.282   8.197
  423   1H    MET   1          1HT       MET   1   6.090  18.208  -2.947
  424   2H    MET   1          2HT       MET   1   6.062  19.635  -2.040
  425   3H    MET   1          3HT       MET   1   4.766  18.553  -1.951
  426    HA   MET   1           HA       MET   1   7.509  18.196  -0.909
  427   1HB   MET   1          2HB       MET   1   4.757  18.215   0.339
  428   2HB   MET   1          1HB       MET   1   6.226  17.799   1.208
  429   1HG   MET   1          2HG       MET   1   5.672  20.446  -0.112
  430   2HG   MET   1          1HG       MET   1   5.519  20.106   1.611
  431   1HE   MET   1          1HE       MET   1   8.057  18.139   2.018
  432   2HE   MET   1          2HE       MET   1   7.560  19.398   3.150
  433   3HE   MET   1          3HE       MET   1   9.235  19.320   2.596
  434    H    GLN   2           H        GLN   2   8.228  16.182  -0.435
  435    HA   GLN   2           HA       GLN   2   6.639  13.945  -1.465
  436   1HB   GLN   2          2HB       GLN   2   8.893  14.206  -2.395
  437   2HB   GLN   2          1HB       GLN   2   9.581  14.116  -0.780
  438   1HG   GLN   2          2HG       GLN   2   9.847  12.012  -1.935
  439   2HG   GLN   2          1HG       GLN   2   8.760  11.825  -0.559
  440   1HE2  GLN   2          1HE2      GLN   2   9.221  10.932  -3.645
  441   2HE2  GLN   2          2HE2      GLN   2   7.590  10.628  -4.126
  442    H    TYR   3           H        TYR   3   5.872  12.376  -0.159
  443    HA   TYR   3           HA       TYR   3   6.784  12.362   2.642
  444   1HB   TYR   3          2HB       TYR   3   3.945  12.040   1.650
  445   2HB   TYR   3          1HB       TYR   3   4.461  11.839   3.321
  446    HD1  TYR   3           1HD      TYR   3   4.992  13.754   4.696
  447    HD2  TYR   3           2HD      TYR   3   3.875  14.255   0.622
  448    HE1  TYR   3           1HE      TYR   3   4.665  16.159   5.087
  449    HE2  TYR   3           2HE      TYR   3   3.546  16.662   1.002
  450    HH   TYR   3           HH       TYR   3   3.480  18.036   4.138
  451    H    LYS   4           H        LYS   4   6.955  10.377   3.643
  452    HA   LYS   4           HA       LYS   4   6.800   8.072   1.823
  453   1HB   LYS   4          2HB       LYS   4   9.030   8.537   2.732
  454   2HB   LYS   4          1HB       LYS   4   8.394   8.423   4.368
  455   1HG   LYS   4          2HG       LYS   4   7.855   6.075   4.010
  456   2HG   LYS   4          1HG       LYS   4   8.462   6.183   2.356
  457   1HD   LYS   4          2HD       LYS   4  10.083   6.644   4.860
  458   2HD   LYS   4          1HD       LYS   4  10.114   5.182   3.871
  459   1HE   LYS   4          2HE       LYS   4  10.906   6.509   1.963
  460   2HE   LYS   4          1HE       LYS   4  10.900   7.953   2.973
  461   1HZ   LYS   4          1HZ       LYS   4  13.024   7.395   3.333
  462   2HZ   LYS   4          2HZ       LYS   4  12.808   5.785   2.865
  463   3HZ   LYS   4          3HZ       LYS   4  12.395   6.272   4.431
  464    H    VAL   5           H        VAL   5   4.975   6.961   2.058
  465    HA   VAL   5           HA       VAL   5   3.716   6.813   4.687
  466    HB   VAL   5           HB       VAL   5   2.661   5.882   2.011
  467   1HG1  VAL   5          1HG1      VAL   5   1.565   5.831   4.782
  468   2HG1  VAL   5          2HG1      VAL   5   1.439   4.629   3.498
  469   3HG1  VAL   5          3HG1      VAL   5   0.463   6.096   3.431
  470   1HG2  VAL   5          1HG2      VAL   5   1.080   7.951   2.753
  471   2HG2  VAL   5          2HG2      VAL   5   2.465   8.096   1.670
  472   3HG2  VAL   5          3HG2      VAL   5   2.641   8.481   3.382
  473    H    ILE   6           H        ILE   6   3.837   5.115   5.912
  474    HA   ILE   6           HA       ILE   6   5.070   2.659   4.885
  475    HB   ILE   6           HB       ILE   6   4.752   3.682   7.709
