<PRE>
*HEADER    TOXIN                                   09-OCT-11   2LKB              
*TITLE     EVOLUTIONARY DIVERSIFICATION OF MESOBUTHUS ALPHA-SCORPION TOXINS      
*TITLE    2 AFFECTING SODIUM CHANNELS                                            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NEUROTOXIN MEUNATX-5;                                      
*COMPND   3 CHAIN: A                                                             
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: MESOBUTHUS EUPEUS;                              
*SOURCE   3 ORGANISM_COMMON: LESSER ASIAN SCORPION;                              
*SOURCE   4 ORGANISM_TAXID: 34648                                                
*KEYWDS    MESOBUTHUS ALPHA-SCORPION, TOXIN                                      
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    S.ZHU, S.PEIGNEUR, B.GAO, X.LU, C.CAO, J.TYTGAT                       
*REVDAT   1   02-NOV-11 2LKB    0                                                


!A1

!inter

!!! assign (resid 1 and name HA) (resid 55 and name HB#) 1.8 0.0 4.2  !! later

assign (resid 1 and name HA) (resid 2 and name HG#) 1.8 0.0 4.2

assign (resid 1 and name HA) (resid 2 and name HN) 1.8 0.0 1.7

assign (resid 1 and name HA) (resid 2 and name HB#) 1.8 0.0 4.2 

assign (resid 1 and name HB#) (resid 52 and name HB#) 1.8 0.0 4.2 


!R2

!intra

assign (resid 2 and name HA) (resid 2 and name HD#) 1.8 0.0 4.2 
assign (resid 2 and name HA) (resid 2 and name HG#) 1.8 0.0 4.2 


assign (resid 2 and name HB1) (resid 2 and name HA) 1.8 0.0 1.7
assign (resid 2 and name HB2) (resid 2 and name HA) 1.8 0.0 1.7


assign (resid 2 and name HB#) (resid 2 and name HD#) 1.8 0.0 4.2 

assign (resid 2 and name HD#) (resid 2 and name HN) 1.8 0.0 4.2

assign (resid 2 and name HD#) (resid 2 and name HG#) 1.8 0.0 4.2

assign (resid 2 and name HG#) (resid 2 and name HN) 1.8 0.0 4.2

assign (resid 2 and name HA) (resid 2 and name HN) 1.8 0.0 4.2

assign (resid 2 and name HB#) (resid 2 and name HN) 1.8 0.0 4.2 


!inter

assign (resid 2 and name HN) (resid 3 and name HN) 1.8 0.0 4.2


assign (resid 2 and name HA) (resid 3 and name HN) 1.8 0.0 1.7

assign (resid 2 and name HA) (resid 50 and name HN) 1.8 0.0 4.2 

assign (resid 2 and name HA) (resid 51 and name HA) 1.8 0.0 3.2   !! later

assign (resid 2 and name HA) (resid 50 and name HB# ) 1.8 0.0 4.2 


assign (resid 2 and name HB#) (resid 1 and name HA) 1.8 0.0 4.2

!!! assign (resid 2 and name HB#) (resid 49 and name HZ2) 1.8 0.0 4.2

!!! assign (resid 2 and name HB1) (resid 54 and name HB#) 1.8 0.0 4.2
!!! assign (resid 2 and name HB#) (resid 54 and name HB#) 1.8 0.0 4.2

assign (resid 2 and name HB#) (resid 3 and name HN) 1.8 0.0 4.2

assign (resid 2 and name HB#) (resid 52 and name HN) 1.8 0.0 4.2 


assign (resid 2 and name HG#) (resid 3 and name HB#) 1.8 0.0 4.2 

assign (resid 2 and name HG#) (resid 4 and name HA) 1.8 0.0 4.2 


assign (resid 2 and name HD#) (resid 3 and name HB#) 1.8 0.0 4.2 


!D3

!intra

assign (resid 3 and name HA) (resid 3 and name HN) 1.8 0.0 1.1

assign (resid 3 and name HB1) (resid 3 and name HN) 1.8 0.0 4.2
assign (resid 3 and name HB2) (resid 3 and name HN) 1.8 0.0 4.2


!inter

assign (resid 3 and name HA) (resid 2 and name HB#) 1.8 0.0 4.2 

assign (resid 3 and name HA) (resid 6 and name HB#) 1.8 0.0 4.2

assign (resid 3 and name HN) (resid 51 and name HA) 1.8 0.0 4.2

assign (resid 3 and name HN) (resid 50 and name HN) 1.8 0.0 4.2

assign (resid 3 and name HA) (resid 4 and name HN) 1.8 0.0 1.7

assign (resid 3 and name HB#) (resid 49 and name HA) 1.8 0.0 4.2

!!! assign (resid 3 and name HB#) (resid 53 and name HA) 1.8 0.0 4.2 


!A4

!intra

assign (resid 4 and name HA) (resid 4 and name HN) 1.8 0.0 1.1

assign (resid 4 and name HB#) (resid 4 and name HN) 1.8 0.0 1.1


!inter


assign (resid 4 and name HN) (resid 5 and name HN) 1.8 0.0 4.2

!!!  assign (resid 4 and name HN) (resid 48 and name HN) 1.8 0.0 4.2


assign (resid 4 and name HA) (resid 5 and name HN) 1.8 0.0 1.7


assign (resid 4 and name HA) (resid 5 and name HE# ) 1.8 0.0 4.2 

assign (resid 4 and name HA) (resid 49 and name HA) 1.8 0.0 1.7

assign (resid 4 and name HA) (resid 49 and name HD1) 1.8 0.0 4.2 

assign (resid 4 and name HA) (resid 50 and name HN) 1.8 0.0 4.2  ! d2o


assign (resid 4 and name HB#) (resid 3 and name HN) 1.8 0.0 4.2

assign (resid 4 and name HB#) (resid 2 and name HB#) 1.8 0.0 4.2

!! assign (resid 4 and name HB#) (resid 49 and name HN) 1.8 0.0 4.2 

!! assign (resid 4 and name HB#) (resid 49 and name HZ2) 1.8 0.0 4.2

! assign (resid 4 and name HB#) (resid 49 and name HH2) 1.8 0.0 4.2 

assign (resid 4 and name HB#) (resid 5 and name HE#) 1.8 0.0 4.2


! assign (resid 4 and name HB#) (resid 53 and name HB#) 1.8 0.0 4.2 

assign (resid 4 and name HB#) (resid 5 and name HB#) 1.8 0.0 4.2 

!!!! assign (resid 4 and name HB#) (resid 33 and name HA) 1.8 0.0 4.2 

!!! assign (resid 4 and name HB#) (resid 37 and name HE#) 1.8 0.0 4.2 

!assign (resid 4 and name HB#) (resid 51 and name HB) 1.8 0.0 4.2 

!assign (resid 4 and name HB#) (resid 61 and name HN) 1.8 0.0 4.2 


!Y5

!intra

assign (resid 5 and name HA) (resid 5 and name HN) 1.8 0.0 1.7 

assign (resid 5 and name HB#) (resid 5 and name HD#) 1.8 0.0 1.7

assign (resid 5 and name HB#) (resid 5 and name HE#) 1.8 0.0 4.2

assign (resid 5 and name HB#) (resid 5 and name HN) 1.8 0.0 1.7


!inter

! assign (resid 5 and name HN) (resid 4 and name HN) 1.8 0.0 4.2

!assign (resid 5 and name HA) (resid 49 and name HZ2) 1.8 0.0 4.2

assign (resid 5 and name HA) (resid 48 and name HB#) 1.8 0.0 4.2

assign (resid 5 and name HB#) (resid 41 and name HG) 1.8 0.0 4.2 

!!! assign (resid 5 and name HB#) (resid 49 and name HD1) 1.8 0.0 4.2 

!assign (resid 5 and name HB#) (resid 52 and name HA) 1.8 0.0 4.2 


assign (resid 5 and name HB#) (resid 6 and name HN) 1.8 0.0 4.2

! assign (resid 5 and name HD#) (resid 23 and name HA) 1.8 0.0 4.2

! assign (resid 5 and name HD#) ((resid 44 or resid 66) and name HN) 1.8 0.0 4.2


!I6

!intra

assign (resid 6 and name HA) (resid 6 and name HN) 1.8 0.0 1.1

assign (resid 6 and name HB) (resid 6 and name HN) 1.8 0.0 4.2

assign (resid 6 and name HB) (resid 6 and name HA) 1.8 0.0 1.7

assign (resid 6 and name HD1#) (resid 6 and name HB) 1.8 0.0 1.7

assign (resid 6 and name HD1#) (resid 6 and name HN) 1.8 0.0 4.2

assign (resid 6 and name HG2#) (resid 6 and name HN) 1.8 0.0 4.2

assign (resid 6 and name HG1#) (resid 6 and name HA) 1.8 0.0 4.2 

!inter

assign (resid 6 and name HA) (resid 7 and name HN) 1.8 0.0 1.7

assign (resid 6 and name HA) (resid 8 and name HG2) 1.8 0.0 4.2 

assign (resid 6 and name HA) (resid 12 and name HB#) 1.8 0.0 4.2

assign (resid 6 and name HA) (resid 13 and name HA) 1.8 0.0 4.2

assign (resid 6 and name HA) (resid 13 and name HB#) 1.8 0.0 4.2


assign (resid 6 and name HD1#) (resid 7 and name HB#) 1.8 0.0 4.2

assign (resid 6 and name HD1#) (resid 7 and name HN) 1.8 0.0 4.2 


assign (resid 6 and name HG1#) (resid 4 and name HN) 1.8 0.0 4.2

assign (resid 6 and name HG2#) (resid 13 and name HN) 1.8 0.0 4.2

assign (resid 6 and name HG2#) (resid 5 and name HD#) 1.8 0.0 4.2


assign (resid 6 and name HB#) (resid 5 and name HN) 1.8 0.0 4.2

assign (resid 6 and name HB#) (resid 13 and name HN) 1.8 0.0 4.2 

!! assign (resid 6 and name HB#) (resid 48 and name HN) 1.8 0.0 4.2 

!nassign (resid 6 and name HB#) (resid 49 and name HA) 1.8 0.0 4.2 


!A7

!intra

assign (resid 7 and name HA) (resid 7 and name HN) 1.8 0.0 1.1

assign (resid 7 and name HB#) (resid 7 and name HN) 1.8 0.0 1.1


!inter

! assign (resid 7 and name HN) (resid 12 and name HN) 1.8 0.0 4.2

assign (resid 7 and name HN) (resid 13 and name HB) 1.8 0.0 4.2

assign (resid 7 and name HA) (resid 8 and name HN) 1.8 0.0 1.7

assign (resid 7 and name HA) (resid 6 and name HN) 1.8 0.0 4.2


assign (resid 7 and name HB#) (resid 6 and name HG2#) 1.8 0.0 4.2

!!! assign (resid 7 and name HB#) (resid 5 and name HD#) 1.8 0.0 4.2 

assign (resid 7 and name HB#) (resid 8 and name HB#) 1.8 0.0 4.2  

assign (resid 7 and name HB#) (resid 8 and name HZ#) 1.8 0.0 4.2   

assign (resid 7 and name HB#) (resid 12 and name HA) 1.8 0.0 4.2

assign (resid 7 and name HB#) (resid 13 and name HB) 1.8 0.0 4.2


!K8

!intra

assign (resid 8 and name HA) (resid 8 and name HN) 1.8 0.0 1.1

assign (resid 8 and name HB#) (resid 8 and name HN) 1.8 0.0 1.7

assign (resid 8 and name HG#) (resid 8 and name HN) 1.8 0.0 4.2

assign (resid 8 and name HG#) (resid 8 and name HA) 1.8 0.0 4.2 


assign (resid 8 and name HE#) (resid 8 and name HZ#) 1.8 0.0 1.1

assign (resid 8 and name HE#) (resid 8 and name HN) 1.8 0.0 4.2


!inter


assign (resid 8 and name HA) (resid 12 and name HA) 1.8 0.0 4.2 


assign (resid 8 and name HB#) (resid 10 and name HN) 1.8 0.0 4.2

assign (resid 8 and name HB#) (resid 9 and name HG#) 1.8 0.0 4.2

assign (resid 8 and name HB#) (resid 7 and name HN) 1.8 0.0 4.2

assign (resid 8 and name HB#) (resid 12 and name HA) 1.8 0.0 4.2

assign (resid 8 and name HB#) (resid 12 and name HB#) 1.8 0.0 4.2  

assign (resid 8 and name HB#) (resid 12 and name HN) 1.8 0.0 4.2 

!!! assign (resid 8 and name HB#) (resid 13 and name HB#) 1.8 0.0 4.2 


assign (resid 8 and name HG#) (resid 13 and name HN) 1.8 0.0 4.2


assign (resid 8 and name HD#) (resid 12 and name HB#) 1.8 0.0 4.2  


assign (resid 8 and name HE#) (resid 10 and name HN) 1.8 0.0 4.2

assign (resid 8 and name HE#) (resid 11 and name HD2#) 1.8 0.0 4.2

assign (resid 8 and name HN) (resid 27 and name HG1#) 1.8 0.0 4.2 

assign (resid 8 and name HG#) (resid 12 and name HA) 1.8 0.0 4.2 

!assign (resid 8 and name HG#) (resid 13 and name HA) 1.8 0.0 4.2 


!P9

!intra

assign (resid 9 and name HD#) (resid 9 and name HA) 1.8 0.0 1.7

assign (resid 9 and name HG#) (resid 9 and name HA) 1.8 0.0 1.7


!inter

assign (resid 9 and name HA) (resid 10 and name HN) 1.8 0.0 4.2


assign (resid 9 and name HA) (resid 10 and name HD1) 1.8 0.0 4.2
! 20110312

assign (resid 9 and name HA) (resid 8 and name HN) 1.8 0.0 4.2

assign (resid 9 and name HA) (resid 11 and name HN) 1.8 0.0 4.2

assign (resid 9 and name HA) (resid 10 and name HN) 1.8 0.0 4.2

assign (resid 9 and name HA) (resid 11 and name HD2#) 1.8 0.0 4.2


assign (resid 9 and name HG#) (resid 10 and name HB#) 1.8 0.0 4.2


!H10

!intra

assign (resid 10 and name HA) (resid 10 and name HD1) 1.8 0.0 4.2

assign (resid 10 and name HA) (resid 10 and name HN) 1.8 0.0 1.1

assign (resid 10 and name HB#) (resid 10 and name HN) 1.8 0.0 1.7

! assign (resid 10 and name HD#) (resid 10 and name HE#) 1.8 0.0 1.1


!inter


! assign (resid 10 and name HA) (resid 64 and name HN) 1.8 0.0 4.2

!!! assign (resid 10 and name HB#) (resid 8 and name HG#) 1.8 0.0 4.2 

assign (resid 10 and name HB#) (resid 11 and name HB#) 1.8 0.0 4.2

! assign (resid 10 and name HB#) (resid 64 and name HG#) 1.8 0.0 4.2


assign (resid 10 and name HD#) (resid 11 and name HD2#) 1.8 0.0 4.2

assign (resid 10 and name HD#) (resid 61 and name HG#) 1.8 0.0 4.2

assign (resid 10 and name HA) (resid 9 and name HA) 1.8 0.0 4.2
! 20110312

assign (resid 10 and name HA) (resid 60 and name HN) 1.8 0.0 4.2

assign (resid 10 and name HN) (resid 8 and name HA) 1.8 0.0 4.2 


!N11

!intra

assign (resid 11 and name HN) (resid 11 and name HD2#) 1.8 0.0 4.2

assign (resid 11 and name HB#) (resid 11 and name HN) 1.8 0.0 1.7


!inter

!assign (resid 11 and name HN) (resid 12 and name HN) 1.8 0.0 1.1  ! repeated


!C12

!intra

assign (resid 12 and name HA) (resid 12 and name HN) 1.8 0.0 4.2

assign (resid 12 and name HB#) (resid 12 and name HN) 1.8 0.0 1.7


!inter

assign (resid 12 and name HN) (resid 7 and name HN) 1.8 0.0 4.2

assign (resid 12 and name HN) (resid 11 and name HN) 1.8 0.0 4.2

assign (resid 12 and name HA) (resid 13 and name HN) 1.8 0.0 1.7

assign (resid 12 and name HB#) (resid 8 and name HE#) 1.8 0.0 4.2

assign (resid 12 and name HB#) (resid 13 and name HA) 1.8 0.0 4.2 


assign (resid 12 and name HA) (resid 13 and name HB) 1.8 0.0 4.2 

!!! assign (resid 12 and name HA) (resid 10 and name HA) 1.8 0.0 4.2 

!!! assign (resid 12 and name HA) (resid 14 and name HA) 1.8 0.0 4.2 


!V13

!intra

assign (resid 13 and name HB) (resid 13 and name HN) 1.8 0.0 4.2

assign (resid 13 and name HG#) (resid 13 and name HB) 1.8 0.0 1.7

assign (resid 13 and (name HG1# or name HG2#)) (resid 13 and name HN) 1.8 0.0 1.7

assign (resid 13 and (name HG1# or name HG2#)) (resid 13 and name HA) 1.8 0.0 1.7 