  476   1HG1  ILE   6          2HG1      ILE   6   7.198   3.250   5.982
  477   2HG1  ILE   6          1HG1      ILE   6   6.486   4.809   6.384
  478   1HG2  ILE   6          1HG2      ILE   6   4.548   1.329   7.843
  479   2HG2  ILE   6          2HG2      ILE   6   6.204   1.724   8.306
  480   3HG2  ILE   6          3HG2      ILE   6   5.867   1.079   6.699
  481   1HD1  ILE   6          1HD1      ILE   6   8.151   2.999   8.019
  482   2HD1  ILE   6          2HD1      ILE   6   6.886   3.906   8.849
  483   3HD1  ILE   6          3HD1      ILE   6   8.129   4.760   7.935
  484    H    LEU   7           H        LEU   7   3.903   0.867   4.652
  485    HA   LEU   7           HA       LEU   7   1.190   0.826   5.779
  486   1HB   LEU   7          2HB       LEU   7   2.181  -0.986   3.596
  487   2HB   LEU   7          1HB       LEU   7   0.535  -0.498   3.954
  488    HG   LEU   7           HG       LEU   7   2.682   1.206   2.710
  489   1HD1  LEU   7          1HD1      LEU   7   1.228   1.211   0.774
  490   2HD1  LEU   7          2HD1      LEU   7   0.055   0.206   1.625
  491   3HD1  LEU   7          3HD1      LEU   7   1.644  -0.443   1.222
  492   1HD2  LEU   7          1HD2      LEU   7   0.993   2.957   2.575
  493   2HD2  LEU   7          2HD2      LEU   7   1.320   2.524   4.253
  494   3HD2  LEU   7          3HD2      LEU   7  -0.145   1.941   3.463
  495    H    ASN   8           H        ASN   8   1.870   0.082   7.837
  496    HA   ASN   8           HA       ASN   8   3.207  -2.500   7.995
  497   1HB   ASN   8          2HB       ASN   8   2.313  -0.589  10.157
  498   2HB   ASN   8          1HB       ASN   8   3.135  -2.116  10.463
  499   1HD2  ASN   8          1HD2      ASN   8   3.635   1.035  10.407
  500   2HD2  ASN   8          2HD2      ASN   8   5.285   1.100   9.905
  501    H    GLY   9           H        GLY   9   1.917  -4.154   7.532
  502   1HA   GLY   9          2HA       GLY   9  -0.635  -4.359   9.009
  503   2HA   GLY   9          1HA       GLY   9  -0.408  -4.998   7.389
  504    H    LYS  10           H        LYS  10  -1.256  -6.383   9.790
  505    HA   LYS  10           HA       LYS  10   0.572  -7.908  11.104
  506   1HB   LYS  10          2HB       LYS  10  -2.060  -8.827   9.938
  507   2HB   LYS  10          1HB       LYS  10  -1.170  -9.663  11.202
  508   1HG   LYS  10          2HG       LYS  10  -1.552  -7.930  12.755
  509   2HG   LYS  10          1HG       LYS  10  -2.119  -6.829  11.498
  510   1HD   LYS  10          2HD       LYS  10  -3.962  -7.758  12.853
  511   2HD   LYS  10          1HD       LYS  10  -4.091  -8.184  11.146
  512   1HE   LYS  10          2HE       LYS  10  -3.136 -10.380  11.618
  513   2HE   LYS  10          1HE       LYS  10  -2.996  -9.959  13.325
  514   1HZ   LYS  10          1HZ       LYS  10  -5.574  -9.478  12.921
  515   2HZ   LYS  10          2HZ       LYS  10  -4.985 -10.985  13.413
  516   3HZ   LYS  10          3HZ       LYS  10  -5.342 -10.709  11.784
  517    H    THR  11           H        THR  11  -0.961  -8.885   8.033
  518    HA   THR  11           HA       THR  11   1.137 -10.862   7.614
  519    HB   THR  11           HB       THR  11  -0.455 -11.440   5.644
  520    HG1  THR  11           1HG      THR  11  -1.666  -9.459   5.950
  521   1HG2  THR  11          1HG2      THR  11  -1.038 -11.920   8.533
  522   2HG2  THR  11          2HG2      THR  11  -0.418 -13.037   7.318
  523   3HG2  THR  11          3HG2      THR  11  -2.110 -12.540   7.277
  524    H    LEU  12           H        LEU  12   0.543  -7.694   6.757
  525    HA   LEU  12           HA       LEU  12   2.295  -7.976   4.424
  526   1HB   LEU  12          2HB       LEU  12   0.014  -7.701   3.602
  527   2HB   LEU  12          1HB       LEU  12  -0.175  -6.247   4.565
  528    HG   LEU  12           HG       LEU  12   1.341  -5.039   3.203
  529   1HD1  LEU  12          1HD1      LEU  12   2.275  -7.709   2.516
  530   2HD1  LEU  12          2HD1      LEU  12   3.141  -6.182   2.545
  531   3HD1  LEU  12          3HD1      LEU  12   2.171  -6.621   1.137
  532   1HD2  LEU  12          1HD2      LEU  12  -0.011  -4.791   1.428
  533   2HD2  LEU  12          2HD2      LEU  12  -1.025  -5.960   2.275
  534   3HD2  LEU  12          3HD2      LEU  12   0.067  -6.500   1.000
  535    H    LYS  13           H        LYS  13   3.911  -6.514   4.296
  536    HA   LYS  13           HA       LYS  13   3.791  -4.078   5.905
  537   1HB   LYS  13          2HB       LYS  13   6.016  -6.109   6.174
  538   2HB   LYS  13          1HB       LYS  13   6.000  -4.512   6.913
  539   1HG   LYS  13          2HG       LYS  13   4.042  -5.136   8.231
  540   2HG   LYS  13          1HG       LYS  13   4.049  -6.735   7.487
  541   1HD   LYS  13          2HD       LYS  13   6.271  -7.158   8.425
  542   2HD   LYS  13          1HD       LYS  13   6.262  -5.558   9.167
  543   1HE   LYS  13          2HE       LYS  13   5.664  -7.284  10.785
  544   2HE   LYS  13          1HE       LYS  13   4.320  -6.178  10.505
  545   1HZ   LYS  13          1HZ       LYS  13   3.675  -8.551  10.569
  546   2HZ   LYS  13          2HZ       LYS  13   4.601  -8.820   9.181
  547   3HZ   LYS  13          3HZ       LYS  13   3.263  -7.786   9.116
  548    H    GLY  14           H        GLY  14   5.094  -2.402   5.124
  549   1HA   GLY  14          2HA       GLY  14   7.182  -2.725   3.272
  550   2HA   GLY  14          1HA       GLY  14   5.695  -2.461   2.380
  551    H    GLU  15           H        GLU  15   7.041  -0.600   1.647
  552    HA   GLU  15           HA       GLU  15   6.345   1.739   3.249
  553   1HB   GLU  15          2HB       GLU  15   9.122   1.241   2.154
  554   2HB   GLU  15          1HB       GLU  15   8.575   2.741   2.890
  555   1HG   GLU  15          2HG       GLU  15   8.197   1.572   5.000
  556   2HG   GLU  15          1HG       GLU  15   8.747   0.068   4.264
  557    H    THR  16           H        THR  16   5.848   3.533   2.050
  558    HA   THR  16           HA       THR  16   6.307   3.471  -0.829
  559    HB   THR  16           HB       THR  16   4.196   2.532  -0.913
  560    HG1  THR  16           1HG      THR  16   3.558   5.260  -0.748
  561   1HG2  THR  16          1HG2      THR  16   2.359   2.931   0.511
  562   2HG2  THR  16          2HG2      THR  16   3.151   4.319   1.253
  563   3HG2  THR  16          3HG2      THR  16   3.766   2.694   1.545
  564    H    THR  17           H        THR  17   5.546   5.610  -1.856
  565    HA   THR  17           HA       THR  17   5.711   7.846   0.019
  566    HB   THR  17           HB       THR  17   7.468   8.938  -1.356
  567    HG1  THR  17           1HG      THR  17   8.462   7.853  -2.947
  568   1HG2  THR  17          1HG2      THR  17   8.335   7.962   0.578
  569   2HG2  THR  17          2HG2      THR  17   9.358   7.367  -0.729
  570   3HG2  THR  17          3HG2      THR  17   8.112   6.327  -0.042
  571    H    THR  18           H        THR  18   4.214   9.281  -0.429
  572    HA   THR  18           HA       THR  18   3.159   9.510  -3.182
  573    HB   THR  18           HB       THR  18   1.516   8.921  -1.410
  574    HG1  THR  18           1HG      THR  18   0.935  10.237  -3.240
  575   1HG2  THR  18          1HG2      THR  18   2.274  11.584  -0.243
  576   2HG2  THR  18          2HG2      THR  18   2.379  10.002   0.529
  577   3HG2  THR  18          3HG2      THR  18   0.802  10.700   0.162
  578    H    GLU  19           H        GLU  19   3.087  11.511  -4.185
  579    HA   GLU  19           HA       GLU  19   4.700  13.620  -2.915
  580   1HB   GLU  19          2HB       GLU  19   5.516  12.837  -5.084