!inter(correct)


assign (resid 13 and name HN) (resid 7 and name HN) 1.8 0.0 4.2

!assign (resid 13 and name HN) (resid 48 and name HN) 1.8 0.0 4.2

!assign (resid 13 and name HN) (resid 43 and name HB#) 1.8 0.0 4.2


assign (resid 13 and name HA) (resid 7 and name HN) 1.8 0.0 4.2

assign (resid 13 and name HA) (resid 12 and name HB#) 1.8 0.0 4.2 

assign (resid 13 and name HA) (resid 14 and name HE#) 1.8 0.0 4.2


assign (resid 13 and name HB) (resid 14 and name HN) 1.8 0.0 4.2

assign (resid 13 and name HB) (resid 15 and name HN) 1.8 0.0 4.2

assign (resid 13 and name HB) (resid 12 and name HA) 1.8 0.0 4.2 

assign (resid 13 and name HB) (resid 47 and name HN) 1.8 0.0 4.2 


assign (resid 13 and name HG1#) (resid 8 and name HG#) 1.8 0.0 4.2

!!! assign (resid 13 and name HG1#) (resid 11 and name HB#) 1.8 0.0 4.2 

assign (resid 13 and name HG1#) (resid 14 and name HB#) 1.8 0.0 4.2

assign (resid 13 and name HG1#) (resid 15 and name HG#) 1.8 0.0 4.2 

assign (resid 13 and name HG1#) (resid 15 and name HA) 1.8 0.0 4.2 

assign (resid 13 and name HG1#) (resid 46 and name HN) 1.8 0.0 4.2


assign (resid 13 and name HG2#) (resid 12 and name HA) 1.8 0.0 4.2

assign (resid 13 and name HG2#) (resid 15 and name HA) 1.8 0.0 4.2

assign (resid 13 and name HG2#) (resid 12 and name HB#) 1.8 0.0 4.2

assign (resid 13 and name HG2#) (resid 14 and name HB#) 1.8 0.0 4.2 


!Y14

!intra

assign (resid 14 and name HB#) (resid 14 and name HD#) 1.8 0.0 1.7

assign (resid 14 and name HB#) (resid 14 and name HE#) 1.8 0.0 4.2

assign (resid 14 and name HB#) (resid 14 and name HN) 1.8 0.0 1.7

!inter

assign (resid 14 and name HB#) (resid 15 and name HN) 1.8 0.0 4.2

assign (resid 14 and name HB#) (resid 15 and name HA) 1.8 0.0 4.2

assign (resid 14 and name HD#) (resid 13 and name HA) 1.8 0.0 4.2

!!! assign (resid 14 and name HA) (resid 46 and name HD2#) 1.8 0.0 4.2 

assign (resid 14 and name HA) (resid 15 and name HA) 1.8 0.0 4.2 


!E15

!intra

assign (resid 15 and name HA) (resid 15 and name HN) 1.8 0.0 1.7


assign (resid 15 and name HB#) (resid 15 and name HN) 1.8 0.0 1.7


!inter


! assign (resid 15 and name HB#) (resid 13 and name HB#) 1.8 0.0 4.2

assign (resid 15 and name HB#) (resid 14 and name HB#) 1.8 0.0 4.2

assign (resid 15 and name HB#) (resid 14 and name HN) 1.8 0.0 4.2 

!!! assign (resid 15 and name HA) (resid 17 and name HZ) 1.8 0.0 4.2 


assign (resid 15 and name HB#) (resid 17 and name HB1) 1.8 0.0 4.2
assign (resid 15 and name HB#) (resid 17 and name HB2) 1.8 0.0 4.2

!!! assign (resid 15 and name HB#) (resid 46 and name HN) 1.8 0.0 4.2

assign (resid 15 and name HG#) (resid 16 and name HB#) 1.8 0.0 4.2

assign (resid 15 and name HG#) (resid 17 and name HB#) 1.8 0.0 4.2


assign (resid 15 and name HB#) (resid 16 and name HB#) 1.8 0.0 4.2


!C16

!intra

assign (resid 16 and name HA) (resid 16 and name HN) 1.8 0.0 1.7

assign (resid 16 and name HB#) (resid 16 and name HA) 1.8 0.0 1.1

assign (resid 16 and name HB#) (resid 16 and name HN) 1.8 0.0 1.7


!inter

assign (resid 16 and name HN) (resid 15 and name HN) 1.8 0.0 1.7

assign (resid 16 and name HB#) (resid 17 and name HN) 1.8 0.0 4.2

assign (resid 16 and name HB#) (resid 14 and name HN) 1.8 0.0 4.2

assign (resid 16 and name HB#) (resid 23 and name HB#) 1.8 0.0 4.2 

assign (resid 16 and name HB#) (resid 38 and name HN) 1.8 0.0 4.2


assign (resid 16 and name HA) (resid 24 and name HB# ) 1.8 0.0 4.2 

assign (resid 16 and name HA) (resid 14 and name HE# ) 1.8 0.0 4.2 


!F17

!intra

assign (resid 17 and name HB#) (resid 17 and name HN) 1.8 0.0 1.7


!inter

assign (resid 17 and name HA) (resid 18 and name HN) 1.8 0.0 1.7


assign (resid 17 and name HE#) (resid 24 and name HN) 1.8 0.0 4.2


assign (resid 17 and name HZ) (resid 18 and name HA) 1.8 0.0 4.2 


!D18

!intra

assign (resid 18 and name HA) (resid 18 and name HN) 1.8 0.0 1.1

assign (resid 18 and name HB#) (resid 18 and name HN) 1.8 0.0 1.1


!inter

assign (resid 18 and name HN) (resid 23 and name HB#) 1.8 0.0 4.2

assign (resid 18 and name HA) (resid 17 and name HD2) 1.8 0.0 4.2

assign (resid 18 and name HB#) (resid 17 and name HD1) 1.8 0.0 4.2

assign (resid 18 and name HB#) (resid 17 and name HZ) 1.8 0.0 4.2

assign (resid 18 and name HB#) (resid 19 and name HB#) 1.8 0.0 4.2

assign (resid 18 and name HA) (resid 19 and name HN) 1.8 0.0 1.7 


!A19

!intra

assign (resid 19 and name HA) (resid 19 and name HN) 1.8 0.0 1.7

assign (resid 19 and name HB#) (resid 19 and name HN) 1.8 0.0 1.7

assign (resid 19 and name HA) (resid 19 and name HB#) 1.8 0.0 1.7


!inter

assign (resid 19 and name HA) (resid 20 and name HN) 1.8 0.0 1.7

assign (resid 19 and name HA) (resid 38 and name HB#) 1.8 0.0 4.2


assign (resid 19 and name HB#) (resid 17 and name HN) 1.8 0.0 4.2

assign (resid 19 and name HB#) (resid 18 and name HN) 1.8 0.0 4.2

assign (resid 19 and name HB#) (resid 20 and name HD#) 1.8 0.0 4.2

assign (resid 19 and name HB#) (resid 21 and name HB#) 1.8 0.0 4.2

assign (resid 19 and name HB#) (resid 25 and name HB#) 1.8 0.0 4.2

assign (resid 19 and name HB#) (resid 25 and name HD2#) 1.8 0.0 4.2

assign (resid 19 and name HB#) (resid 26 and name HN) 1.8 0.0 4.2

! assign (resid 19 and name HB#) (resid 46 and name HN) 1.8 0.0 4.2 

assign (resid 19 and name HN) (resid 38 and name HB# ) 1.8 0.0 4.2 

assign (resid 19 and name HN) (resid 23 and name HN ) 1.8 0.0 4.2 


!F20

!intra

assign (resid 20 and name HA) (resid 20 and name HN) 1.8 0.0 1.1

assign (resid 20 and name HB#) (resid 20 and name HN) 1.8 0.0 1.7


!inter

!assign (resid 20 and name HN) (resid 21 and name HN) 1.8 0.0 1.1

assign (resid 20 and name HB#) (resid 21 and name HB#) 1.8 0.0 4.2 


!S21

!intra

assign (resid 21 and name HA) (resid 21 and name HN) 1.8 0.0 1.1

assign (resid 21 and name HB#) (resid 21 and name HN) 1.8 0.0 1.1


!inter

assign (resid 21 and name HA) (resid 22 and name HN) 1.8 0.0 1.7

assign (resid 21 and name HN) (resid 20 and name HN) 1.8 0.0 1.1


assign (resid 21 and name HA) (resid 22 and name HA) 1.8 0.0 4.2


! assign (resid 21 and name HB#) (resid 23 and name HN) 1.8 0.0 4.2


!S22

!intra

assign (resid 22 and name HA) (resid 22 and name HN) 1.8 0.0 1.1

assign (resid 22 and name HB1) (resid 22 and name HN) 1.8 0.0 4.2
assign (resid 22 and name HB2) (resid 22 and name HN) 1.8 0.0 4.2


! inter

assign (resid 22 and name HN) (resid 24 and name HN) 1.8 0.0 4.2

assign (resid 22 and name HA) (resid 23 and name HN) 1.8 0.0 4.2

assign (resid 22 and name HA) (resid 24 and name HN) 1.8 0.0 4.2

assign (resid 22 and name HA) (resid 25 and name HN) 1.8 0.0 4.2

assign (resid 22 and name HA) (resid 26 and name HN) 1.8 0.0 4.2

assign (resid 22 and name HA) (resid 25 and name HB#) 1.8 0.0 4.2 ! d2o

assign (resid 22 and name HB#) (resid 23 and name HN) 1.8 0.0 4.2

assign (resid 22 and name HB#) (resid 23 and name HA) 1.8 0.0 4.2


assign (resid 22 and name HB#) (resid 19 and name HA) 1.8 0.0 4.2

assign (resid 22 and name HB#) (resid 25 and name HN) 1.8 0.0 4.2 

!!! assign (resid 22 and name HB#) (resid 23 and name HD#) 1.8 0.0 4.2   !! later

!!! assign (resid 22 and name HN) (resid 27 and name HG2#) 1.8 0.0 4.2 


!Y23

!intra

assign (resid 23 and name HB#) (resid 23 and name HE#) 1.8 0.0 4.2

assign (resid 23 and name HB1) (resid 23 and name HN) 1.8 0.0 1.7
assign (resid 23 and name HB2) (resid 23 and name HN) 1.8 0.0 1.7


!inter

assign (resid 23 and name HN) (resid 24 and name HN) 1.8 0.0 1.7

assign (resid 23 and name HN) (resid 25 and name HN) 1.8 0.0 4.2

assign (resid 23 and name HA) (resid 17 and name HD#) 1.8 0.0 4.2

assign (resid 23 and name HA) (resid 24 and name HN) 1.8 0.0 1.7

assign (resid 23 and name HA) (resid 24 and name HA) 1.8 0.0 4.2

assign (resid 23 and name HA) (resid 25 and name HN) 1.8 0.0 4.2

assign (resid 23 and name HA) (resid 26 and name HN) 1.8 0.0 4.2

assign (resid 23 and name HA) (resid 26 and name HA#) 1.8 0.0 4.2 


assign (resid 23 and name HB#) (resid 24 and name HN) 1.8 0.0 1.1

assign (resid 23 and name HB#) (resid 19 and name HA) 1.8 0.0 4.2

assign (resid 23 and name HD#) (resid 25 and name HD2#) 1.8 0.0 4.2

assign (resid 23 and name HD#) (resid 27 and name HN) 1.8 0.0 4.2

assign (resid 23 and name HE#) (resid 27 and name HN) 1.8 0.0 4.2 


assign (resid 23 and name HE#) (resid 16 and name HB#) 1.8 0.0 4.2


!C24

!intra

assign (resid 24 and name HA) (resid 24 and name HN) 1.8 0.0 1.7

assign (resid 24 and name HB#) (resid 24 and name HN) 1.8 0.0 1.7


!inter

assign (resid 24 and name HN) (resid 25 and name HN) 1.8 0.0 1.7

assign (resid 24 and name HN) (resid 26 and name HN) 1.8 0.0 4.2

assign (resid 24 and name HA) (resid 25 and name HN) 1.8 0.0 1.7

assign (resid 24 and name HA) (resid 26 and name HN) 1.8 0.0 4.2

assign (resid 24 and name HA) (resid 27 and name HN) 1.8 0.0 4.2

assign (resid 24 and name HA) (resid 28 and name HN) 1.8 0.0 4.2

assign (resid 24 and name HA) (resid 27 and name HB) 1.8 0.0 4.2

assign (resid 24 and name HB#) (resid 23 and name HE#) 1.8 0.0 4.2

assign (resid 24 and name HB#) (resid 25 and name HD21) 1.8 0.0 1.7
assign (resid 24 and name HB#) (resid 25 and name HD22) 1.8 0.0 1.7

assign (resid 24 and name HB#) (resid 25 and name HN) 1.8 0.0 1.1


assign (resid 24 and name HB#) (resid 38 and name HN) 1.8 0.0 4.2

assign (resid 24 and name HB#) (resid 38 and name HA) 1.8 0.0 4.2


!N25

!intra

assign (resid 25 and name HA) (resid 25 and name HN) 1.8 0.0 1.1

assign (resid 25 and name HB#) (resid 25 and name HA) 1.8 0.0 1.1

assign (resid 25 and name HB#) (resid 25 and name HN) 1.8 0.0 1.7


!inter

!assign (resid 25 and name HN) (resid 26 and name HN) 1.8 0.0 1.7

! assign (resid 25 and name HN) (resid 28 and name HB#) 1.8 0.0 4.2


assign (resid 25 and name HN) (resid 27 and name HN) 1.8 0.0 4.2

assign (resid 25 and name HA) (resid 26 and name HN) 1.8 0.0 1.7


assign (resid 25 and name HA) (resid 28 and name HB#) 1.8 0.0 4.2

assign (resid 25 and name HB#) (resid 26 and name HN) 1.8 0.0 4.2


!G26

!intra

assign (resid 26 and name HA#) (resid 26 and name HN) 1.8 0.0 1.1


!inter

assign (resid 26 and name HN) (resid 25 and name HN) 1.8 0.0 1.1

assign (resid 26 and name HN) (resid 27 and name HN) 1.8 0.0 1.1

assign (resid 26 and name HA#) (resid 27 and name HA) 1.8 0.0 4.2

assign (resid 26 and name HA#) (resid 28 and name HN) 1.8 0.0 4.2

assign (resid 26 and name HA#) (resid 29 and name HN) 1.8 0.0 4.2

assign (resid 26 and name HA#) (resid 30 and name HN) 1.8 0.0 4.2

assign (resid 26 and name HA#) (resid 29 and name HB) 1.8 0.0 4.2

assign (resid 26 and name HA#) (resid 27 and name HB) 1.8 0.0 4.2 

assign (resid 26 and name HA#) (resid 30 and name HD#) 1.8 0.0 4.2 


!V27

!intra

assign (resid 27 and name HA) (resid 27 and name HN) 1.8 0.0 1.1

assign (resid 27 and name HB) (resid 27 and name HN) 1.8 0.0 1.1

assign (resid 27 and name HG1#) (resid 27 and name HA) 1.8 0.0 1.7
assign (resid 27 and name HG2#) (resid 27 and name HA) 1.8 0.0 1.7

assign (resid 27 and name HG1#) (resid 27 and name HN) 1.8 0.0 4.2
assign (resid 27 and name HG2#) (resid 27 and name HN) 1.8 0.0 4.2


!inter

assign (resid 27 and name HN) (resid 26 and name HN) 1.8 0.0 1.1

!assign (resid 27 and name HN) (resid 28 and name HN) 1.8 0.0 1.1

assign (resid 27 and name HA) (resid 28 and name HN) 1.8 0.0 1.7

assign (resid 27 and name HB) (resid 28 and name HN) 1.8 0.0 4.2

assign (resid 27 and name HA) (resid 28 and name HA) 1.8 0.0 4.2

assign (resid 27 and name HA) (resid 30 and name HN) 1.8 0.0 4.2

assign (resid 27 and name HA) (resid 30 and name HB#) 1.8 0.0 4.2

assign (resid 27 and name HB) (resid 25 and name HD2#) 1.8 0.0 4.2

! assign (resid 27 and name HB) (resid 26 and name HA#) 1.8 0.0 4.2
! assign (resid 27 and name HB) (resid 26 and name HN) 1.8 0.0 4.2   !!!

!!! assign (resid 27 and name HB) (resid 30 and name HD#) 1.8 0.0 4.2


assign (resid 27 and name HG1#) (resid 24 and name HB#) 1.8 0.0 4.2
assign (resid 27 and name HG2#) (resid 24 and name HB#) 1.8 0.0 4.2

assign (resid 27 and name HG1#) (resid 28 and name HB#) 1.8 0.0 4.2 
assign (resid 27 and name HG2#) (resid 28 and name HB#) 1.8 0.0 4.2 


assign (resid 27 and name HG2#) (resid 26 and name HA#) 1.8 0.0 4.2

assign (resid 27 and (name HG1# or name HG2#)) (resid 26 and name HN) 1.8 0.0 4.2

assign (resid 27 and name HG2#) (resid 26 and name HN) 1.8 0.0 4.2

assign (resid 27 and name HG2#) (resid 23 and name HE#) 1.8 0.0 4.2


!C28

!intra

assign (resid 28 and name HA) (resid 28 and name HN) 1.8 0.0 1.1

assign (resid 28 and name HB#) (resid 28 and name HN) 1.8 0.0 1.7


!inter

assign (resid 28 and name HN) (resid 27 and name HN) 1.8 0.0 1.7

assign (resid 28 and name HN) (resid 30 and name HN) 1.8 0.0 4.2

assign (resid 28 and name HA) (resid 29 and name HN) 1.8 0.0 1.7

assign (resid 28 and name HA) (resid 30 and name HN) 1.8 0.0 4.2

assign (resid 28 and name HB#) (resid 35 and name HN) 1.8 0.0 4.2


assign (resid 28 and name HB#) (resid 26 and name HN) 1.8 0.0 4.2

assign (resid 28 and name HB#) (resid 27 and name HA) 1.8 0.0 4.2 

assign (resid 28 and name HB#) (resid 27 and name HN) 1.8 0.0 4.2 

assign (resid 28 and name HB#) (resid 35 and name HA) 1.8 0.0 4.2 

! assign (resid 28 and name HA) (resid 33 and name HB#) 1.8 0.0 4.2 


!T29

!intra

assign (resid 29 and name HA) (resid 29 and name HN) 1.8 0.0 1.7

assign (resid 29 and name HA) (resid 29 and name HN) 1.8 0.0 4.2

assign (resid 29 and name HG#) (resid 29 and name HN) 1.8 0.0 1.7


!inter

assign (resid 29 and name HA) (resid 30 and name HN) 1.8 0.0 1.7

assign (resid 29 and name HB#) (resid 30 and name HA) 1.8 0.0 4.2 

!assign (resid 29 and name HB#) (resid 30 and name HB#) 1.8 0.0 4.2 


!K30

!intra

assign (resid 30 and name HA) (resid 30 and name HN) 1.8 0.0 1.1

assign (resid 30 and name HB#) (resid 30 and name HA) 1.8 0.0 1.7


assign (resid 30 and name HB#) (resid 30 and name HN) 1.8 0.0 1.1

assign (resid 30 and name HB#) (resid 30 and name HE#) 1.8 0.0 1.7


assign (resid 30 and name HG#) (resid 30 and name HN) 1.8 0.0 1.7

assign (resid 30 and name HD#) (resid 30 and name HN) 1.8 0.0 4.2

assign (resid 30 and name HE#) (resid 30 and name HN) 1.8 0.0 4.2


!inter

assign (resid 30 and name HA) (resid 31 and name HN) 1.8 0.0 1.7

assign (resid 30 and name HB#) (resid 27 and name HA) 1.8 0.0 4.2 


assign (resid 30 and name HB#) (resid 26 and name HA#) 1.8 0.0 4.2

!!! assign (resid 30 and name HB1) (resid 29 and name HN) 1.8 0.0 4.2
assign (resid 30 and name HB2) (resid 29 and name HN) 1.8 0.0 4.2