  581   2HB   GLU  19          1HB       GLU  19   3.957  13.185  -5.817
  582   1HG   GLU  19          2HG       GLU  19   5.565  14.902  -6.369
  583   2HG   GLU  19          1HG       GLU  19   4.272  15.563  -5.367
  584    H    ALA  20           H        ALA  20   3.547  15.200  -1.950
  585    HA   ALA  20           HA       ALA  20   1.297  16.353  -3.387
  586   1HB   ALA  20          1HB       ALA  20   0.639  14.432  -1.699
  587   2HB   ALA  20          2HB       ALA  20  -0.350  15.879  -1.896
  588   3HB   ALA  20          3HB       ALA  20   0.763  15.750  -0.533
  589    H    VAL  21           H        VAL  21   0.724  18.412  -2.737
  590    HA   VAL  21           HA       VAL  21   2.723  20.173  -2.078
  591    HB   VAL  21           HB       VAL  21  -0.187  20.654  -1.453
  592   1HG1  VAL  21          1HG1      VAL  21   0.441  22.997  -2.129
  593   2HG1  VAL  21          2HG1      VAL  21   2.125  22.475  -2.070
  594   3HG1  VAL  21          3HG1      VAL  21   1.136  22.427  -0.612
  595   1HG2  VAL  21          1HG2      VAL  21  -0.043  21.676  -3.860
  596   2HG2  VAL  21          2HG2      VAL  21  -0.353  19.953  -3.634
  597   3HG2  VAL  21          3HG2      VAL  21   1.267  20.511  -4.051
  598    H    ASP  22           H        ASP  22   0.490  18.576   0.125
  599    HA   ASP  22           HA       ASP  22   2.228  19.326   2.344
  600   1HB   ASP  22          2HB       ASP  22   0.417  20.130   3.753
  601   2HB   ASP  22          1HB       ASP  22   0.504  21.090   2.281
  602    H    ALA  23           H        ALA  23   1.447  18.223   4.439
  603    HA   ALA  23           HA       ALA  23   1.508  15.474   4.050
  604   1HB   ALA  23          1HB       ALA  23   1.772  17.147   6.202
  605   2HB   ALA  23          2HB       ALA  23   1.780  15.385   6.268
  606   3HB   ALA  23          3HB       ALA  23   0.288  16.270   6.579
  607    H    ALA  24           H        ALA  24  -1.255  17.584   4.702
  608    HA   ALA  24           HA       ALA  24  -3.167  15.524   4.958
  609   1HB   ALA  24          1HB       ALA  24  -4.448  17.267   5.484
  610   2HB   ALA  24          2HB       ALA  24  -4.399  17.825   3.812
  611   3HB   ALA  24          3HB       ALA  24  -3.174  18.366   4.961
  612    H    THR  25           H        THR  25  -2.362  17.591   2.154
  613    HA   THR  25           HA       THR  25  -4.008  16.381   0.288
  614    HB   THR  25           HB       THR  25  -2.379  17.206  -1.392
  615    HG1  THR  25           1HG      THR  25  -0.411  17.572  -0.876
  616   1HG2  THR  25          1HG2      THR  25  -2.146  19.619  -0.291
  617   2HG2  THR  25          2HG2      THR  25  -3.387  18.937   0.761
  618   3HG2  THR  25          3HG2      THR  25  -3.651  19.014  -0.982
  619    H    ALA  26           H        ALA  26  -0.704  15.580   1.282
  620    HA   ALA  26           HA       ALA  26  -0.321  13.386  -0.436
  621   1HB   ALA  26          1HB       ALA  26   0.827  13.903   2.311
  622   2HB   ALA  26          2HB       ALA  26   1.539  14.381   0.770
  623   3HB   ALA  26          3HB       ALA  26   1.405  12.673   1.187
  624    H    GLU  27           H        GLU  27  -1.396  13.514   2.971
  625    HA   GLU  27           HA       GLU  27  -1.931  10.861   3.393
  626   1HB   GLU  27          2HB       GLU  27  -2.061  12.555   5.147
  627   2HB   GLU  27          1HB       GLU  27  -3.484  13.254   4.386
  628   1HG   GLU  27          2HG       GLU  27  -4.725  11.197   4.808
  629   2HG   GLU  27          1HG       GLU  27  -3.300  10.490   5.564
  630    H    LYS  28           H        LYS  28  -4.113  13.328   2.041
  631    HA   LYS  28           HA       LYS  28  -6.340  11.680   1.650
  632   1HB   LYS  28          2HB       LYS  28  -5.435  14.103   0.086
  633   2HB   LYS  28          1HB       LYS  28  -7.022  13.360  -0.060