assign (resid 30 and name HD#) (resid 26 and name HA#) 1.8 0.0 4.2

assign (resid 30 and name HD#) (resid 29 and name HB#) 1.8 0.0 1.7

assign (resid 30 and name HD#) (resid 31 and name HN) 1.8 0.0 4.2

assign (resid 30 and name HG#) (resid 29 and name HB#) 1.8 0.0 4.2


assign (resid 30 and name HN) (resid 33 and name HN) 1.8 0.0 4.2

assign (resid 30 and name HB#) (resid 32 and name HN) 1.8 0.0 4.2


!N31

!intra

assign (resid 31 and name HB#) (resid 31 and name HN) 1.8 0.0 1.7

assign (resid 31 and name HB#) (resid 31 and name HD#) 1.8 0.0 4.2

assign (resid 31 and name HD#) (resid 31 and name HN) 1.8 0.0 4.2


!inter

assign (resid 31 and name HD2#) (resid 33 and name HN) 1.8 0.0 4.2


!G32

!intra

assign (resid 32 and name HA#) (resid 32 and name HN) 1.8 0.0 1.1


!inter

assign (resid 32 and name HA#) (resid 33 and name HN) 1.8 0.0 1.1

assign (resid 32 and name HA#) (resid 33 and name HB#) 1.8 0.0 4.2

assign (resid 32 and name HN) (resid 31 and name HN) 1.8 0.0 1.1

!assign (resid 32 and name HN) (resid 33 and name HN) 1.8 0.0 1.1

assign (resid 32 and name HA#) (resid 29 and name HG2#) 1.8 0.0 4.2 


!A33

!intra

assign (resid 33 and name HA) (resid 33 and name HN) 1.8 0.0 1.1

assign (resid 33 and name HB#) (resid 33 and name HA) 1.8 0.0 1.1

assign (resid 33 and name HB#) (resid 33 and name HN) 1.8 0.0 1.1


!inter

assign (resid 33 and name HN) (resid 32 and name HN) 1.8 0.0 1.1

assign (resid 33 and name HA) (resid 32 and name HN) 1.8 0.0 4.2

assign (resid 33 and name HA) (resid 34 and name HN) 1.8 0.0 4.2

assign (resid 33 and name HA) (resid 34 and name HA) 1.8 0.0 4.2 

assign (resid 33 and name HA) (resid 35 and name HN) 1.8 0.0 4.2


assign (resid 33 and name HA) (resid 34 and name HA) 1.8 0.0 4.2


assign (resid 33 and name HB#) (resid 32 and name HN) 1.8 0.0 4.2

assign (resid 33 and name HB#) (resid 34 and name HN) 1.8 0.0 1.1

assign (resid 33 and name HB#) (resid 35 and name HA) 1.8 0.0 4.2

! assign (resid 33 and name HB#) (resid 51 and name HN) 1.8 0.0 4.2


!K34

!intra

assign (resid 34 and name HA) (resid 34 and name HN) 1.8 0.0 1.7 


assign (resid 34 and name HB#) (resid 34 and name HN) 1.8 0.0 1.7

assign (resid 34 and name HD#) (resid 34 and name HB#) 1.8 0.0 1.7

assign (resid 34 and name HD1) (resid 34 and name HN) 1.8 0.0 4.2
assign (resid 34 and name HD2) (resid 34 and name HN) 1.8 0.0 4.2

assign (resid 34 and name HE#) (resid 34 and name HN) 1.8 0.0 4.2

assign (resid 34 and name HG#) (resid 34 and name HE#) 1.8 0.0 1.1

assign (resid 34 and name HG1) (resid 34 and name HN) 1.8 0.0 4.2
assign (resid 34 and name HG2) (resid 34 and name HN) 1.8 0.0 4.2


!inter

!assign (resid 34 and name HG#) (resid 52 and name HN) 1.8 0.0 4.2

!assign (resid 34 and name HA) (resid 52 and name HN) 1.8 0.0 4.2 


assign (resid 34 and name HD#) (resid 35 and name HN) 1.8 0.0 4.2

assign (resid 34 and name HB#) (resid 35 and name HN) 1.8 0.0 4.2 

assign (resid 34 and name HD#) (resid 51 and name HN) 1.8 0.0 4.2

assign (resid 34 and name HE#) (resid 51 and name HA) 1.8 0.0 4.2 

assign (resid 34 and name HE#) (resid 52 and name HA) 1.8 0.0 4.2 


!assign (resid 34 and name HD#) (resid 27 and name HA) 1.8 0.0 4.2 

assign (resid 34 and name HD#) (resid 33 and name HB#) 1.8 0.0 4.2 

assign (resid 34 and name HD#) (resid 36 and name HN) 1.8 0.0 4.2 


!S35

!intra

assign (resid 35 and name HA) (resid 35 and name HN) 1.8 0.0 1.1

assign (resid 35 and name HB#) (resid 35 and name HA) 1.8 0.0 1.1

assign (resid 35 and name HB#) (resid 35 and name HN) 1.8 0.0 1.7


!inter

assign (resid 35 and name HN) (resid 51 and name HN) 1.8 0.0 4.2

assign (resid 35 and name HA) (resid 36 and name HN) 1.8 0.0 4.2

assign (resid 35 and name HA) (resid 29 and name HN) 1.8 0.0 4.2

assign (resid 35 and name HB#) (resid 37 and name HD#) 1.8 0.0 4.2 

assign (resid 35 and name HB#) (resid 25 and name HD2#) 1.8 0.0 4.2 


!G36

!intra

!assign (resid 36 and name HA1) (resid 36 and name HA2) 1.8 0.0 1.1

assign (resid 36 and name HA1) (resid 36 and name HN) 1.8 0.0 1.1

assign (resid 36 and name HA2) (resid 36 and name HN) 1.8 0.0 1.1


!inter

assign (resid 36 and name HA#) (resid 51 and name HN) 1.8 0.0 4.2

assign (resid 36 and name HA#) (resid 37 and name HN) 1.8 0.0 1.1


assign (resid 36 and name HA1) (resid 50 and name HA) 1.8 0.0 4.2
assign (resid 36 and name HA2) (resid 50 and name HA) 1.8 0.0 4.2

assign (resid 36 and name HA#) (resid 37 and name HA) 1.8 0.0 4.2 


!Y37

!intra

assign (resid 37 and name HA) (resid 37 and name HD#) 1.8 0.0 1.7

assign (resid 37 and name HB#) (resid 37 and name HD#) 1.8 0.0 1.7

assign (resid 37 and name HB#) (resid 37 and name HN) 1.8 0.0 1.7


!inter


assign (resid 37 and name HN) (resid 38 and name HN) 1.8 0.0 4.2

assign (resid 37 and name HN) (resid 38 and name HB# ) 1.8 0.0 4.2 

assign (resid 37 and name HN) (resid 49 and name HA) 1.8 0.0 4.2 

assign (resid 37 and name HN) (resid 51 and name HG1#) 1.8 0.0 4.2


assign (resid 37 and name HA) (resid 38 and name HN) 1.8 0.0 4.2

assign (resid 37 and name HA) (resid 39 and name HN) 1.8 0.0 4.2 

!!! assign (resid 37 and name HA) (resid 49 and name HH2) 1.8 0.0 4.2  

! assign (resid 37 and name HA) (resid 49 and name HD1) 1.8 0.0 4.2


assign (resid 37 and name HD#) (resid 25 and name HD2#) 1.8 0.0 4.2

assign (resid 37 and name HD#) (resid 39 and name HE#) 1.8 0.0 4.2

assign (resid 37 and name HD#) (resid 49 and name HA) 1.8 0.0 4.2 

assign (resid 37 and name HD#) (resid 49 and name HD1) 1.8 0.0 4.2


assign (resid 37 and name HE#) (resid 49 and name HE1) 1.8 0.0 4.2

assign (resid 37 and name HE#) (resid 49 and name HD1) 1.8 0.0 4.2

assign (resid 37 and name HE#) (resid 51 and name HG2#) 1.8 0.0 4.2


!C38

!intra

assign (resid 38 and name HB#) (resid 38 and name HN) 1.8 0.0 4.2


!inter


assign (resid 38 and name HA) (resid 39 and name HN) 1.8 0.0 1.1

assign (resid 38 and name HA) (resid 49 and name HN) 1.8 0.0 4.2

assign (resid 38 and name HA) (resid 48 and name HA) 1.8 0.0 4.2


assign (resid 38 and name HB#) (resid 37 and name HA) 1.8 0.0 4.2

assign (resid 38 and name HB#) (resid 39 and name HA) 1.8 0.0 4.2 

assign (resid 38 and name HB#) (resid 48 and name HN) 1.8 0.0 4.2 


!Q39

!intra

assign (resid 39 and name HA) (resid 39 and name HN) 1.8 0.0 1.7

assign (resid 39 and name HB#) (resid 39 and name HE2#) 1.8 0.0 1.7

assign (resid 39 and name HB#) (resid 39 and name HN) 1.8 0.0 1.7

assign (resid 39 and name HE2#) (resid 39 and name HA) 1.8 0.0 4.2

assign (resid 39 and name HG#) (resid 39 and name HE2#) 1.8 0.0 1.7

assign (resid 39 and name HG#) (resid 39 and name HN) 1.8 0.0 4.2


!inter

assign (resid 39 and name HN) (resid 38 and name HA) 1.8 0.0 1.7

assign (resid 39 and name HN) (resid 47 and name HN) 1.8 0.0 4.2

assign (resid 39 and name HN) (resid 48 and name HA) 1.8 0.0 4.2


assign (resid 39 and name HA) (resid 40 and name HN) 1.8 0.0 1.7

assign (resid 39 and name HA) (resid 38 and name HB# ) 1.8 0.0 4.2 

!assign (resid 39 and name HA) (resid 49 and name HD1) 1.8 0.0 4.2


assign (resid 39 and name HB#) (resid 37 and name HB#) 1.8 0.0 4.2 

assign (resid 39 and name HB#) (resid 49 and name HH2) 1.8 0.0 4.2
 
assign (resid 39 and name HB#) (resid 49 and name HZ3) 1.8 0.0 4.2


assign (resid 39 and name HG#) (resid 40 and name HN) 1.8 0.0 4.2

assign (resid 39 and name HG#) (resid 38 and name HB#) 1.8 0.0 4.2 

assign (resid 39 and name HG#) (resid 40 and name HA) 1.8 0.0 4.2 

assign (resid 39 and name HG#) (resid 40 and name HA) 1.8 0.0 4.2 

assign (resid 39 and name HG#) (resid 46 and name HD2#) 1.8 0.0 4.2 


assign (resid 39 and name HE2#) (resid 40 and name HN) 1.8 0.0 4.2

assign (resid 39 and name HE2#) (resid 49 and name HZ2) 1.8 0.0 4.2

assign (resid 39 and name HE2#) (resid 49 and name HZ3) 1.8 0.0 4.2

assign (resid 39 and name HE2#) (resid 49 and name HD1) 1.8 0.0 4.2

assign (resid 39 and name HE2#) (resid 40 and name HG2#) 1.8 0.0 4.2


!I40

!intra

assign (resid 40 and name HB) (resid 40 and name HN) 1.8 0.0 4.2

assign (resid 40 and name HD1#) (resid 40 and name HN) 1.8 0.0 4.2

assign (resid 40 and name HG2#) (resid 40 and name HN) 1.8 0.0 4.2

assign (resid 40 and name HG1#) (resid 40 and name HG2#) 1.8 0.0 1.7

assign (resid 40 and name HG1#) (resid 40 and name HN) 1.8 0.0 4.2

assign (resid 40 and name HG2#) (resid 40 and name HD1#) 1.8 0.0 1.7

assign (resid 40 and name HG2#) (resid 40 and name HA) 1.8 0.0 1.7


!inter

assign (resid 40 and name HA) (resid 47 and name HN) 1.8 0.0 4.2

assign (resid 40 and name HA) (resid 46 and name HA) 1.8 0.0 4.2


assign (resid 40 and name HB) (resid 41 and name HA) 1.8 0.0 4.2

! assign (resid 40 and name HD1#) (resid 44 and name HD#) 1.8 0.0 4.2


assign (resid 40 and name HG1#) (resid 39 and name HB#) 1.8 0.0 4.2

assign (resid 40 and name HG1#) (resid 39 and name HE2#) 1.8 0.0 4.2

assign (resid 40 and name HG1#) (resid 46 and name HD2#) 1.8 0.0 4.2

assign (resid 40 and name HG2#) (resid 46 and name HB#) 1.8 0.0 4.2

assign (resid 40 and name HG2#) (resid 46 and name HD2#) 1.8 0.0 4.2

assign (resid 40 and name HG2#) (resid 47 and name HN) 1.8 0.0 4.2 

assign (resid 40 and name HA) (resid 41 and name HN) 1.8 0.0 4.2

assign (resid 40 and name HA) (resid 46 and name HD2#) 1.8 0.0 4.2

assign (resid 40 and name HG1#) (resid 41 and name HN) 1.8 0.0 4.2

assign (resid 40 and name HA) (resid 41 and name HB# ) 1.8 0.0 4.2 


!L41

!intra

assign (resid 41 and name HA) (resid 41 and name HN) 1.8 0.0 1.1

assign (resid 41 and name HB1) (resid 41 and name HN) 1.8 0.0 1.7
assign (resid 41 and name HB2) (resid 41 and name HN) 1.8 0.0 1.7

assign (resid 41 and name HB#) (resid 41 and name HA) 1.8 0.0 4.2


assign (resid 41 and name HD#) (resid 41 and name HB1) 1.8 0.0 1.7
assign (resid 41 and name HD#) (resid 41 and name HB2) 1.8 0.0 1.7

assign (resid 41 and name HD1#) (resid 41 and name HN) 1.8 0.0 4.2
assign (resid 41 and name HD2#) (resid 41 and name HN) 1.8 0.0 4.2

assign (resid 41 and name HG) (resid 41 and name HB#) 1.8 0.0 1.7

assign (resid 41 and name HG) (resid 41 and name HN) 1.8 0.0 4.2


!inter

assign (resid 41 and name HA) (resid 46 and name HN) 1.8 0.0 4.2

!assign (resid 41 and name HB#) (resid 39 and name HG#) 1.8 0.0 4.2 !3.52

assign (resid 41 and name HB1) (resid 40 and name HB) 1.8 0.0 4.2
assign (resid 41 and name HB2) (resid 40 and name HB) 1.8 0.0 4.2

assign (resid 41 and name HB#) (resid 45 and name HN) 1.8 0.0 4.2

assign (resid 41 and name HB#) (resid 42 and name HA#) 1.8 0.0 4.2


assign (resid 41 and name HB#) (resid 43 and name HN) 1.8 0.0 1.7


assign (resid 41 and name HD#) (resid 43 and name HB#) 1.8 0.0 4.2

assign (resid 41 and name HD#) (resid 44 and name HD#) 1.8 0.0 4.2

assign (resid 41 and name HD#) (resid 47 and name HA#) 1.8 0.0 4.2

assign (resid 41 and name HB#) (resid 45 and name HN) 1.8 0.0 4.2


assign (resid 41 and name HG) (resid 46 and name HA#) 1.8 0.0 4.2

assign (resid 41 and name HG) (resid 47 and name HA#) 1.8 0.0 4.2

assign (resid 41 and name HG) (resid 43 and name HN) 1.8 0.0 4.2


assign (resid 41 and name HG) (resid 46 and name HN) 1.8 0.0 4.2

assign (resid 41 and name HG) (resid 40 and name HG#) 1.8 0.0 4.2


assign (resid 41 and name HB#) (resid 44 and name HD#) 1.8 0.0 4.2

assign (resid 41 and name HD#) (resid 44 and name HD#) 1.8 0.0 4.2

assign (resid 41 and name HG) (resid 47 and name HA#) 1.8 0.0 4.2 

assign (resid 41 and name HB#) (resid 47 and name HA#) 1.8 0.0 4.2 


!G42

!inter

assign (resid 42 and name HN) (resid 41 and name HN) 1.8 0.0 4.2

!assign (resid 42 and name HN) (resid 43 and name HN) 1.8 0.0 1.1


!inter

assign (resid 42 and name HA#) (resid 43 and name HG#) 1.8 0.0 4.2


!T43

!intra

assign (resid 43 and name HA#) (resid 43 and name HN) 1.8 0.0 1.1

assign (resid 43 and name HG#) (resid 43 and name HB#) 1.8 0.0 1.1

assign (resid 43 and name HG#) (resid 43 and name HN) 1.8 0.0 1.1


!inter

assign (resid 43 and name HN) (resid 42 and name HN) 1.8 0.0 1.1

assign (resid 43 and name HA) (resid 44 and name HN) 1.8 0.0 1.7


assign (resid 43 and name HB) (resid 44 and name HD#) 1.8 0.0 4.2

assign (resid 43 and name HB) (resid 44 and name HN) 1.8 0.0 4.2

assign (resid 43 and name HB) (resid 44 and name HD#) 1.8 0.0 4.2

assign (resid 43 and name HB) (resid 44 and name HE#) 1.8 0.0 4.2 

!!!! assign (resid 43 and name HB) (resid 45 and name HA#) 1.8 0.0 4.2   !!later


assign (resid 43 and name HG#) (resid 44 and name HN) 1.8 0.0 4.2

assign (resid 43 and name HG#) (resid 44 and name HD#) 1.8 0.0 4.2


!Y44

!intra

assign (resid 44 and name HB#) (resid 44 and name HD#) 1.8 0.0 1.7

assign (resid 44 and name HB#) (resid 44 and name HN) 1.8 0.0 1.7

! assign (resid 44 and name HE#) (resid 44 and name HN) 1.8 0.0 4.2


!inter

assign (resid 44 and name HB#) (resid 43 and name HB#) 1.8 0.0 4.2


assign (resid 44 and name HD#) (resid 41 and name HB#) 1.8 0.0 4.2

! assign (resid 44 and name HD#) (resid 13 and name HG#) 1.8 0.0 4.2


assign (resid 44 and name HE#) (resid 43 and name HG#) 1.8 0.0 4.2


!G45

!intra

assign (resid 45 and name HA#) (resid 45 and name HN) 1.8 0.0 1.7

!inter

assign (resid 45 and name HN) (resid 41 and name HN) 1.8 0.0 4.2

assign (resid 45 and name HA#) (resid 46 and name HN) 1.8 0.0 4.2

assign (resid 45 and name HA#) (resid 44 and name HD#) 1.8 0.0 4.2 

!!! assign (resid 45 and name HA#) (resid 11 and name HB#) 1.8 0.0 4.2 


!N46

!intra

assign (resid 46 and name HA) (resid 46 and name HN) 1.8 0.0 1.1

assign (resid 46 and name HB1) (resid 46 and name HN) 1.8 0.0 1.7
assign (resid 46 and name HB2) (resid 46 and name HN) 1.8 0.0 1.7

!interl

! assign (resid 46 and name HN) (resid 45 and name HN) 1.8 0.0 1.1

assign (resid 46 and name HA) (resid 47 and name HN) 1.8 0.0 1.7

assign (resid 46 and name HD21) (resid 47 and name HA#) 1.8 0.0 4.2 


!G47

!intra

assign (resid 47 and name HA#) (resid 47 and name HN) 1.8 0.0 1.1


!inter

assign (resid 47 and name HA#) (resid 49 and name HZ3) 1.8 0.0 4.2


assign (resid 47 and name HN) (resid 39 and name HN) 1.8 0.0 4.2

assign (resid 47 and name HA#) (resid 48 and name HN) 1.8 0.0 1.1 

assign (resid 47 and name HA#) (resid 41 and name HD#) 1.8 0.0 4.2 

assign (resid 47 and name HA#) (resid 13 and name HG1# ) 1.8 0.0 4.2 

assign (resid 47 and name HN) (resid 48 and name HN ) 1.8 0.0 4.2 


!C48

!intra

assign (resid 48 and name HA) (resid 48 and name HN) 1.8 0.0 1.1

assign (resid 48 and name HB#) (resid 48 and name HN) 1.8 0.0 1.1


!inter

! assign (resid 48 and name HN) (resid 2 and name HG#) 1.8 0.0 4.2


assign (resid 48 and name HA) (resid 49 and name HN) 1.8 0.0 1.7


assign (resid 48 and name HA) (resid 38 and name HA) 1.8 0.0 4.2

assign (resid 48 and name HA) (resid 39 and name HN) 1.8 0.0 4.2


assign (resid 48 and name HB#) (resid 5 and name HA) 1.8 0.0 4.2

assign (resid 48 and name HA) (resid 49 and name HB#) 1.8 0.0 4.2 

!! assign (resid 48 and name HB#) (resid 37 and name HE#) 1.8 0.0 4.2 


!W49

!intra

assign (resid 49 and name HA) (resid 49 and name HN) 1.8 0.0 1.1

assign (resid 49 and name HB#) (resid 49 and name HN) 1.8 0.0 1.7

assign (resid 49 and name HD1) (resid 49 and name HN) 1.8 0.0 4.2


!inter

assign (resid 49 and name HA) (resid 37 and name HD#) 1.8 0.0 4.2 

assign (resid 49 and name HA) (resid 3 and name HN) 1.8 0.0 4.2 

assign (resid 49 and name HA) (resid 50 and name HN) 1.8 0.0 1.1

assign (resid 49 and name HB#) ((resid 39 or resid 50) and name HN) 1.8 0.0 4.2

assign (resid 49 and name HN) (resid 37 and name HN) 1.8 0.0 4.2

assign (resid 49 and name HN) (resid 38 and name HA) 1.8 0.0 4.2

! assign (resid 49 and name HE1) (resid 37 and name HA) 1.8 0.0 4.2 

! assign (resid 49 and name HA) (resid 47 and name HN) 1.8 0.0 4.2 

assign (resid 49 and name HD1) (resid 51 and name HD#) 1.8 0.0 4.2 

assign (resid 49 and name HB#) (resid 51 and name HG1#) 1.8 0.0 4.2 


!assign (resid 49 and name HZ) (resid 37 and name HD#) 1.8 0.0 4.2 


assign (resid 49 and name HA) (resid 37 and name HN) 1.8 0.0 4.2 

assign (resid 49 and name HB#) (resid 48 and name HA) 1.8 0.0 4.2 


!C50

!intra

assign (resid 50 and name HA) (resid 50 and name HN) 1.8 0.0 1.7


assign (resid 50 and name HB#) (resid 50 and name HN) 1.8 0.0 1.7


!inter

assign (resid 50 and name HA) (resid 37 and name HN) 1.8 0.0 4.2

assign (resid 50 and name HA) (resid 51 and name HN) 1.8 0.0 1.7

assign (resid 50 and name HB#) (resid 3 and name HA) 1.8 0.0 4.2

assign (resid 50 and name HA) (resid 49 and name HD1) 1.8 0.0 4.2

assign (resid 50 and name HA) (resid 51 and name HA) 1.8 0.0 4.2


! assign (resid 50 and name HB#) (resid 4 and name HN) 1.8 0.0 4.2

assign (resid 50 and name HB#) (resid 36 and name HA#) 1.8 0.0 4.2

!!! assign (resid 50 and name HB#) (resid 34 and name HN) 1.8 0.0 4.2

assign (resid 50 and name HB#) (resid 2 and name HA) 1.8 0.0 4.2 


!I51

!intra

assign (resid 51 and name HA) (resid 51 and name HN) 1.8 0.0 1.1

assign (resid 51 and name HG1#) (resid 51 and name HN) 1.8 0.0 4.2

assign (resid 51 and name HG2#) (resid 51 and name HN) 1.8 0.0 4.2

assign (resid 51 and name HD#) (resid 51 and name HN) 1.8 0.0 4.2 

!inter

! assign (resid 51 and name HN) (resid 50 and name HN) 1.8 0.0 4.2

assign (resid 51 and name HA) (resid 52 and name HA) 1.8 0.0 4.2

assign (resid 51 and name HA) (resid 52 and name HN) 1.8 0.0 1.7


assign (resid 51 and name HB) (resid 36 and name HA#) 1.8 0.0 4.2

assign (resid 51 and name HB) (resid 2 and name HD#) 1.8 0.0 4.2 

!! assign (resid 51 and name HB) (resid 53 and name HB#) 1.8 0.0 4.2 


assign (resid 51 and name HD1#) (resid 2 and name HG#) 1.8 0.0 4.2

assign (resid 51 and name HD1#) (resid 3 and name HN) 1.8 0.0 4.2

! assign (resid 51 and name HD1#) (resid 34 and name HD#) 1.8 0.0 4.2

assign (resid 51 and name HD1#) (resid 35 and name HB#) 1.8 0.0 4.2

assign (resid 51 and name HD1#) (resid 36 and name HA#) 1.8 0.0 4.2

assign (resid 51 and name HD1#) (resid 37 and name HE#) 1.8 0.0 4.2

assign (resid 51 and name HD1#) (resid 49 and name HE1) 1.8 0.0 4.2

assign (resid 51 and name HD1#) (resid 49 and name HN) 1.8 0.0 4.2 

assign (resid 51 and name HD1#) (resid 49 and name HB#) 1.8 0.0 4.2 

assign (resid 51 and name HD1#) (resid 49 and name HD1) 1.8 0.0 4.2

! assign (resid 51 and name HD1#) (resid 50 and name HB#) 1.8 0.0 4.2

! assign (resid 51 and name HD1#) (resid 53 and name HG) 1.8 0.0 4.2


!!!! assign (resid 51 and name HG1#) (resid 2 and name HA) 1.8 0.0 4.2   !! later

assign (resid 51 and name HG1#) (resid 37 and name HD#) 1.8 0.0 4.2

assign (resid 51 and name HG1#) (resid 37 and name HE#) 1.8 0.0 4.2

assign (resid 51 and name HG1#) (resid 49 and name HE1) 1.8 0.0 4.2

assign (resid 51 and name HG1#) (resid 50 and name HN) 1.8 0.0 4.2 

!!! assign (resid 51 and name HG1#) (resid 49 and name HN) 1.8 0.0 4.2 


assign (resid 51 and name HG2#) (resid 35 and name HN) 1.8 0.0 4.2

assign (resid 51 and name HG2#) (resid 49 and name HD1) 1.8 0.0 4.2

! assign (resid 51 and name HG2#) (resid 50 and name HB#) 1.8 0.0 4.2


! assign (resid 51 and name HG1#) (resid 60 and name HN) 1.8 0.0 4.2 

! assign (resid 51 and name HA) (resid 34 and name HN) 1.8 0.0 4.2 


!A52

!intra

assign (resid 52 and name HA) (resid 52 and name HN) 1.8 0.0 1.7

assign (resid 52 and name HB#) (resid 52 and name HN) 1.8 0.0 1.7


!inter

assign (resid 52 and name HA) (resid 53 and name HN) 1.8 0.0 1.7

! assign (resid 52 and name HA) (resid 33 and name HN) 1.8 0.0 4.2


assign (resid 52 and name HB#) (resid 33 and name HN) 1.8 0.0 4.2

assign (resid 52 and name HB#) (resid 34 and name HD#) 1.8 0.0 4.2

assign (resid 52 and name HB#) (resid 50 and name HB#) 1.8 0.0 4.2

assign (resid 52 and name HB#) (resid 53 and name HN) 1.8 0.0 1.7

assign (resid 52 and name HB#) (resid 1 and name HB#) 1.8 0.0 4.2 

assign (resid 52 and name HB#) (resid 2 and name HA) 1.8 0.0 4.2 


!L53

! intra

assign (resid 53 and name HB#) (resid 53 and name HN) 1.8 0.0 1.7

 assign (resid 53 and name HD#) (resid 53 and name HN) 1.8 0.0 4.2

assign (resid 53 and name HG) (resid 53 and name HN) 1.8 0.0 4.2


!inter

assign (resid 53 and name HA) (resid 54 and name HA) 1.8 0.0 4.2


assign (resid 53 and name HB#) (resid 2 and name HA) 1.8 0.0 4.2

assign (resid 53 and name HB#) (resid 52 and name HN) 1.8 0.0 4.2


assign (resid 53 and (name HD1# or name HD2#)) (resid 2 and name HA) 1.8 0.0 4.2

assign (resid 53 and (name HD1# or name HD2#)) (resid 2 and name HB#) 1.8 0.0 4.2

!!! assign (resid 53 and name HD#) (resid 33 and name HB#) 1.8 0.0 4.2

 assign (resid 53 and name HG#) (resid 56 and name HB#) 1.8 0.0 4.2

!!!  assign (resid 53 and name HA) (resid 2 and name HN) 1.8 0.0 4.2    

assign (resid 53 and name HA) (resid 52 and name HA) 1.8 0.0 4.2


!!! assign (resid 53 and name HG) (resid 52 and name HN) 1.8 0.0 4.2 

assign (resid 53 and name HG) (resid 55 and name HN) 1.8 0.0 4.2 

assign (resid 53 and name HG) (resid 53 and name HA) 1.8 0.0 4.2 

assign (resid 53 and name HG) (resid 55 and name HN) 1.8 0.0 4.2 

assign (resid 53 and name HG) (resid 1 and name HA) 1.8 0.0 4.2 


!P54

!intra

assign (resid 54 and name HB1) (resid 54 and name HA) 1.8 0.0 4.2

assign (resid 54 and name HB2) (resid 54 and name HA) 1.8 0.0 4.2


!inter


assign (resid 54 and name HA) (resid 55 and name HN) 1.8 0.0 1.7

assign (resid 54 and name HA) (resid 56 and name HN) 1.8 0.0 4.2


assign (resid 54 and name HB#) (resid 53 and name HB#) 1.8 0.0 4.2

assign (resid 54 and name HB#) (resid 55 and name HN) 1.8 0.0 4.2

!!! assign (resid 54 and name HG#) (resid 1 and name HA) 1.8 0.0 4.2   !! later

assign (resid 54 and name HG#) (resid 53 and name HB#) 1.8 0.0 4.2

! assign (resid 54 and name HA) (resid 52 and name HB#) 1.8 0.0 4.2 

assign (resid 54 and name HA) (resid 53 and name HG# ) 1.8 0.0 4.2 

assign (resid 54 and name HB#) (resid 1 and name HA) 1.8 0.0 4.2

assign (resid 54 and name HB#) (resid 56 and name HB#) 1.8 0.0 4.2

assign (resid 54 and name HG#) (resid 53 and name HB#) 1.8 0.0 4.2 

assign (resid 54 and name HD#) (resid 53 and name HA) 1.8 0.0 4.2 


!D55

!intra

assign (resid 55 and name HB#) (resid 55 and name HN) 1.8 0.0 1.7


!inter

! assign (resid 55 and name HN) (resid 56 and name HN) 1.8 0.0 1.1

assign (resid 55 and name HB#) (resid 56 and name HD2#) 1.8 0.0 4.2

!!! assign (resid 55 and name HB#) (resid 53 and name HN) 1.8 0.0 4.2 


!N56

!intra

assign (resid 56 and name HA) (resid 56 and name HN) 1.8 0.0 1.1

assign (resid 56 and name HB#) (resid 56 and name HA) 1.8 0.0 1.1

! assign (resid 56 and name HD21) (resid 56 and name HD22) 1.8 0.0 1.1

assign (resid 56 and name HD21) (resid 56 and name HN) 1.8 0.0 4.2
assign (resid 56 and name HN) (resid 56 and name HD22) 1.8 0.0 4.2


assign (resid 56 and name HB#) (resid 56 and name HN) 1.8 0.0 1.7


!inter

assign (resid 56 and name HN) (resid 55 and name HN) 1.8 0.0 4.2

assign (resid 56 and name HA) (resid 57 and name HN) 1.8 0.0 1.7

assign (resid 56 and name HB#) (resid 55 and name HB#) 1.8 0.0 4.2


!V57

!intra

assign (resid 57 and name HA) (resid 57 and name HN) 1.8 0.0 1.1

assign (resid 57 and name HB) (resid 57 and name HN) 1.8 0.0 4.2

assign (resid 57 and name HG1#) (resid 57 and name HN) 1.8 0.0 4.2
assign (resid 57 and name HG2#) (resid 57 and name HN) 1.8 0.0 4.2


!inter


assign (resid 57 and name HB#) (resid 58 and name HD#) 1.8 0.0 4.2

assign (resid 57 and (name HG2# or name HG1#)) (resid 56 and name HD2#) 1.8 0.0 4.2

assign (resid 57 and (name HG2# or name HG1#)) (resid 59 and name HN) 1.8 0.0 4.2


!P58

!intra

assign (resid 58 and name HB#) (resid 58 and name HD#) 1.8 0.0 1.1


!inter


!!!! assign (resid 58 and name HB#) (resid 5 and name HD#) 1.8 0.0 4.2 

assign (resid 58 and name HB#) (resid 59 and name HN) 1.8 0.0 4.2

assign (resid 58 and name HD#) (resid 60 and name HN) 1.8 0.0 4.2

assign (resid 58 and name HD#) (resid 59 and name HA) 1.8 0.0 4.2

assign (resid 58 and name HB#) (resid 59 and name HG2#) 1.8 0.0 4.2 

assign (resid 58 and name HA) (resid 57 and name HN) 1.8 0.0 4.2 

! assign (resid 58 and name HB#) (resid 60 and name HD#) 1.8 0.0 4.2 

assign (resid 58 and name HB#) (resid 56 and name HA) 1.8 0.0 4.2 


assign (resid 58 and name HG#) (resid 60 and name HA) 1.8 0.0 4.2 


!I59

!intra

assign (resid 59 and name HA) (resid 59 and name HN) 1.8 0.0 1.1

assign (resid 59 and name HB) (resid 59 and name HN) 1.8 0.0 4.2

assign (resid 59 and name HD1#) (resid 59 and name HN) 1.8 0.0 4.2

assign (resid 59 and name HG1#) (resid 59 and name HN) 1.8 0.0 4.2

assign (resid 59 and name HG2#) (resid 59 and name HA) 1.8 0.0 1.7

assign (resid 59 and name HG2#) (resid 59 and name HN) 1.8 0.0 4.2


!inter

assign (resid 59 and name HN) (resid 60 and name HB#) 1.8 0.0 4.2


assign (resid 59 and name HA) (resid 61 and name HN) 1.8 0.0 4.2

assign (resid 59 and name HB) (resid 60 and name HN) 1.8 0.0 4.2


assign (resid 59 and name HD#) (resid 58 and name HG#) 1.8 0.0 4.2

assign (resid 59 and name HD#) (resid 58 and name HD#) 1.8 0.0 4.2

assign (resid 59 and name HG1#) (resid 58 and name HB#) 1.8 0.0 4.2

assign (resid 59 and name HG1#) (resid 5 and name HD#) 1.8 0.0 4.2


assign (resid 59 and name HG1#) (resid 60 and name HN) 1.8 0.0 4.2

assign (resid 59 and name HG1#) (resid 61 and name HG1#) 1.8 0.0 4.2

assign (resid 59 and name HG1#) (resid 61 and name HN) 1.8 0.0 4.2

assign (resid 59 and name HG1#) (resid 5 and name HN) 1.8 0.0 4.2 

assign (resid 59 and name HG2#) (resid 58 and name HD#) 1.8 0.0 4.2

assign (resid 59 and name HG2#) (resid 58 and name HA) 1.8 0.0 4.2

assign (resid 59 and name HG2#) (resid 58 and name HG#) 1.8 0.0 4.2


!!!! assign (resid 59 and name HD#) (resid 3 and name HN) 1.8 0.0 4.2 

assign (resid 59 and name HB#) (resid 60 and name HN) 1.8 0.0 4.2 

assign (resid 59 and name HG1#) (resid 58 and name HA) 1.8 0.0 4.2 

assign (resid 59 and name HA) (resid 61 and name HG1#) 1.8 0.0 4.2  


!R60

!intra

assign (resid 60 and name HA) (resid 60 and name HN) 1.8 0.0 1.1

assign (resid 60 and name HD#) (resid 60 and name HN) 1.8 0.0 4.2

assign (resid 60 and name HG#) (resid 60 and name HN) 1.8 0.0 4.2


!inter


assign (resid 60 and name HN) (resid 61 and name HG2#) 1.8 0.0 4.2

assign (resid 60 and name HA) (resid 61 and name HN) 1.8 0.0 1.7


assign (resid 60 and name HB#) (resid 59 and name HN) 1.8 0.0 4.2

assign (resid 60 and name HG#) (resid 61 and name HG1#) 1.8 0.0 4.2 

!!! assign (resid 60 and name HG#) (resid 62 and name HG#) 1.8 0.0 4.2 

assign (resid 60 and name HD#) (resid 59 and name HN) 1.8 0.0 4.2 


!I61

!intra

assign (resid 61 and name HB) (resid 61 and name HN) 1.8 0.0 4.2

assign (resid 61 and name HD1#) (resid 61 and name HB) 1.8 0.0 1.7

assign (resid 61 and name HD1#) (resid 61 and name HN) 1.8 0.0 4.2

assign (resid 61 and name HG2#) (resid 61 and name HN) 1.8 0.0 4.2

assign (resid 61 and name HG1#) (resid 61 and name HG2#) 1.8 0.0 1.1

assign (resid 61 and name HG1#) (resid 61 and name HN) 1.8 0.0 4.2

assign (resid 61 and name HG2#) (resid 61 and name HA) 1.8 0.0 1.7

assign (resid 61 and name HG1#) (resid 61 and name HA) 1.8 0.0 4.2 


!inter

assign (resid 61 and name HA) (resid 62 and name HG#) 1.8 0.0 4.2


assign (resid 61 and name HB) (resid 62 and name HA) 1.8 0.0 4.2

assign (resid 61 and name HB) (resid 62 and name HB#) 1.8 0.0 4.2

assign (resid 61 and name HB) (resid 60 and name HD#) 1.8 0.0 4.2

! assign (resid 61 and name HB) (resid 10 and name HB#) 1.8 0.0 4.2


assign (resid 61 and name HD1#) (resid 59 and name HN) 1.8 0.0 4.2

assign (resid 61 and name HD1#) (resid 60 and name HN) 1.8 0.0 4.2


! assign (resid 61 and name HD1#) (resid 66 and name HD1) 1.8 0.0 4.2

!!!! assign (resid 61 and name HD1#) (resid 66 and name HN) 1.8 0.0 4.2 

assign (resid 61 and name HG1#) (resid 60 and name HD#) 1.8 0.0 4.2

assign (resid 61 and name HG1#) (resid 65 and name HN) 1.8 0.0 4.2

assign (resid 61 and name HN) (resid 59 and name HN) 1.8 0.0 4.2

assign (resid 61 and name HG1#) (resid 63 and name HA#) 1.8 0.0 4.2 


!P62

!intra

assign (resid 62 and name HB#) (resid 62 and name HA) 1.8 0.0 1.1

assign (resid 62 and name HG#) (resid 62 and name HA) 1.8 0.0 4.2


assign (resid 62 and name HG#) (resid 62 and name HB#) 1.8 0.0 4.2

!inter

assign (resid 62 and name HG#) (resid 64 and name HE#) 1.8 0.0 4.2

assign (resid 62 and name HG#) (resid 63 and name HA#) 1.8 0.0 4.2 

assign (resid 62 and name HG#) (resid 64 and name HG#) 1.8 0.0 3.2 


!G63

!intra

assign (resid 63 and name HA1) (resid 63 and name HN) 1.8 0.0 1.1
assign (resid 63 and name HA2) (resid 63 and name HN) 1.8 0.0 1.1