  634   1HG   LYS  28          2HG       LYS  28  -5.873  14.627   2.417
  635   2HG   LYS  28          1HG       LYS  28  -7.115  15.314   1.368
  636   1HD   LYS  28          2HD       LYS  28  -8.597  13.441   1.902
  637   2HD   LYS  28          1HD       LYS  28  -7.355  12.757   2.953
  638   1HE   LYS  28          2HE       LYS  28  -8.705  15.433   3.311
  639   2HE   LYS  28          1HE       LYS  28  -9.051  13.970   4.234
  640   1HZ   LYS  28          1HZ       LYS  28  -6.295  14.470   4.355
  641   2HZ   LYS  28          2HZ       LYS  28  -7.423  14.497   5.614
  642   3HZ   LYS  28          3HZ       LYS  28  -7.101  15.908   4.737
  643    H    VAL  29           H        VAL  29  -3.558  12.350  -0.417
  644    HA   VAL  29           HA       VAL  29  -4.405  11.056  -2.732
  645    HB   VAL  29           HB       VAL  29  -1.586  11.193  -1.647
  646   1HG1  VAL  29          1HG1      VAL  29  -2.511  10.861  -4.495
  647   2HG1  VAL  29          2HG1      VAL  29  -1.944   9.542  -3.471
  648   3HG1  VAL  29          3HG1      VAL  29  -0.849  10.853  -3.907
  649   1HG2  VAL  29          1HG2      VAL  29  -3.284  13.281  -2.410
  650   2HG2  VAL  29          2HG2      VAL  29  -2.187  13.043  -3.771
  651   3HG2  VAL  29          3HG2      VAL  29  -1.540  13.356  -2.160
  652    H    VAL  30           H        VAL  30  -2.873   9.788   0.173
  653    HA   VAL  30           HA       VAL  30  -2.472   7.148  -0.742
  654    HB   VAL  30           HB       VAL  30  -3.012   8.074   2.087
  655   1HG1  VAL  30          1HG1      VAL  30  -3.219   5.615   1.630
  656   2HG1  VAL  30          2HG1      VAL  30  -1.989   6.053   2.816
  657   3HG1  VAL  30          3HG1      VAL  30  -1.517   5.627   1.170
  658   1HG2  VAL  30          1HG2      VAL  30  -1.050   9.085   0.675
  659   2HG2  VAL  30          2HG2      VAL  30  -0.282   7.535   1.024
  660   3HG2  VAL  30          3HG2      VAL  30  -0.788   8.585   2.347
  661    H    LYS  31           H        LYS  31  -5.152   8.681   1.061
  662    HA   LYS  31           HA       LYS  31  -6.789   6.493   1.423
  663   1HB   LYS  31          2HB       LYS  31  -7.406   9.393   0.971
  664   2HB   LYS  31          1HB       LYS  31  -8.707   8.221   1.128
  665   1HG   LYS  31          2HG       LYS  31  -8.319   9.243   3.254
  666   2HG   LYS  31          1HG       LYS  31  -7.791   7.561   3.328
  667   1HD   LYS  31          2HD       LYS  31  -5.466   8.321   2.942
  668   2HD   LYS  31          1HD       LYS  31  -6.038   9.990   2.991
  669   1HE   LYS  31          2HE       LYS  31  -6.282   7.985   5.230
  670   2HE   LYS  31          1HE       LYS  31  -5.087   9.276   5.139
  671   1HZ   LYS  31          1HZ       LYS  31  -7.019   9.825   6.540
  672   2HZ   LYS  31          2HZ       LYS  31  -8.023   9.712   5.183
  673   3HZ   LYS  31          3HZ       LYS  31  -6.822  10.902   5.249
  674    H    GLN  32           H        GLN  32  -6.612   8.639  -1.391
  675    HA   GLN  32           HA       GLN  32  -8.590   7.287  -2.897
  676   1HB   GLN  32          2HB       GLN  32  -7.979   9.535  -3.489
  677   2HB   GLN  32          1HB       GLN  32  -6.303   9.086  -3.722
  678   1HG   GLN  32          2HG       GLN  32  -8.526   7.958  -5.394
  679   2HG   GLN  32          1HG       GLN  32  -7.718   9.469  -5.790
  680   1HE2  GLN  32          1HE2      GLN  32  -5.201   7.989  -4.564
  681   2HE2  GLN  32          2HE2      GLN  32  -4.634   7.086  -5.916
  682    H    PHE  33           H        PHE  33  -5.109   6.970  -2.593
  683    HA   PHE  33           HA       PHE  33  -4.546   5.172  -4.622
  684   1HB   PHE  33          2HB       PHE  33  -2.906   6.324  -3.074
  685   2HB   PHE  33          1HB       PHE  33  -3.314   5.120  -1.857
  686    HD1  PHE  33           1HD      PHE  33  -2.416   5.153  -5.470