!inter

assign (resid 63 and name HA#) (resid 64 and name HN) 1.8 0.0 1.7


assign (resid 63 and name HA#) (resid 65 and name HN) 1.8 0.0 4.2


!K64

!intra

assign (resid 64 and name HA) (resid 64 and name HN) 1.8 0.0 1.1

assign (resid 64 and name HB#) (resid 64 and name HN) 1.8 0.0 1.7

assign (resid 64 and name HD#) (resid 64 and name HN) 1.8 0.0 4.2

assign (resid 64 and name HG#) (resid 64 and name HE#) 1.8 0.0 1.7

assign (resid 64 and name HG#) (resid 64 and name HN) 1.8 0.0 4.2

assign (resid 64 and name HE#) (resid 64 and name HN) 1.8 0.0 4.2


!inter


assign (resid 64 and name HN) (resid 65 and name HN) 1.8 0.0 4.2

assign (resid 64 and name HA) (resid 65 and name HN) 1.8 0.0 1.7

assign (resid 64 and name HB#) (resid 65 and name HN) 1.8 0.0 4.2

assign (resid 64 and name HD#) (resid 65 and name HN) 1.8 0.0 4.2

assign (resid 64 and name HG#) (resid 65 and name HN) 1.8 0.0 4.2

!!!! assign (resid 64 and name HA) (resid 11 and name HD2#) 1.8 0.0 4.2 

assign (resid 64 and name HB#) (resid 61 and name HA ) 1.8 0.0 4.2 

assign (resid 64 and name HB#) (resid 65 and name HA) 1.8 0.0 4.2 

!!! assign (resid 64 and name HD#) (resid 63 and name HA#) 1.8 0.0 4.2 


!C65

!intra

assign (resid 65 and name HB1) (resid 65 and name HN) 1.8 0.0 4.2
assign (resid 65 and name HB2) (resid 65 and name HN) 1.8 0.0 4.2


!inter

assign (resid 65 and name HA) (resid 11 and name HB#) 1.8 0.0 4.2

! assign (resid 65 and name HB#) (resid 11 and name HD2#) 1.8 0.0 4.2

!!!! assign (resid 65 and name HB#) (resid 11 and name HN) 1.8 0.0 4.2 after

assign (resid 65 and name HB#) (resid 11 and name HA) 1.8 0.0 4.2


assign (resid 65 and name HB#) (resid 64 and name HE#) 1.8 0.0 4.2

assign (resid 65 and name HB#) (resid 64 and name HN) 1.8 0.0 4.2

assign (resid 65 and name HB#) (resid 66 and name HA) 1.8 0.0 4.2


assign (resid 65 and name HB#) (resid 66 and name HD1) 1.8 0.0 4.2

assign (resid 65 and name HN) (resid 64 and name HN) 1.8 0.0 4.2


!H66

!intra

assign (resid 66 and name HA) (resid 66 and name HE1) 1.8 0.0 4.2

assign (resid 66 and name HB1) (resid 66 and name HN) 1.8 0.0 4.2
assign (resid 66 and name HB2) (resid 66 and name HN) 1.8 0.0 4.2


assign (resid 66 and name HB#) (resid 66 and name HD1) 1.8 0.0 1.7


!inter

 
assign (resid 66 and name HA) (resid 65 and name HN) 1.8 0.0 4.2


! Two angles Phi and Psi generated from rama.tcl (in talos)
! rama.tcl -in HRDC1_talos.tab


! D2
assign  ( resid 1 and name c ) ( resid 2 and name n )
        ( resid 2 and name ca) ( resid 2 and name c ) 1.0 -120 20 2 


! D3
assign  ( resid 2 and name c ) ( resid 3 and name n )
        ( resid 3 and name ca) ( resid 3 and name c ) 1.0 -96 20 2 

! A4
assign  ( resid 3 and name c ) ( resid 4 and name n )
        ( resid 4 and name ca) ( resid 4 and name c ) 1.0 -116 20 2 


! Y5
assign  ( resid 4 and name c ) ( resid 5 and name n )
        ( resid 5 and name ca) ( resid 5 and name c ) 1.0 -120 20 2 


! A7
assign  ( resid 6 and name c ) ( resid 7 and name n )
        ( resid 7 and name ca) ( resid 7 and name c ) 1.0 -120 20 2 


! K8
assign  ( resid 7 and name c ) ( resid 8 and name n )
        ( resid 8 and name ca) ( resid 8 and name c ) 1.0 -120 20 2 


! N11
assign  ( resid 10 and name c ) ( resid 11 and name n )
        ( resid 11 and name ca) ( resid 11 and name c ) 1.0 -120 20 2 


! C12
assign  ( resid 11 and name c ) ( resid 12 and name n )
        ( resid 12 and name ca) ( resid 12 and name c ) 1.0 -120 20 2 


! Y23
assign  ( resid 22 and name c ) ( resid 23 and name n )                ! PHI
        ( resid 23 and name ca) ( resid 23 and name c ) 1.0 -60 10 2   !


! C24 
assign  ( resid 23 and name c ) ( resid 24 and name n )
        ( resid 24 and name ca) ( resid 24 and name c ) 1.0 -60 10 2 


! N25
assign  ( resid 24 and name c ) ( resid 25 and name n )
        ( resid 25 and name ca) ( resid 25 and name c ) 1.0 -60 10 2 


! G26
assign  ( resid 25 and name c ) ( resid 26 and name n )
        ( resid 26 and name ca) ( resid 26 and name c ) 1.0 -60 10 2 


! V27
assign  ( resid 26 and name c ) ( resid 27 and name n )
        ( resid 27 and name ca) ( resid 27 and name c ) 1.0 -60 10 2 


! C28
assign  ( resid 27 and name c ) ( resid 28 and name n )
        ( resid 28 and name ca) ( resid 28 and name c ) 1.0 -60 10 2 


! T29
assign  ( resid 28 and name c ) ( resid 29 and name n )
        ( resid 29 and name ca) ( resid 29 and name c ) 1.0 -60 10 2 


! K30
assign  ( resid 29 and name c ) ( resid 30 and name n )
        ( resid 30 and name ca) ( resid 30 and name c ) 1.0 -60 10 2 


! N31
assign  ( resid 30 and name c ) ( resid 31 and name n )
        ( resid 31 and name ca) ( resid 31 and name c ) 1.0 -60 10 2 


! S35
assign  ( resid 34 and name c ) ( resid 35 and name n )
        ( resid 35 and name ca) ( resid 35 and name c ) 1.0 -123 20 2 


! G36
assign  ( resid 35 and name c ) ( resid 36 and name n )
        ( resid 36 and name ca) ( resid 36 and name c ) 1.0 -123 20 2 


! Y37
assign  ( resid 36 and name c ) ( resid 37 and name n )
        ( resid 37 and name ca) ( resid 37 and name c ) 1.0 -120 20 2 


! C38
assign  ( resid 37 and name c ) ( resid 38 and name n )
        ( resid 38 and name ca) ( resid 38 and name c ) 1.0 -120 20 2 


! Q39
assign  ( resid 38 and name c ) ( resid 39 and name n )
        ( resid 39 and name ca) ( resid 39 and name c ) 1.0 -120 20 2


! I40
assign  ( resid 39 and name c ) ( resid 40 and name n )
        ( resid 40 and name ca) ( resid 40 and name c ) 1.0 -114 20 2


! N46
assign  ( resid 45 and name c ) ( resid 46 and name n )
        ( resid 46 and name ca) ( resid 46 and name c ) 1.0 -120 20 2 


! G47
assign  ( resid 46 and name c ) ( resid 47 and name n )
        ( resid 47 and name ca) ( resid 47 and name c ) 1.0 -120 20 2 


! C48
assign  ( resid 47 and name c ) ( resid 48 and name n )
        ( resid 48 and name ca) ( resid 48 and name c ) 1.0 -120 20 2 

! W49
assign  ( resid 48 and name c ) ( resid 49 and name n )
        ( resid 49 and name ca) ( resid 49 and name c ) 1.0 -120 20 2 

! C50
assign  ( resid 49 and name c ) ( resid 50 and name n )
        ( resid 50 and name ca) ( resid 50 and name c ) 1.0 -120 20 2 

! I51
assign  ( resid 50 and name c ) ( resid 51 and name n )
        ( resid 51 and name ca) ( resid 51 and name c ) 1.0 -120 20 2 


! h-bonds added based on H-D exchange, confirmed in NOESY, TOCSY or dqCOSY acquired in D2O, 


! assign (resid    5 and name hn) (resid   48 and name o) 2.0 0.8 0.2
! assign (resid    5 and name  n) (resid   48 and name o) 3.0 0.8 0.2
assign (resid   48 and name hn) (resid    5 and name o) 2.0 0.8 0.2
assign (resid   48 and name  n) (resid    5 and name o) 3.0 0.8 0.2

assign (resid   50 and name hn) (resid    3 and name o) 2.0 0.8 0.2
assign (resid   50 and name  n) (resid    3 and name o) 3.0 0.8 0.2
assign (resid   3 and name hn) (resid    50 and name o) 2.0 0.8 0.2
assign (resid   3 and name  n) (resid    50 and name o) 3.0 0.8 0.2


assign (resid   35 and name hn) (resid   51 and name o) 2.0 0.8 0.5
assign (resid   35 and name  n) (resid   51 and name o) 3.0 0.8 0.5
assign (resid   51 and name hn) (resid   35 and name o) 2.0 0.8 0.5
assign (resid   51 and name  n) (resid   35 and name o) 3.0 0.8 0.2

assign (resid   37 and name hn) (resid   49 and name o) 2.0 0.8 0.2
assign (resid   37 and name  n) (resid   49 and name o) 3.0 0.8 0.2
assign (resid   49 and name hn) (resid   37 and name o) 2.0 0.8 0.2
assign (resid   49 and name  n) (resid   37 and name o) 3.0 0.8 0.2


assign (resid   39 and name hn) (resid   47 and name o) 2.0 0.8 0.2
assign (resid   39 and name  n) (resid   47 and name o) 3.0 0.8 0.2
assign (resid   47 and name hn) (resid   39 and name o) 2.0 0.8 0.2
assign (resid   47 and name  n) (resid   39 and name o) 3.0 0.8 0.2


!assign (residue 30 and name HN) (residue 26 and name O) 2.0 0.8 0.2
!assign (residue 30 and name  N) (residue 26 and name O) 3.0 0.8 0.2

assign (residue 29 and name HN) (residue 25 and name O) 2.0 0.8 0.2
assign (residue 29 and name  N) (residue 25 and name O) 3.0 0.8 0.2

assign (residue 28 and name HN) (residue 24 and name O) 2.0 0.8 0.2
assign (residue 28 and name  N) (residue 24 and name O) 3.0 0.8 0.2

assign (residue 27 and name HN) (residue 23 and name O) 2.0 0.8 0.2
assign (residue 27 and name  N) (residue 23 and name O) 3.0 0.8 0.2