  687    HD2  PHE  33           2HD      PHE  33  -1.776   3.419  -1.624
  688    HE1  PHE  33           1HE      PHE  33  -0.756   3.612  -6.431
  689    HE2  PHE  33           2HE      PHE  33  -0.102   1.899  -2.591
  690    HZ   PHE  33           HZ       PHE  33   0.406   2.001  -5.002
  691    H    PHE  34           H        PHE  34  -5.217   4.403  -1.244
  692    HA   PHE  34           HA       PHE  34  -5.524   1.605  -1.724
  693   1HB   PHE  34          2HB       PHE  34  -6.292   3.265   0.676
  694   2HB   PHE  34          1HB       PHE  34  -6.300   1.500   0.624
  695    HD1  PHE  34           1HD      PHE  34  -3.883   0.949  -0.923
  696    HD2  PHE  34           2HD      PHE  34  -4.568   3.796   2.165
  697    HE1  PHE  34           1HE      PHE  34  -1.488   0.935  -0.391
  698    HE2  PHE  34           2HE      PHE  34  -2.167   3.782   2.707
  699    HZ   PHE  34           HZ       PHE  34  -0.632   2.354   1.416
  700    H    ASN  35           H        ASN  35  -7.761   4.291  -1.412
  701    HA   ASN  35           HA       ASN  35 -10.184   2.960  -1.284
  702   1HB   ASN  35          2HB       ASN  35 -10.087   5.368  -1.131
  703   2HB   ASN  35          1HB       ASN  35  -9.436   5.494  -2.763
  704   1HD2  ASN  35          1HD2      ASN  35 -12.074   6.054  -1.057
  705   2HD2  ASN  35          2HD2      ASN  35 -13.301   5.788  -2.241
  706    H    ASP  36           H        ASP  36  -8.109   3.602  -4.027
  707    HA   ASP  36           HA       ASP  36  -9.941   2.263  -5.859
  708   1HB   ASP  36          2HB       ASP  36  -7.336   3.702  -6.386
  709   2HB   ASP  36          1HB       ASP  36  -8.376   3.012  -7.628
  710    H    ASN  37           H        ASN  37  -6.969   1.598  -4.161
  711    HA   ASN  37           HA       ASN  37  -6.228  -0.590  -5.899
  712   1HB   ASN  37          2HB       ASN  37  -5.238   0.158  -3.137
  713   2HB   ASN  37          1HB       ASN  37  -4.564  -1.132  -4.126
  714   1HD2  ASN  37          1HD2      ASN  37  -3.470   1.425  -3.036
  715   2HD2  ASN  37          2HD2      ASN  37  -2.778   2.210  -4.409
  716    H    GLY  38           H        GLY  38  -7.617  -0.169  -2.707
  717   1HA   GLY  38          2HA       GLY  38  -8.055  -2.179  -1.317
  718   2HA   GLY  38          1HA       GLY  38  -9.503  -1.479  -1.999
  719    H    VAL  39           H        VAL  39 -10.854  -2.872  -2.773
  720    HA   VAL  39           HA       VAL  39  -9.865  -5.502  -3.655
  721    HB   VAL  39           HB       VAL  39 -12.603  -4.739  -2.697
  722   1HG1  VAL  39          1HG1      VAL  39 -12.988  -6.665  -3.886
  723   2HG1  VAL  39          2HG1      VAL  39 -12.579  -7.345  -2.311
  724   3HG1  VAL  39          3HG1      VAL  39 -11.368  -7.298  -3.593
  725   1HG2  VAL  39          1HG2      VAL  39 -11.534  -6.399  -0.795
  726   2HG2  VAL  39          2HG2      VAL  39 -11.642  -4.641  -0.680
  727   3HG2  VAL  39          3HG2      VAL  39 -10.155  -5.399  -1.254
  728    H    ASP  40           H        ASP  40 -10.809  -2.740  -5.160
  729    HA   ASP  40           HA       ASP  40 -12.144  -4.263  -7.286
  730   1HB   ASP  40          2HB       ASP  40 -12.718  -1.412  -6.451
  731   2HB   ASP  40          1HB       ASP  40 -13.436  -2.230  -7.836
  732    H    GLY  41           H        GLY  41  -9.305  -2.997  -6.575
  733   1HA   GLY  41          2HA       GLY  41  -8.883  -1.316  -8.898
  734   2HA   GLY  41          1HA       GLY  41  -7.676  -1.778  -7.709
  735    H    GLU  42           H        GLU  42  -6.679  -1.817 -10.075
  736    HA   GLU  42           HA       GLU  42  -6.856  -4.596 -11.042
  737   1HB   GLU  42          2HB       GLU  42  -6.029  -2.111 -12.556
  738   2HB   GLU  42          1HB       GLU  42  -6.022  -3.745 -13.208
  739   1HG   GLU  42          2HG       GLU  42  -8.442  -3.876 -12.904
  740   2HG   GLU  42          1HG       GLU  42  -8.448  -2.237 -12.259
  741    H    TRP  43           H        TRP  43  -5.175  -5.806 -10.510
  742    HA   TRP  43           HA       TRP  43  -2.531  -4.517 -10.249
  743   1HB   TRP  43          2HB       TRP  43  -3.373  -7.000  -8.759
  744   2HB   TRP  43          1HB       TRP  43  -1.946  -6.015  -8.489
  745    HD1  TRP  43           HD       TRP  43  -4.341  -3.390  -8.632
  746    HE1  TRP  43           1HE      TRP  43  -5.372  -2.867  -6.316
  747    HE3  TRP  43           3HE      TRP  43  -2.990  -7.644  -6.150
  748    HZ2  TRP  43           2HZ      TRP  43  -5.576  -4.090  -3.800
  749    HZ3  TRP  43           3HZ      TRP  43  -3.631  -7.888  -3.793
  750    HH2  TRP  43           HH       TRP  43  -4.899  -6.147  -2.639
  751    H    THR  44           H        THR  44  -0.745  -5.639 -11.049
  752    HA   THR  44           HA       THR  44  -1.370  -8.002 -12.697
  753    HB   THR  44           HB       THR  44   0.541  -7.319 -14.134
  754    HG1  THR  44           1HG      THR  44   0.522  -5.032 -12.466
  755   1HG2  THR  44          1HG2      THR  44  -1.942  -6.414 -14.357
  756   2HG2  THR  44          2HG2      THR  44  -0.643  -5.908 -15.439
  757   3HG2  THR  44          3HG2      THR  44  -1.119  -4.878 -14.089
  758    H    TYR  45           H        TYR  45   0.014  -9.774 -12.564
  759    HA   TYR  45           HA       TYR  45   1.920  -9.660 -10.324
  760   1HB   TYR  45          2HB       TYR  45  -0.010 -11.201 -10.060
  761   2HB   TYR  45          1HB       TYR  45   0.532 -12.083 -11.482
  762    HD1  TYR  45           1HD      TYR  45   2.696 -10.702  -8.806
  763    HD2  TYR  45           2HD      TYR  45   0.979 -14.195 -10.528
  764    HE1  TYR  45           1HE      TYR  45   4.125 -12.101  -7.378
  765    HE2  TYR  45           2HE      TYR  45   2.406 -15.603  -9.103
  766    HH   TYR  45           HH       TYR  45   4.456 -15.483  -7.857
  767    H    ASP  46           H        ASP  46   3.965 -10.519 -10.509
  768    HA   ASP  46           HA       ASP  46   4.821 -11.284 -13.221
  769   1HB   ASP  46          2HB       ASP  46   5.615  -9.025 -12.675
  770   2HB   ASP  46          1HB       ASP  46   6.361  -9.636 -11.201
  771    H    ASP  47           H        ASP  47   4.528 -13.488 -12.590
  772    HA   ASP  47           HA       ASP  47   5.474 -14.826 -10.415
  773   1HB   ASP  47          2HB       ASP  47   5.578 -15.786 -13.280
  774   2HB   ASP  47          1HB       ASP  47   5.676 -16.819 -11.858
  775    H    ALA  48           H        ALA  48   7.354 -13.769 -13.203
  776    HA   ALA  48           HA       ALA  48   9.704 -15.137 -12.859
  777   1HB   ALA  48          1HB       ALA  48   8.905 -13.186 -14.522
  778   2HB   ALA  48          2HB       ALA  48  10.580 -13.717 -14.373
  779   3HB   ALA  48          3HB       ALA  48  10.030 -12.282 -13.509
  780    H    THR  49           H        THR  49   8.520 -12.428 -10.968
  781    HA   THR  49           HA       THR  49  10.875 -12.729  -9.224
  782    HB   THR  49           HB       THR  49  10.762 -10.305  -8.744
  783    HG1  THR  49           1HG      THR  49   8.805 -10.326 -10.794
  784   1HG2  THR  49          1HG2      THR  49  10.984 -10.770 -11.706
  785   2HG2  THR  49          2HG2      THR  49  12.258 -11.133 -10.541
  786   3HG2  THR  49          3HG2      THR  49  11.713  -9.470 -10.764
  787    H    LYS  50           H        LYS  50   7.847 -13.552  -9.288
  788    HA   LYS  50           HA       LYS  50   6.113 -13.760  -7.804
  789   1HB   LYS  50          2HB       LYS  50   8.431 -13.686  -5.874
  790   2HB   LYS  50          1HB       LYS  50   6.805 -14.232  -5.482
  791   1HG   LYS  50          2HG       LYS  50   7.404 -15.729  -7.690