assign (residue 26 and name HN) (residue 22 and name O) 2.0 0.8 0.2
assign (residue 26 and name  N) (residue 22 and name O) 3.0 0.8 0.2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ALA   1           H1       ALA   1  -8.448   7.564   7.372
    2    H2   ALA   1           H2       ALA   1  -7.927   7.447   5.759
    3    H3   ALA   1           H3       ALA   1  -8.975   8.699   6.226
    4    HA   ALA   1           HA       ALA   1  -7.017   9.840   6.203
    5    HB1  ALA   1           HB1      ALA   1  -6.097   9.307   8.757
    6    HB2  ALA   1           HB2      ALA   1  -7.779   8.784   8.834
    7    HB3  ALA   1           HB3      ALA   1  -7.390  10.437   8.358
    8    H    ARG   2           H        ARG   2  -6.633   6.444   6.873
    9    HA   ARG   2           HA       ARG   2  -3.798   6.658   5.971
   10    HB2  ARG   2           HB3      ARG   2  -3.088   5.049   7.652
   11    HB3  ARG   2           HB2      ARG   2  -3.885   6.396   8.465
   12    HG2  ARG   2           HG3      ARG   2  -6.024   5.039   8.402
   13    HG3  ARG   2           HG2      ARG   2  -5.056   3.672   7.847
   14    HD2  ARG   2           HD3      ARG   2  -3.628   3.911   9.883
   15    HD3  ARG   2           HD2      ARG   2  -4.708   5.184  10.452
   16    HE   ARG   2           HE       ARG   2  -5.242   2.336  10.561
   17   HH11  ARG   2          HH22      ARG   2  -6.597   5.481  10.167
   18   HH12  ARG   2          HH21      ARG   2  -8.155   5.032  10.774
   19   HH21  ARG   2          HH11      ARG   2  -7.270   1.731  11.358
   20   HH22  ARG   2          HH12      ARG   2  -8.535   2.909  11.449
   21    H    ASP   3           H        ASP   3  -2.994   4.547   5.106
   22    HA   ASP   3           HA       ASP   3  -5.202   3.128   3.730
   23    HB2  ASP   3           HB3      ASP   3  -2.201   3.067   3.303
   24    HB3  ASP   3           HB2      ASP   3  -3.369   2.162   2.341
   25    H    ALA   4           H        ALA   4  -5.534   0.896   3.986
   26    HA   ALA   4           HA       ALA   4  -4.213  -0.271   6.369
   27    HB1  ALA   4           HB1      ALA   4  -6.503  -0.506   6.672
   28    HB2  ALA   4           HB2      ALA   4  -6.109  -2.049   5.916
   29    HB3  ALA   4           HB3      ALA   4  -6.808  -0.748   4.951
   30    H    TYR   5           H        TYR   5  -5.401  -1.598   3.266
   31    HA   TYR   5           HA       TYR   5  -3.041  -3.436   3.291
   32    HB2  TYR   5           HB3      TYR   5  -5.466  -3.775   1.540
   33    HB3  TYR   5           HB2      TYR   5  -4.354  -5.005   2.140
   34    HD1  TYR   5           HD1      TYR   5  -7.098  -2.699   3.087
   35    HD2  TYR   5           HD2      TYR   5  -4.637  -6.002   4.305
   36    HE1  TYR   5           HE1      TYR   5  -8.585  -3.088   5.036
   37    HE2  TYR   5           HE2      TYR   5  -6.121  -6.391   6.256
   38    HH   TYR   5           HH       TYR   5  -7.811  -5.551   7.472
   39    H    ILE   6           H        ILE   6  -3.975  -0.587   1.911
   40    HA   ILE   6           HA       ILE   6  -2.794  -1.242  -0.741
   41    HB   ILE   6           HB       ILE   6  -4.375   1.189   0.126
   42   HG12  ILE   6          HG13      ILE   6  -5.194  -1.185  -1.577
   43   HG13  ILE   6          HG12      ILE   6  -5.686  -0.932   0.097
   44   HG21  ILE   6          HG21      ILE   6  -2.801   1.609  -1.738
   45   HG22  ILE   6          HG22      ILE   6  -4.477   1.670  -2.283
   46   HG23  ILE   6          HG23      ILE   6  -3.493   0.245  -2.617
   47   HD11  ILE   6          HD11      ILE   6  -7.343   0.436  -0.565
   48   HD12  ILE   6          HD12      ILE   6  -6.911   0.109  -2.244
   49   HD13  ILE   6          HD13      ILE   6  -6.182   1.473  -1.394
   50    H    ALA   7           H        ALA   7  -0.984  -0.162  -1.475
   51    HA   ALA   7           HA       ALA   7   0.255   1.833   0.367
   52    HB1  ALA   7           HB1      ALA   7   1.233  -0.771  -0.343
   53    HB2  ALA   7           HB2      ALA   7   1.989   0.435   0.700
   54    HB3  ALA   7           HB3      ALA   7   2.303   0.445  -1.035
   55    H    LYS   8           H        LYS   8  -0.495   0.787  -2.843
   56    HA   LYS   8           HA       LYS   8   1.028   3.062  -4.005
   57    HB2  LYS   8           HB3      LYS   8  -0.381   1.235  -5.838
   58    HB3  LYS   8           HB2      LYS   8   1.293   1.787  -5.875
   59    HG2  LYS   8           HG3      LYS   8   1.650   0.234  -3.840
   60    HG3  LYS   8           HG2      LYS   8   0.115  -0.500  -4.301
   61    HD2  LYS   8           HD3      LYS   8   2.483  -0.176  -6.168
   62    HD3  LYS   8           HD2      LYS   8   2.106  -1.659  -5.293
   63    HE2  LYS   8           HE3      LYS   8  -0.310  -1.102  -6.451
   64    HE3  LYS   8           HE2      LYS   8   0.806  -0.498  -7.676
   65    HZ1  LYS   8           HZ1      LYS   8   1.422  -2.552  -8.208
   66    HZ2  LYS   8           HZ2      LYS   8   0.083  -3.095  -7.321
   67    HZ3  LYS   8           HZ3      LYS   8   1.612  -3.019  -6.586
   68    HA   PRO   9           HA       PRO   9  -2.279   5.833  -4.836
   69    HB2  PRO   9           HB2      PRO   9  -1.921   4.971  -7.700
   70    HB3  PRO   9           HB3      PRO   9  -2.168   6.604  -7.047
   71    HG2  PRO   9           HG3      PRO   9   0.255   5.722  -7.703
   72    HG3  PRO   9           HG2      PRO   9  -0.002   6.774  -6.301
   73    HD2  PRO   9           HD3      PRO   9   0.747   3.920  -6.363
   74    HD3  PRO   9           HD2      PRO   9   0.910   5.095  -5.041
   75    H    HIS  10           H        HIS  10  -3.521   4.521  -7.675
   76    HA   HIS  10           HA       HIS  10  -5.885   3.535  -6.243
   77    HB2  HIS  10           HB3      HIS  10  -5.278   3.757  -9.208
   78    HB3  HIS  10           HB2      HIS  10  -6.838   3.290  -8.529
   79    HD1  HIS  10           HD1      HIS  10  -4.590   6.239  -9.037
   80    HD2  HIS  10           HD2      HIS  10  -8.271   5.422  -7.252
   81    HE1  HIS  10           HE1      HIS  10  -5.660   8.482  -8.539
   82    HE2  HIS  10           HE2      HIS  10  -7.900   7.996  -7.453
   83    H    ASN  11           H        ASN  11  -2.983   2.204  -7.125
   84    HA   ASN  11           HA       ASN  11  -4.139  -0.459  -7.782
   85    HB2  ASN  11           HB3      ASN  11  -1.254   0.480  -7.801
   86    HB3  ASN  11           HB2      ASN  11  -1.842  -1.075  -8.389
   87   HD21  ASN  11          HD22      ASN  11  -0.780   1.750  -9.601
   88   HD22  ASN  11          HD21      ASN  11  -1.768   1.898 -10.974
   89    H    CYS  12           H        CYS  12  -3.556  -2.306  -6.505
   90    HA   CYS  12           HA       CYS  12  -2.747  -1.605  -3.717
   91    HB2  CYS  12           HB3      CYS  12  -4.209  -4.075  -4.692
   92    HB3  CYS  12           HB2      CYS  12  -3.938  -3.605  -3.017
   93    H    VAL  13           H        VAL  13  -1.505  -3.394  -2.586
   94    HA   VAL  13           HA       VAL  13   0.736  -4.204  -4.292
   95    HB   VAL  13           HB       VAL  13   0.215  -4.854  -1.374
   96   HG11  VAL  13          HG11      VAL  13   2.825  -4.868  -1.490
   97   HG12  VAL  13          HG12      VAL  13   2.580  -5.078  -3.224
   98   HG13  VAL  13          HG13      VAL  13   1.943  -6.272  -2.093
   99   HG21  VAL  13          HG21      VAL  13   0.240  -2.484  -1.494
  100   HG22  VAL  13          HG22      VAL  13   1.484  -2.477  -2.744
  101   HG23  VAL  13          HG23      VAL  13   1.900  -2.916  -1.087
  102    H    TYR  14           H        TYR  14   1.035  -6.228  -5.149
  103    HA   TYR  14           HA       TYR  14  -1.102  -8.106  -5.250
  104    HB2  TYR  14           HB3      TYR  14   0.411  -9.541  -6.423
  105    HB3  TYR  14           HB2      TYR  14   0.859  -7.895  -6.868
  106    HD1  TYR  14           HD2      TYR  14   2.827  -6.796  -5.789
  107    HD2  TYR  14           HD1      TYR  14   1.897 -10.943  -5.161
  108    HE1  TYR  14           HE2      TYR  14   5.120  -7.178  -4.922
  109    HE2  TYR  14           HE1      TYR  14   4.190 -11.325  -4.294
  110    HH   TYR  14           HH       TYR  14   6.525 -10.091  -4.668
  111    H    GLU  15           H        GLU  15   1.822  -8.004  -3.227
  112    HA   GLU  15           HA       GLU  15   0.553  -9.385  -1.056
  113    HB2  GLU  15           HB3      GLU  15   0.839 -11.298  -2.697
  114    HB3  GLU  15           HB2      GLU  15   2.581 -11.060  -2.563
  115    HG2  GLU  15           HG3      GLU  15   2.408 -11.388  -0.101
  116    HG3  GLU  15           HG2      GLU  15   0.689 -11.731  -0.293
  117    H    CYS  16           H        CYS  16   1.589  -7.706   0.137
  118    HA   CYS  16           HA       CYS  16   4.421  -7.190  -0.084
  119    HB2  CYS  16           HB3      CYS  16   4.153  -5.797   1.856
  120    HB3  CYS  16           HB2      CYS  16   2.695  -5.604   0.886
  121    H    PHE  17           H        PHE  17   6.102  -8.206   0.938
  122    HA   PHE  17           HA       PHE  17   5.387 -10.487   2.730
  123    HB2  PHE  17           HB3      PHE  17   7.148 -11.686   1.821
  124    HB3  PHE  17           HB2      PHE  17   6.705 -10.697   0.434
  125    HD1  PHE  17           HD2      PHE  17   7.881  -8.341   0.285
  126    HD2  PHE  17           HD1      PHE  17   9.360 -11.660   2.577
  127    HE1  PHE  17           HE2      PHE  17  10.150  -7.339   0.275
  128    HE2  PHE  17           HE1      PHE  17  11.626 -10.656   2.568
  129    HZ   PHE  17           HZ       PHE  17  12.021  -8.498   1.419
  130    H    ASP  18           H        ASP  18   8.200 -10.743   3.598
  131    HA   ASP  18           HA       ASP  18   8.092  -9.173   5.954
  132    HB2  ASP  18           HB3      ASP  18  10.485 -10.417   4.569
  133    HB3  ASP  18           HB2      ASP  18  10.520  -9.746   6.199
  134    H    ALA  19           H        ALA  19   8.874  -7.147   6.461
  135    HA   ALA  19           HA       ALA  19   9.404  -5.340   4.240
  136    HB1  ALA  19           HB1      ALA  19   9.715  -3.662   6.132
  137    HB2  ALA  19           HB2      ALA  19   9.338  -4.979   7.243
  138    HB3  ALA  19           HB3      ALA  19   8.138  -4.450   6.063
  139    H    PHE  20           H        PHE  20  11.370  -7.572   5.453
  140    HA   PHE  20           HA       PHE  20  13.724  -6.316   6.338
  141    HB2  PHE  20           HB3      PHE  20  13.384  -8.795   6.159
  142    HB3  PHE  20           HB2      PHE  20  13.584  -8.656   4.411
  143    HD1  PHE  20           HD1      PHE  20  15.273  -8.270   7.686
  144    HD2  PHE  20           HD2      PHE  20  15.749  -8.283   3.416
  145    HE1  PHE  20           HE1      PHE  20  17.737  -8.341   7.961
  146    HE2  PHE  20           HE2      PHE  20  18.213  -8.354   3.692
  147    HZ   PHE  20           HZ       PHE  20  19.207  -8.383   5.964
  148    H    SER  21           H        SER  21  12.577  -6.822   3.005
  149    HA   SER  21           HA       SER  21  14.876  -5.355   1.908
  150    HB2  SER  21           HB3      SER  21  12.363  -6.409   0.575
  151    HB3  SER  21           HB2      SER  21  13.739  -5.709  -0.270
  152    HG   SER  21           HG       SER  21  14.282  -7.777  -0.269
  153    H    SER  22           H        SER  22  12.340  -4.359   3.619
  154    HA   SER  22           HA       SER  22  11.126  -2.356   3.766
  155    HB2  SER  22           HB3      SER  22  13.431  -1.405   2.041
  156    HB3  SER  22           HB2      SER  22  12.287  -0.351   2.865
  157    HG   SER  22           HG       SER  22  13.075  -1.000   4.797
  158    H    TYR  23           H        TYR  23  10.622  -4.251   1.483
  159    HA   TYR  23           HA       TYR  23  10.085  -2.821  -0.918
  160    HB2  TYR  23           HB3      TYR  23  10.028  -5.294  -0.747
  161    HB3  TYR  23           HB2      TYR  23   8.571  -5.180   0.242
  162    HD1  TYR  23           HD1      TYR  23   9.979  -4.744  -3.137
  163    HD2  TYR  23           HD2      TYR  23   6.436  -4.510  -0.720
  164    HE1  TYR  23           HE1      TYR  23   8.591  -4.617  -5.187
  165    HE2  TYR  23           HE2      TYR  23   5.045  -4.386  -2.771
  166    HH   TYR  23           HH       TYR  23   5.177  -3.899  -5.052
  167    H    CYS  24           H        CYS  24   7.869  -3.619   1.771
  168    HA   CYS  24           HA       CYS  24   5.694  -2.047   0.738
  169    HB2  CYS  24           HB3      CYS  24   5.580  -3.878   2.526
  170    HB3  CYS  24           HB2      CYS  24   6.180  -2.667   3.659
  171    H    ASN  25           H        ASN  25   8.063  -1.407   3.324
  172    HA   ASN  25           HA       ASN  25   7.264   1.266   3.858
  173    HB2  ASN  25           HB3      ASN  25  10.063   0.096   3.996
  174    HB3  ASN  25           HB2      ASN  25   9.506   1.551   4.822
  175   HD21  ASN  25          HD22      ASN  25   7.064  -0.851   4.663
  176   HD22  ASN  25          HD21      ASN  25   7.247  -1.466   6.235
  177    H    GLY  26           H        GLY  26   9.413  -0.108   1.420
  178    HA2  GLY  26           HA3      GLY  26  10.566   2.281   0.433
  179    HA3  GLY  26           HA2      GLY  26  10.285   0.838  -0.541
  180    H    VAL  27           H        VAL  27   7.475   0.702  -0.424
  181    HA   VAL  27           HA       VAL  27   6.751   2.586  -2.454
  182    HB   VAL  27           HB       VAL  27   5.018   0.906  -0.620
  183   HG11  VAL  27          HG11      VAL  27   4.389   2.842  -2.798
  184   HG12  VAL  27          HG12      VAL  27   3.440   2.399  -1.380
  185   HG13  VAL  27          HG13      VAL  27   3.479   1.332  -2.783
  186   HG21  VAL  27          HG21      VAL  27   5.229   0.297  -3.497
  187   HG22  VAL  27          HG22      VAL  27   5.312  -0.789  -2.110
  188   HG23  VAL  27          HG23      VAL  27   6.743   0.111  -2.612
  189    H    CYS  28           H        CYS  28   5.987   2.465   1.024
  190    HA   CYS  28           HA       CYS  28   4.553   4.978   1.016
  191    HB2  CYS  28           HB3      CYS  28   5.798   3.320   3.223
  192    HB3  CYS  28           HB2      CYS  28   4.945   4.829   3.537
  193    H    THR  29           H        THR  29   7.914   4.092   1.214
  194    HA   THR  29           HA       THR  29   8.952   6.426   2.483
  195    HB   THR  29           HB       THR  29  10.279   4.705   0.373
  196    HG1  THR  29           HG1      THR  29  10.625   4.480   3.148
  197   HG21  THR  29          HG21      THR  29  11.533   6.728   0.706
  198   HG22  THR  29          HG22      THR  29  12.351   5.458   1.617
  199   HG23  THR  29          HG23      THR  29  11.334   6.630   2.455
  200    H    LYS  30           H        LYS  30   7.967   5.866  -0.854
  201    HA   LYS  30           HA       LYS  30   9.316   7.946  -2.161
  202    HB2  LYS  30           HB3      LYS  30   6.580   6.752  -2.547
  203    HB3  LYS  30           HB2      LYS  30   7.114   8.101  -3.550
  204    HG2  LYS  30           HG3      LYS  30   7.675   6.043  -4.696
  205    HG3  LYS  30           HG2      LYS  30   9.172   6.777  -4.119
  206    HD2  LYS  30           HD3      LYS  30   9.302   5.268  -2.263
  207    HD3  LYS  30           HD2      LYS  30   7.665   4.675  -2.551
  208    HE2  LYS  30           HE3      LYS  30   8.301   3.528  -4.518
  209    HE3  LYS  30           HE2      LYS  30   9.817   4.419  -4.647
  210    HZ1  LYS  30           HZ1      LYS  30  10.464   3.357  -2.498
  211    HZ2  LYS  30           HZ2      LYS  30  10.330   2.284  -3.804
  212    HZ3  LYS  30           HZ3      LYS  30   9.096   2.359  -2.639
  213    H    ASN  31           H        ASN  31   6.523   8.156  -0.015
  214    HA   ASN  31           HA       ASN  31   5.716  10.813  -0.574
  215    HB2  ASN  31           HB3      ASN  31   4.655   9.106   1.043
  216    HB3  ASN  31           HB2      ASN  31   5.840   9.682   2.217
  217   HD21  ASN  31          HD22      ASN  31   5.081  11.369   3.488
  218   HD22  ASN  31          HD21      ASN  31   3.905  12.498   3.016
  219    H    GLY  32           H        GLY  32   8.416   9.578   1.329
  220    HA2  GLY  32           HA3      GLY  32  10.451  10.891   1.604
  221    HA3  GLY  32           HA2      GLY  32   9.476  12.357   1.483
  222    H    ALA  33           H        ALA  33   7.771  10.214   3.341
  223    HA   ALA  33           HA       ALA  33   9.101  10.391   5.882
  224    HB1  ALA  33           HB1      ALA  33   7.038  12.016   6.639
  225    HB2  ALA  33           HB2      ALA  33   7.430  12.679   5.052
  226    HB3  ALA  33           HB3      ALA  33   8.671  12.586   6.302
  227    H    LYS  34           H        LYS  34   6.217   9.971   3.970
  228    HA   LYS  34           HA       LYS  34   4.399   8.978   5.872
  229    HB2  LYS  34           HB3      LYS  34   3.952   9.324   3.421
  230    HB3  LYS  34           HB2      LYS  34   4.861   7.850   3.096
  231    HG2  LYS  34           HG3      LYS  34   3.302   6.544   4.416
  232    HG3  LYS  34           HG2      LYS  34   2.429   7.997   4.878