  792   2HG   LYS  50          1HG       LYS  50   8.964 -15.611  -6.872
  793   1HD   LYS  50          2HD       LYS  50   6.404 -16.439  -5.527
  794   2HD   LYS  50          1HD       LYS  50   7.576 -17.577  -6.194
  795   1HE   LYS  50          2HE       LYS  50   7.966 -17.375  -3.834
  796   2HE   LYS  50          1HE       LYS  50   9.297 -16.600  -4.691
  797   1HZ   LYS  50          1HZ       LYS  50   8.575 -14.506  -4.081
  798   2HZ   LYS  50          2HZ       LYS  50   8.235 -15.409  -2.695
  799   3HZ   LYS  50          3HZ       LYS  50   6.991 -15.010  -3.766
  800    H    THR  51           H        THR  51   6.600 -11.091  -8.617
  801    HA   THR  51           HA       THR  51   5.828  -9.623  -6.183
  802    HB   THR  51           HB       THR  51   7.377  -8.609  -8.574
  803    HG1  THR  51           1HG      THR  51   8.775  -9.667  -7.282
  804   1HG2  THR  51          1HG2      THR  51   6.981  -6.523  -7.976
  805   2HG2  THR  51          2HG2      THR  51   7.434  -6.866  -6.306
  806   3HG2  THR  51          3HG2      THR  51   5.771  -7.119  -6.839
  807    H    PHE  52           H        PHE  52   4.095  -8.291  -6.269
  808    HA   PHE  52           HA       PHE  52   2.475  -8.386  -8.729
  809   1HB   PHE  52          2HB       PHE  52   1.538  -7.769  -5.916
  810   2HB   PHE  52          1HB       PHE  52   0.529  -8.054  -7.327
  811    HD1  PHE  52           1HD      PHE  52  -0.512 -10.085  -7.429
  812    HD2  PHE  52           2HD      PHE  52   3.249  -9.812  -5.457
  813    HE1  PHE  52           1HE      PHE  52  -0.654 -12.470  -6.830
  814    HE2  PHE  52           2HE      PHE  52   3.117 -12.194  -4.864
  815    HZ   PHE  52           HZ       PHE  52   1.163 -13.525  -5.550
  816    H    THR  53           H        THR  53   1.573  -6.445  -9.534
  817    HA   THR  53           HA       THR  53   2.568  -3.996  -8.251
  818    HB   THR  53           HB       THR  53   2.465  -3.062 -10.680
  819    HG1  THR  53           1HG      THR  53   2.851  -4.596 -12.248
  820   1HG2  THR  53          1HG2      THR  53   4.625  -4.775  -9.544
  821   2HG2  THR  53          2HG2      THR  53   4.566  -3.023  -9.746
  822   3HG2  THR  53          3HG2      THR  53   4.786  -4.068 -11.151
  823    H    VAL  54           H        VAL  54   1.148  -2.502  -7.779
  824    HA   VAL  54           HA       VAL  54  -1.612  -2.827  -8.750
  825    HB   VAL  54           HB       VAL  54  -0.608  -1.418  -6.270
  826   1HG1  VAL  54          1HG1      VAL  54  -3.070  -1.405  -5.692
  827   2HG1  VAL  54          2HG1      VAL  54  -3.372  -1.799  -7.384
  828   3HG1  VAL  54          3HG1      VAL  54  -2.559  -0.293  -6.963
  829   1HG2  VAL  54          1HG2      VAL  54  -2.405  -3.731  -6.034
  830   2HG2  VAL  54          2HG2      VAL  54  -0.998  -3.282  -5.072
  831   3HG2  VAL  54          3HG2      VAL  54  -0.783  -4.094  -6.622
  832    H    THR  55           H        THR  55  -2.012  -1.481 -10.420
  833    HA   THR  55           HA       THR  55  -0.723   1.152 -10.401
  834    HB   THR  55           HB       THR  55  -2.174  -0.157 -12.696
  835    HG1  THR  55           1HG      THR  55  -0.100  -0.734 -13.412
  836   1HG2  THR  55          1HG2      THR  55  -0.281   2.169 -12.525
  837   2HG2  THR  55          2HG2      THR  55  -1.952   2.170 -13.096
  838   3HG2  THR  55          3HG2      THR  55  -0.699   1.355 -14.034
  839    H    GLU  56           H        GLU  56  -1.857   2.783  -9.639
  840    HA   GLU  56           HA       GLU  56  -4.517   2.798  -8.932
  841   1HB   GLU  56          2HB       GLU  56  -2.799   4.478  -8.255
  842   2HB   GLU  56          1HB       GLU  56  -2.916   5.194  -9.857
  843   1HG   GLU  56          2HG       GLU  56  -5.164   5.014  -7.860
  844   2HG   GLU  56          1HG       GLU  56  -4.179   6.440  -8.169