  233    HD2  LYS  34           HD3      LYS  34   2.143   8.409   2.345
  234    HD3  LYS  34           HD2      LYS  34   2.612   6.721   2.156
  235    HE2  LYS  34           HE3      LYS  34   0.407   6.269   2.456
  236    HE3  LYS  34           HE2      LYS  34   0.721   6.587   4.162
  237    HZ1  LYS  34           HZ1      LYS  34  -0.867   8.127   3.876
  238    HZ2  LYS  34           HZ2      LYS  34  -0.651   8.215   2.196
  239    HZ3  LYS  34           HZ3      LYS  34   0.397   9.062   3.232
  240    H    SER  35           H        SER  35   4.252   7.030   6.998
  241    HA   SER  35           HA       SER  35   6.491   5.105   6.525
  242    HB2  SER  35           HB3      SER  35   5.057   5.726   9.118
  243    HB3  SER  35           HB2      SER  35   6.363   4.561   8.921
  244    HG   SER  35           HG       SER  35   6.441   7.373   8.547
  245    H    GLY  36           H        GLY  36   5.934   2.983   6.182
  246    HA2  GLY  36           HA3      GLY  36   3.211   2.087   6.919
  247    HA3  GLY  36           HA2      GLY  36   3.683   1.955   5.225
  248    H    TYR  37           H        TYR  37   3.000  -0.303   6.755
  249    HA   TYR  37           HA       TYR  37   5.572  -1.761   6.632
  250    HB2  TYR  37           HB3      TYR  37   5.299  -2.829   8.743
  251    HB3  TYR  37           HB2      TYR  37   5.068  -1.108   9.034
  252    HD1  TYR  37           HD2      TYR  37   2.791  -0.182   9.345
  253    HD2  TYR  37           HD1      TYR  37   3.510  -4.395   8.988
  254    HE1  TYR  37           HE2      TYR  37   0.540  -0.642  10.289
  255    HE2  TYR  37           HE1      TYR  37   1.267  -4.860   9.937
  256    HH   TYR  37           HH       TYR  37  -0.378  -3.565  11.495
  257    H    CYS  38           H        CYS  38   5.091  -4.226   6.707
  258    HA   CYS  38           HA       CYS  38   2.765  -4.655   4.915
  259    HB2  CYS  38           HB3      CYS  38   4.816  -5.449   3.994
  260    HB3  CYS  38           HB2      CYS  38   5.251  -6.268   5.490
  261    H    GLN  39           H        GLN  39   0.974  -5.598   5.652
  262    HA   GLN  39           HA       GLN  39   1.157  -7.325   8.091
  263    HB2  GLN  39           HB3      GLN  39  -0.133  -5.016   8.150
  264    HB3  GLN  39           HB2      GLN  39  -1.386  -5.931   7.311
  265    HG2  GLN  39           HG3      GLN  39  -1.301  -7.644   9.132
  266    HG3  GLN  39           HG2      GLN  39  -0.145  -6.630   9.989
  267   HE21  GLN  39          HE22      GLN  39  -2.007  -4.385   8.516
  268   HE22  GLN  39          HE21      GLN  39  -3.213  -4.164   9.691
  269    H    ILE  40           H        ILE  40  -1.850  -7.792   7.481
  270    HA   ILE  40           HA       ILE  40  -1.369  -9.871   5.391
  271    HB   ILE  40           HB       ILE  40  -3.163 -11.150   6.436
  272   HG12  ILE  40          HG13      ILE  40  -3.360  -8.821   8.378
  273   HG13  ILE  40          HG12      ILE  40  -4.560  -9.225   7.150
  274   HG21  ILE  40          HG21      ILE  40  -0.676 -10.553   7.603
  275   HG22  ILE  40          HG22      ILE  40  -1.686 -11.962   7.930
  276   HG23  ILE  40          HG23      ILE  40  -1.832 -10.518   8.935
  277   HD11  ILE  40          HD11      ILE  40  -3.759 -10.872   9.557
  278   HD12  ILE  40          HD12      ILE  40  -4.715 -11.524   8.226
  279   HD13  ILE  40          HD13      ILE  40  -5.344 -10.192   9.195
  280    H    LEU  41           H        LEU  41  -2.802 -10.010   3.661
  281    HA   LEU  41           HA       LEU  41  -4.141  -7.657   2.803
  282    HB2  LEU  41           HB3      LEU  41  -3.412  -9.553   1.321
  283    HB3  LEU  41           HB2      LEU  41  -4.752 -10.505   1.959
  284    HG   LEU  41           HG       LEU  41  -6.309  -8.673   1.212
  285   HD11  LEU  41          HD11      LEU  41  -5.335  -6.704   0.684
  286   HD12  LEU  41          HD12      LEU  41  -4.832  -7.470  -0.822
  287   HD13  LEU  41          HD13      LEU  41  -3.739  -7.445   0.562
  288   HD21  LEU  41          HD21      LEU  41  -5.779  -9.197  -1.340
  289   HD22  LEU  41          HD22      LEU  41  -6.366 -10.462  -0.261
  290   HD23  LEU  41          HD23      LEU  41  -4.646 -10.347  -0.629
  291    H    GLY  42           H        GLY  42  -5.308 -10.501   4.544
  292    HA2  GLY  42           HA3      GLY  42  -7.175  -9.701   6.198
  293    HA3  GLY  42           HA2      GLY  42  -8.022  -9.288   4.704
  294    H    THR  43           H        THR  43  -7.764 -11.260   3.036
  295    HA   THR  43           HA       THR  43  -8.767 -13.649   4.499
  296    HB   THR  43           HB       THR  43  -9.017 -13.577   1.558
  297    HG1  THR  43           HG1      THR  43  -9.448 -11.456   1.829
  298   HG21  THR  43          HG21      THR  43 -11.219 -14.425   2.061
  299   HG22  THR  43          HG22      THR  43 -11.080 -13.925   3.746
  300   HG23  THR  43          HG23      THR  43 -10.076 -15.238   3.130
  301    H    TYR  44           H        TYR  44  -7.138 -13.163   1.372
  302    HA   TYR  44           HA       TYR  44  -5.099 -15.180   2.212
  303    HB2  TYR  44           HB3      TYR  44  -6.388 -14.931  -0.523
  304    HB3  TYR  44           HB2      TYR  44  -5.127 -16.082  -0.078
  305    HD1  TYR  44           HD1      TYR  44  -5.600 -17.834   1.666
  306    HD2  TYR  44           HD2      TYR  44  -8.678 -15.319   0.037
  307    HE1  TYR  44           HE1      TYR  44  -7.327 -19.401   2.511
  308    HE2  TYR  44           HE2      TYR  44 -10.404 -16.886   0.883
  309    HH   TYR  44           HH       TYR  44  -9.648 -19.444   3.075
  310    H    GLY  45           H        GLY  45  -2.984 -14.801   1.368
  311    HA2  GLY  45           HA3      GLY  45  -1.328 -13.589   0.138
  312    HA3  GLY  45           HA2      GLY  45  -2.571 -12.441  -0.358
  313    H    ASN  46           H        ASN  46  -0.752 -10.910   0.308
  314    HA   ASN  46           HA       ASN  46  -0.902 -10.348   3.226
  315    HB2  ASN  46           HB3      ASN  46   1.360  -9.868   1.272
  316    HB3  ASN  46           HB2      ASN  46   1.344  -9.305   2.937
  317   HD21  ASN  46          HD22      ASN  46   0.215 -11.548   4.247
  318   HD22  ASN  46          HD21      ASN  46   1.266 -12.872   4.084
  319    H    GLY  47           H        GLY  47  -0.609  -7.954   3.714
  320    HA2  GLY  47           HA3      GLY  47  -1.569  -6.237   1.462
  321    HA3  GLY  47           HA2      GLY  47  -2.403  -6.194   3.015
  322    H    CYS  48           H        CYS  48  -0.956  -4.006   1.660
  323    HA   CYS  48           HA       CYS  48   1.360  -3.611   3.473
  324    HB2  CYS  48           HB3      CYS  48   0.629  -2.661   0.797
  325    HB3  CYS  48           HB2      CYS  48   1.234  -1.384   1.851
  326    H    TRP  49           H        TRP  49   1.383  -1.983   5.000
  327    HA   TRP  49           HA       TRP  49  -1.177  -0.491   5.368
  328    HB2  TRP  49           HB3      TRP  49  -0.198  -2.229   7.120
  329    HB3  TRP  49           HB2      TRP  49   0.818  -0.860   7.567
  330    HD1  TRP  49           HD1      TRP  49  -0.373   1.298   8.568
  331    HE1  TRP  49           HE1      TRP  49  -2.681   1.626   9.671
  332    HE3  TRP  49           HE3      TRP  49  -2.667  -3.020   7.104
  333    HZ2  TRP  49           HZ2      TRP  49  -5.172   0.235   9.902
  334    HZ3  TRP  49           HZ3      TRP  49  -5.002  -3.496   7.779
  335    HH2  TRP  49           HH2      TRP  49  -6.256  -1.876   9.175
  336    H    CYS  50           H        CYS  50  -1.024   1.709   5.183
  337    HA   CYS  50           HA       CYS  50   1.679   2.950   5.494
  338    HB2  CYS  50           HB3      CYS  50   0.489   2.733   3.090
  339    HB3  CYS  50           HB2      CYS  50  -0.272   4.223   3.648
  340    H    ILE  51           H        ILE  51   1.730   4.744   6.807
  341    HA   ILE  51           HA       ILE  51  -0.900   5.700   7.847
  342    HB   ILE  51           HB       ILE  51   1.776   5.595   9.257
  343   HG12  ILE  51          HG13      ILE  51  -0.472   4.088  10.367
  344   HG13  ILE  51          HG12      ILE  51  -0.040   3.546   8.746
  345   HG21  ILE  51          HG21      ILE  51  -0.632   7.102   9.751
  346   HG22  ILE  51          HG22      ILE  51   0.866   7.086  10.679
  347   HG23  ILE  51          HG23      ILE  51  -0.405   5.919  11.039
  348   HD11  ILE  51          HD11      ILE  51   2.067   3.989  10.857
  349   HD12  ILE  51          HD12      ILE  51   2.177   3.031   9.380
  350   HD13  ILE  51          HD13      ILE  51   1.203   2.457  10.733
  351    H    ALA  52           H        ALA  52  -1.321   7.835   7.831
  352    HA   ALA  52           HA       ALA  52   0.295  10.050   8.038
  353    HB1  ALA  52           HB1      ALA  52   0.420   8.873   5.283
  354    HB2  ALA  52           HB2      ALA  52   1.701   9.646   6.223
  355    HB3  ALA  52           HB3      ALA  52   0.446  10.624   5.466
  356    H    LEU  53           H        LEU  53  -0.759  12.049   6.974
  357    HA   LEU  53           HA       LEU  53  -3.638  11.505   6.376
  358    HB2  LEU  53           HB3      LEU  53  -3.284  12.334   8.728
  359    HB3  LEU  53           HB2      LEU  53  -2.619  13.819   8.045
  360    HG   LEU  53           HG       LEU  53  -4.933  13.637   6.628
  361   HD11  LEU  53          HD11      LEU  53  -5.400  11.574   8.184
  362   HD12  LEU  53          HD12      LEU  53  -6.695  12.730   7.870
  363   HD13  LEU  53          HD13      LEU  53  -5.795  12.802   9.386
  364   HD21  LEU  53          HD21      LEU  53  -4.621  14.829   9.404
  365   HD22  LEU  53          HD22      LEU  53  -5.822  15.313   8.207
  366   HD23  LEU  53          HD23      LEU  53  -4.110  15.595   7.901
  367    HA   PRO  54           HA       PRO  54  -1.502  13.931   2.968
  368    HB2  PRO  54           HB2      PRO  54  -3.783  12.583   1.586
  369    HB3  PRO  54           HB3      PRO  54  -2.100  12.775   1.058
  370    HG2  PRO  54           HG3      PRO  54  -3.033  10.447   1.978
  371    HG3  PRO  54           HG2      PRO  54  -1.369  10.979   2.274
  372    HD2  PRO  54           HD3      PRO  54  -3.662  10.848   4.168
  373    HD3  PRO  54           HD2      PRO  54  -1.918  10.734   4.493
  374    H    ASP  55           H        ASP  55  -3.009  15.227   1.180
  375    HA   ASP  55           HA       ASP  55  -4.334  17.270   2.585
  376    HB2  ASP  55           HB3      ASP  55  -4.769  16.287  -0.250
  377    HB3  ASP  55           HB2      ASP  55  -5.456  17.782   0.383
  378    H    ASN  56           H        ASN  56  -5.623  14.265   1.224
  379    HA   ASN  56           HA       ASN  56  -7.566  13.686   3.066
  380    HB2  ASN  56           HB3      ASN  56  -8.383  16.008   1.422
  381    HB3  ASN  56           HB2      ASN  56  -9.585  14.728   1.553
  382   HD21  ASN  56          HD22      ASN  56  -9.084  13.796   4.180
  383   HD22  ASN  56          HD21      ASN  56  -9.429  15.038   5.284
  384    H    VAL  57           H        VAL  57  -9.695  12.694   1.782
  385    HA   VAL  57           HA       VAL  57 -10.354  10.954   0.351
  386    HB   VAL  57           HB       VAL  57  -8.367  12.132  -1.603
  387   HG11  VAL  57          HG11      VAL  57  -9.587  11.044  -3.226
  388   HG12  VAL  57          HG12      VAL  57 -11.096  11.160  -2.319
  389   HG13  VAL  57          HG13      VAL  57  -9.894   9.945  -1.882
  390   HG21  VAL  57          HG21      VAL  57  -9.711  13.954  -0.615
  391   HG22  VAL  57          HG22      VAL  57 -11.189  13.060  -0.971
  392   HG23  VAL  57          HG23      VAL  57 -10.184  13.664  -2.289
  393    HA   PRO  58           HA       PRO  58  -6.357   8.699   1.243
  394    HB2  PRO  58           HB2      PRO  58  -7.328   7.049   3.184
  395    HB3  PRO  58           HB3      PRO  58  -6.693   8.669   3.527
  396    HG2  PRO  58           HG3      PRO  58  -9.507   7.740   3.337
  397    HG3  PRO  58           HG2      PRO  58  -8.781   8.943   4.415
  398    HD2  PRO  58           HD3      PRO  58 -10.247   9.566   2.149
  399    HD3  PRO  58           HD2      PRO  58  -9.054  10.648   2.900
  400    H    ILE  59           H        ILE  59  -9.416   6.899   1.741
  401    HA   ILE  59           HA       ILE  59  -8.574   5.068  -0.467
  402    HB   ILE  59           HB       ILE  59 -10.279   4.430   1.961
  403   HG12  ILE  59          HG13      ILE  59  -7.470   3.500   1.285
  404   HG13  ILE  59          HG12      ILE  59  -7.824   4.807   2.416
  405   HG21  ILE  59          HG21      ILE  59  -9.455   2.055   0.898
  406   HG22  ILE  59          HG22      ILE  59  -9.644   3.024  -0.563
  407   HG23  ILE  59          HG23      ILE  59 -11.007   2.808   0.534
  408   HD11  ILE  59          HD11      ILE  59  -8.202   3.307   4.048
  409   HD12  ILE  59          HD12      ILE  59  -7.819   2.002   2.925
  410   HD13  ILE  59          HD13      ILE  59  -9.481   2.570   3.082
  411    H    ARG  60           H        ARG  60  -9.932   5.080  -2.194
  412    HA   ARG  60           HA       ARG  60 -12.687   6.162  -1.795
  413    HB2  ARG  60           HB3      ARG  60 -11.285   6.048  -4.457
  414    HB3  ARG  60           HB2      ARG  60 -12.608   7.097  -3.952
  415    HG2  ARG  60           HG3      ARG  60 -10.917   8.624  -3.719
  416    HG3  ARG  60           HG2      ARG  60 -10.734   7.838  -2.151
  417    HD2  ARG  60           HD3      ARG  60  -9.055   6.297  -3.136
  418    HD3  ARG  60           HD2      ARG  60  -9.211   7.139  -4.677
  419    HE   ARG  60           HE       ARG  60  -8.592   9.081  -2.705
  420   HH11  ARG  60          HH22      ARG  60  -7.264   6.295  -4.242
  421   HH12  ARG  60          HH21      ARG  60  -5.623   6.824  -4.083
  422   HH21  ARG  60          HH11      ARG  60  -6.454   9.790  -2.489
  423   HH22  ARG  60          HH12      ARG  60  -5.164   8.803  -3.091
  424    H    ILE  61           H        ILE  61 -11.080   3.332  -2.137
  425    HA   ILE  61           HA       ILE  61 -13.395   2.072  -3.546
  426    HB   ILE  61           HB       ILE  61 -11.506   0.365  -4.276
  427   HG12  ILE  61          HG13      ILE  61  -9.901   2.005  -2.885
  428   HG13  ILE  61          HG12      ILE  61  -9.338   1.137  -4.313
  429   HG21  ILE  61          HG21      ILE  61 -12.132   3.052  -5.504
  430   HG22  ILE  61          HG22      ILE  61 -12.783   1.473  -5.942
  431   HG23  ILE  61          HG23      ILE  61 -11.108   1.872  -6.323
  432   HD11  ILE  61          HD11      ILE  61  -8.856   3.666  -4.221
  433   HD12  ILE  61          HD12      ILE  61 -10.580   3.882  -4.519
  434   HD13  ILE  61          HD13      ILE  61  -9.580   3.044  -5.704
  435    HA   PRO  62           HA       PRO  62 -13.703  -0.649  -0.082
  436    HB2  PRO  62           HB2      PRO  62 -13.989  -3.097  -1.415
  437    HB3  PRO  62           HB3      PRO  62 -15.302  -1.971  -1.028
  438    HG2  PRO  62           HG3      PRO  62 -13.852  -2.385  -3.579
  439    HG3  PRO  62           HG2      PRO  62 -15.544  -1.942  -3.294
  440    HD2  PRO  62           HD3      PRO  62 -13.706  -0.127  -4.118
  441    HD3  PRO  62           HD2      PRO  62 -15.056   0.315  -3.050
  442    H    GLY  63           H        GLY  63 -11.101  -0.669  -2.146
  443    HA2  GLY  63           HA3      GLY  63  -8.878  -1.233  -1.322
  444    HA3  GLY  63           HA2      GLY  63  -9.607  -2.518  -0.361
  445    H    LYS  64           H        LYS  64 -11.177  -2.648  -3.232
  446    HA   LYS  64           HA       LYS  64  -9.581  -4.953  -4.113
  447    HB2  LYS  64           HB3      LYS  64 -12.104  -4.951  -4.093
  448    HB3  LYS  64           HB2      LYS  64 -12.055  -3.768  -5.400
  449    HG2  LYS  64           HG3      LYS  64 -10.724  -5.366  -6.764
  450    HG3  LYS  64           HG2      LYS  64 -10.865  -6.557  -5.470
  451    HD2  LYS  64           HD3      LYS  64 -13.359  -6.396  -5.666
  452    HD3  LYS  64           HD2      LYS  64 -13.139  -5.343  -7.064
  453    HE2  LYS  64           HE3      LYS  64 -11.480  -7.549  -7.561
  454    HE3  LYS  64           HE2      LYS  64 -12.968  -8.238  -6.910
  455    HZ1  LYS  64           HZ1      LYS  64 -12.592  -7.438  -9.471
  456    HZ2  LYS  64           HZ2      LYS  64 -13.421  -6.121  -8.797
  457    HZ3  LYS  64           HZ3      LYS  64 -14.101  -7.676  -8.727
  458    H    CYS  65           H        CYS  65  -8.123  -4.883  -5.761
  459    HA   CYS  65           HA       CYS  65  -8.027  -2.397  -7.426
  460    HB2  CYS  65           HB3      CYS  65  -5.902  -4.113  -6.208
  461    HB3  CYS  65           HB2      CYS  65  -5.557  -3.323  -7.746
  462    H    HIS  66           H        HIS  66  -7.310  -2.726  -9.674
  463    HA   HIS  66           HA       HIS  66  -8.656  -4.935 -10.932
  464    HB2  HIS  66           HB3      HIS  66  -8.295  -2.740 -12.040
  465    HB3  HIS  66           HB2      HIS  66  -6.563  -3.068 -12.091
  466    HD1  HIS  66           HD1      HIS  66  -5.709  -4.722 -13.852
  467    HD2  HIS  66           HD2      HIS  66  -9.869  -4.416 -13.792
  468    HE1  HIS  66           HE1      HIS  66  -6.549  -5.942 -15.910
  469    HE2  HIS  66           HE2      HIS  66  -9.078  -5.761 -15.882
  Start of MODEL    2
    1    H1   ALA   1           H1       ALA   1  -2.160  11.578   2.775
    2    H2   ALA   1           H2       ALA   1  -1.415  10.269   1.988
    3    H3   ALA   1           H3       ALA   1  -1.213  10.484   3.660
    4    HA   ALA   1           HA       ALA   1  -3.789  10.298   3.717
    5    HB1  ALA   1           HB1      ALA   1  -4.506  10.079   1.547
    6    HB2  ALA   1           HB2      ALA   1  -4.153   8.379   1.854
    7    HB3  ALA   1           HB3      ALA   1  -2.979   9.383   1.005
    8    H    ARG   2           H        ARG   2  -4.497   7.701   3.717
    9    HA   ARG   2           HA       ARG   2  -2.190   6.255   4.964
   10    HB2  ARG   2           HB3      ARG   2  -3.789   7.123   6.674
   11    HB3  ARG   2           HB2      ARG   2  -5.076   6.200   5.895
   12    HG2  ARG   2           HG3      ARG   2  -3.746   4.115   6.261
   13    HG3  ARG   2           HG2      ARG   2  -2.555   5.068   7.144
   14    HD2  ARG   2           HD3      ARG   2  -4.379   5.801   8.700
   15    HD3  ARG   2           HD2      ARG   2  -5.471   4.691   7.871
   16    HE   ARG   2           HE       ARG   2  -3.189   3.206   8.667
   17   HH11  ARG   2          HH22      ARG   2  -5.830   4.987   9.985
   18   HH12  ARG   2          HH21      ARG   2  -5.920   4.041  11.433
   19   HH21  ARG   2          HH11      ARG   2  -3.289   1.961  10.553
   20   HH22  ARG   2          HH12      ARG   2  -4.482   2.328  11.755
   21    H    ASP   3           H        ASP   3  -1.904   4.203   4.197
   22    HA   ASP   3           HA       ASP   3  -3.932   3.175   2.283
   23    HB2  ASP   3           HB3      ASP   3  -1.080   2.306   2.801
   24    HB3  ASP   3           HB2      ASP   3  -2.134   1.637   1.563
   25    H    ALA   4           H        ALA   4  -4.882   1.141   2.589
   26    HA   ALA   4           HA       ALA   4  -4.493  -0.034   5.299
   27    HB1  ALA   4           HB1      ALA   4  -6.779   0.606   4.974
   28    HB2  ALA   4           HB2      ALA   4  -6.729  -1.147   4.782
   29    HB3  ALA   4           HB3      ALA   4  -6.815  -0.107   3.360
   30    H    TYR   5           H        TYR   5  -5.887  -1.585   2.444
   31    HA   TYR   5           HA       TYR   5  -3.900  -3.775   2.784
   32    HB2  TYR   5           HB3      TYR   5  -6.292  -3.866   0.954
   33    HB3  TYR   5           HB2      TYR   5  -5.465  -5.201   1.757
   34    HD1  TYR   5           HD2      TYR   5  -5.451  -5.080   4.406
   35    HD2  TYR   5           HD1      TYR   5  -8.269  -3.052   1.880
   36    HE1  TYR   5           HE2      TYR   5  -7.032  -4.910   6.309
   37    HE2  TYR   5           HE1      TYR   5  -9.851  -2.880   3.782
   38    HH   TYR   5           HH       TYR   5 -10.247  -4.211   5.967
   39    H    ILE   6           H        ILE   6  -5.025  -1.360   0.502
   40    HA   ILE   6           HA       ILE   6  -3.174  -2.406  -1.577
   41    HB   ILE   6           HB       ILE   6  -5.274  -0.227  -1.746
   42   HG12  ILE   6          HG13      ILE   6  -5.347  -3.093  -2.738
   43   HG13  ILE   6          HG12      ILE   6  -6.192  -2.508  -1.304
   44   HG21  ILE   6          HG21      ILE   6  -4.366   0.237  -3.747
   45   HG22  ILE   6          HG22      ILE   6  -4.640  -1.432  -4.246
   46   HG23  ILE   6          HG23      ILE   6  -3.120  -0.980  -3.472
   47   HD11  ILE   6          HD11      ILE   6  -6.730  -0.789  -3.571
   48   HD12  ILE   6          HD12      ILE   6  -7.868  -1.671  -2.552
   49   HD13  ILE   6          HD13      ILE   6  -7.139  -2.461  -3.952
   50    H    ALA   7           H        ALA   7  -1.368  -1.232  -2.194
   51    HA   ALA   7           HA       ALA   7  -0.898   1.335  -0.734
   52    HB1  ALA   7           HB1      ALA   7   0.954   0.333   0.049
   53    HB2  ALA   7           HB2      ALA   7   1.574   0.333  -1.601
   54    HB3  ALA   7           HB3      ALA   7   0.694  -1.068  -0.991
   55    H    LYS   8           H        LYS   8  -2.034   0.695  -3.538
   56    HA   LYS   8           HA       LYS   8  -0.155   2.488  -5.009
   57    HB2  LYS   8           HB3      LYS   8  -1.828   0.714  -6.663
   58    HB3  LYS   8           HB2      LYS   8  -0.121   1.114  -6.825
   59    HG2  LYS   8           HG3      LYS   8  -1.264  -0.833  -4.798
   60    HG3  LYS   8           HG2      LYS   8  -0.442  -1.281  -6.290
   61    HD2  LYS   8           HD3      LYS   8   1.154   0.622  -4.804
   62    HD3  LYS   8           HD2      LYS   8   0.756  -0.770  -3.796
   63    HE2  LYS   8           HE3      LYS   8   1.811  -1.052  -6.616
   64    HE3  LYS   8           HE2      LYS   8   2.870  -0.996  -5.207
   65    HZ1  LYS   8           HZ1      LYS   8   1.524  -3.196  -6.212
   66    HZ2  LYS   8           HZ2      LYS   8   0.748  -2.804  -4.755
   67    HZ3  LYS   8           HZ3      LYS   8   2.420  -3.104  -4.772
   68    HA   PRO   9           HA       PRO   9  -3.547   5.237  -5.591
   69    HB2  PRO   9           HB2      PRO   9  -3.213   5.872  -8.296
   70    HB3  PRO   9           HB3      PRO   9  -2.399   6.668  -6.937
   71    HG2  PRO   9           HG3      PRO   9  -1.395   4.584  -8.785
   72    HG3  PRO   9           HG2      PRO   9  -0.529   5.910  -7.992
   73    HD2  PRO   9           HD3      PRO   9  -0.311   3.337  -7.154
   74    HD3  PRO   9           HD2      PRO   9  -0.203   4.711  -6.034
   75    H    HIS  10           H        HIS  10  -3.177   2.611  -7.914
   76    HA   HIS  10           HA       HIS  10  -6.102   2.266  -7.925
   77    HB2  HIS  10           HB3      HIS  10  -4.571   2.568 -10.525
   78    HB3  HIS  10           HB2      HIS  10  -6.304   2.296 -10.346
   79    HD1  HIS  10           HD1      HIS  10  -7.522   4.273  -8.786
   80    HD2  HIS  10           HD2      HIS  10  -3.959   5.253 -10.726
   81    HE1  HIS  10           HE1      HIS  10  -7.418   6.805  -8.865
   82    HE2  HIS  10           HE2      HIS  10  -5.255   7.410 -10.042
   83    H    ASN  11           H        ASN  11  -2.980   1.065  -7.951
   84    HA   ASN  11           HA       ASN  11  -3.845  -1.603  -8.966
   85    HB2  ASN  11           HB3      ASN  11  -1.050  -0.579  -8.379
   86    HB3  ASN  11           HB2      ASN  11  -1.460  -2.123  -9.130
   87   HD21  ASN  11          HD22      ASN  11  -0.863   1.218  -9.763
   88   HD22  ASN  11          HD21      ASN  11  -1.312   1.213 -11.400
   89    H    CYS  12           H        CYS  12  -2.767  -3.463  -7.680
   90    HA   CYS  12           HA       CYS  12  -2.928  -2.854  -4.757
   91    HB2  CYS  12           HB3      CYS  12  -3.826  -5.342  -6.241
   92    HB3  CYS  12           HB2      CYS  12  -3.834  -5.157  -4.487
   93    H    VAL  13           H        VAL  13  -1.856  -4.843  -3.519
   94    HA   VAL  13           HA       VAL  13   0.868  -5.079  -4.669
   95    HB   VAL  13           HB       VAL  13  -0.167  -5.847  -1.921
   96   HG11  VAL  13          HG11      VAL  13   2.474  -5.984  -3.291
   97   HG12  VAL  13          HG12      VAL  13   1.808  -7.017  -2.027
   98   HG13  VAL  13          HG13      VAL  13   2.476  -5.438  -1.614
   99   HG21  VAL  13          HG21      VAL  13   0.007  -3.671  -1.357
  100   HG22  VAL  13          HG22      VAL  13   0.271  -3.289  -3.058
  101   HG23  VAL  13          HG23      VAL  13   1.647  -3.601  -2.000
  102    H    TYR  14           H        TYR  14   1.665  -6.998  -5.420
  103    HA   TYR  14           HA       TYR  14  -0.078  -9.193  -5.967
  104    HB2  TYR  14           HB3      TYR  14   2.781  -9.862  -5.821
  105    HB3  TYR  14           HB2      TYR  14   1.678  -9.948  -7.194
  106    HD1  TYR  14           HD1      TYR  14   1.172  -7.877  -8.517
  107    HD2  TYR  14           HD2      TYR  14   4.181  -7.965  -5.454
  108    HE1  TYR  14           HE1      TYR  14   2.144  -5.776  -9.410
  109    HE2  TYR  14           HE2      TYR  14   5.153  -5.867  -6.344
  110    HH   TYR  14           HH       TYR  14   4.744  -4.093  -7.725
  111    H    GLU  15           H        GLU  15   2.505  -8.823  -3.528
  112    HA   GLU  15           HA       GLU  15   1.135 -10.150  -1.452
  113    HB2  GLU  15           HB3      GLU  15   2.526 -12.315  -1.450
  114    HB3  GLU  15           HB2      GLU  15   1.191 -12.230  -2.595
  115    HG2  GLU  15           HG3      GLU  15   2.765 -11.573  -4.379
  116    HG3  GLU  15           HG2      GLU  15   4.103 -11.665  -3.238
  117    H    CYS  16           H        CYS  16   2.269  -8.250  -0.573
  118    HA   CYS  16           HA       CYS  16   4.992  -7.738  -0.534
  119    HB2  CYS  16           HB3      CYS  16   4.071  -6.166   0.819
  120    HB3  CYS  16           HB2      CYS  16   2.756  -7.236   1.304
  121    H    PHE  17           H        PHE  17   6.708  -8.368   0.981
  122    HA   PHE  17           HA       PHE  17   6.258 -11.022   2.276
  123    HB2  PHE  17           HB3      PHE  17   8.121 -11.982   1.257
  124    HB3  PHE  17           HB2      PHE  17   7.505 -10.975  -0.051
  125    HD1  PHE  17           HD1      PHE  17   8.403  -8.469  -0.044
  126    HD2  PHE  17           HD2      PHE  17  10.362 -11.791   1.846
  127    HE1  PHE  17           HE1      PHE  17  10.552  -7.232  -0.088
  128    HE2  PHE  17           HE2      PHE  17  12.508 -10.553   1.802
  129    HZ   PHE  17           HZ       PHE  17  12.600  -8.274   0.839
  130    H    ASP  18           H        ASP  18   9.168 -11.068   2.966
  131    HA   ASP  18           HA       ASP  18   9.046  -9.833   5.508
  132    HB2  ASP  18           HB3      ASP  18  10.669 -11.626   4.826
  133    HB3  ASP  18           HB2      ASP  18  11.565 -10.403   3.925
  134    H    ALA  19           H        ALA  19   9.407  -7.775   6.185
  135    HA   ALA  19           HA       ALA  19   9.728  -5.667   4.213
  136    HB1  ALA  19           HB1      ALA  19  10.005  -5.288   7.190
  137    HB2  ALA  19           HB2      ALA  19   8.430  -5.593   6.457
  138    HB3  ALA  19           HB3      ALA  19   9.359  -4.167   5.993
  139    H    PHE  20           H        PHE  20  11.977  -7.740   5.354
  140    HA   PHE  20           HA       PHE  20  14.123  -6.242   6.347
  141    HB2  PHE  20           HB3      PHE  20  14.144  -8.721   5.983
  142    HB3  PHE  20           HB2      PHE  20  14.335  -8.428   4.253
  143    HD1  PHE  20           HD2      PHE  20  15.928  -8.029   7.576
  144    HD2  PHE  20           HD1      PHE  20  16.432  -7.697   3.324
  145    HE1  PHE  20           HE2      PHE  20  18.374  -7.768   7.887
  146    HE2  PHE  20           HE1      PHE  20  18.879  -7.437   3.635
  147    HZ   PHE  20           HZ       PHE  20  19.850  -7.472   5.916
  148    H    SER  21           H        SER  21  13.094  -6.642   2.962
  149    HA   SER  21           HA       SER  21  15.187  -4.824   2.010
  150    HB2  SER  21           HB3      SER  21  14.253  -5.201  -0.183
  151    HB3  SER  21           HB2      SER  21  14.282  -6.751   0.651
  152    HG   SER  21           HG       SER  21  12.010  -5.576   1.275
  153    H    SER  22           H        SER  22  12.258  -4.439   3.563
  154    HA   SER  22           HA       SER  22  10.916  -2.554   3.936
  155    HB2  SER  22           HB3      SER  22  12.439  -0.589   2.450
  156    HB3  SER  22           HB2      SER  22  12.181  -0.709   4.188
  157    HG   SER  22           HG       SER  22  14.122  -1.475   4.344
  158    H    TYR  23           H        TYR  23  10.524  -4.209   1.557
  159    HA   TYR  23           HA       TYR  23  10.082  -2.681  -0.794
  160    HB2  TYR  23           HB3      TYR  23   9.984  -5.138  -0.771
  161    HB3  TYR  23           HB2      TYR  23   8.528  -5.078   0.224
  162    HD1  TYR  23           HD1      TYR  23   6.398  -4.307  -0.694
  163    HD2  TYR  23           HD2      TYR  23   9.932  -4.499  -3.129
  164    HE1  TYR  23           HE1      TYR  23   5.007  -4.067  -2.734
  165    HE2  TYR  23           HE2      TYR  23   8.542  -4.257  -5.169
  166    HH   TYR  23           HH       TYR  23   6.347  -4.479  -5.932
  167    H    CYS  24           H        CYS  24   7.818  -3.454   1.857
  168    HA   CYS  24           HA       CYS  24   5.662  -1.889   0.758
  169    HB2  CYS  24           HB3      CYS  24   5.526  -3.720   2.564
  170    HB3  CYS  24           HB2      CYS  24   6.055  -2.476   3.696
  171    H    ASN  25           H        ASN  25   7.942  -1.243   3.427
  172    HA   ASN  25           HA       ASN  25   7.133   1.436   3.906
  173    HB2  ASN  25           HB3      ASN  25   9.911   0.244   4.180
  174    HB3  ASN  25           HB2      ASN  25   9.337   1.719   4.963
  175   HD21  ASN  25          HD22      ASN  25   6.868  -0.645   4.713
  176   HD22  ASN  25          HD21      ASN  25   6.960  -1.245   6.299
  177    H    GLY  26           H        GLY  26   9.416   0.055   1.588
  178    HA2  GLY  26           HA3      GLY  26  10.533   2.488   0.619
  179    HA3  GLY  26           HA2      GLY  26  10.402   0.999  -0.323
  180    H    VAL  27           H        VAL  27   7.556   0.749  -0.215
  181    HA   VAL  27           HA       VAL  27   6.800   2.375  -2.437
  182    HB   VAL  27           HB       VAL  27   5.103   0.869  -0.425
  183   HG11  VAL  27          HG11      VAL  27   3.406   2.076  -1.331
  184   HG12  VAL  27          HG12      VAL  27   3.645   1.057  -2.751
  185   HG13  VAL  27          HG13      VAL  27   4.406   2.646  -2.668
  186   HG21  VAL  27          HG21      VAL  27   5.278  -0.956  -1.830
  187   HG22  VAL  27          HG22      VAL  27   6.839  -0.204  -2.162
  188   HG23  VAL  27          HG23      VAL  27   5.489   0.041  -3.269
  189    H    CYS  28           H        CYS  28   6.182   2.680   1.049
  190    HA   CYS  28           HA       CYS  28   4.512   4.994   0.895
  191    HB2  CYS  28           HB3      CYS  28   6.370   3.979   3.057
  192    HB3  CYS  28           HB2      CYS  28   5.362   5.411   3.267
  193    H    THR  29           H        THR  29   8.014   4.596   0.836
  194    HA   THR  29           HA       THR  29   8.780   7.282   1.309
  195    HB   THR  29           HB       THR  29  10.087   5.361  -0.638
  196    HG1  THR  29           HG1      THR  29  10.351   4.223   1.098
  197   HG21  THR  29          HG21      THR  29  11.729   6.890  -0.794
  198   HG22  THR  29          HG22      THR  29  11.823   7.040   0.960
  199   HG23  THR  29          HG23      THR  29  10.672   8.021   0.054
  200    H    LYS  30           H        LYS  30   7.918   5.672  -1.754
  201    HA   LYS  30           HA       LYS  30   8.295   7.992  -3.400
  202    HB2  LYS  30           HB3      LYS  30   6.351   5.709  -3.849
  203    HB3  LYS  30           HB2      LYS  30   7.011   6.788  -5.077
  204    HG2  LYS  30           HG3      LYS  30   8.651   4.896  -3.366
  205    HG3  LYS  30           HG2      LYS  30   8.182   4.600  -5.040
  206    HD2  LYS  30           HD3      LYS  30   9.315   6.870  -5.552
  207    HD3  LYS  30           HD2      LYS  30  10.060   6.700  -3.963
  208    HE2  LYS  30           HE3      LYS  30  10.200   4.560  -6.098
  209    HE3  LYS  30           HE2      LYS  30  11.444   5.788  -5.871
  210    HZ1  LYS  30           HZ1      LYS  30  10.656   3.596  -4.071
  211    HZ2  LYS  30           HZ2      LYS  30  11.379   4.992  -3.435
  212    HZ3  LYS  30           HZ3      LYS  30  12.207   4.056  -4.586
  213    H    ASN  31           H        ASN  31   5.462   6.669  -1.726
  214    HA   ASN  31           HA       ASN  31   3.594   8.641  -2.635
  215    HB2  ASN  31           HB3      ASN  31   3.637   7.005  -0.079
  216    HB3  ASN  31           HB2      ASN  31   2.252   7.938  -0.651
  217   HD21  ASN  31          HD22      ASN  31   2.108   5.086  -0.339
  218   HD22  ASN  31          HD21      ASN  31   1.943   4.391  -1.879
  219    H    GLY  32           H        GLY  32   6.009   8.617  -0.105
  220    HA2  GLY  32           HA3      GLY  32   6.936  10.706   0.742
  221    HA3  GLY  32           HA2      GLY  32   5.377  11.477   0.438
  222    H    ALA  33           H        ALA  33   4.637   8.534   1.668
  223    HA   ALA  33           HA       ALA  33   3.776   9.587   4.201
  224    HB1  ALA  33           HB1      ALA  33   3.711   6.892   4.588
  225    HB2  ALA  33           HB2      ALA  33   3.735   6.963   2.826
  226    HB3  ALA  33           HB3      ALA  33   2.456   7.782   3.724
  227    H    LYS  34           H        LYS  34   4.650   9.176   6.303
  228    HA   LYS  34           HA       LYS  34   7.509   9.124   6.440
  229    HB2  LYS  34           HB3      LYS  34   6.946   8.584   8.967
  230    HB3  LYS  34           HB2      LYS  34   6.596  10.175   8.293
  231    HG2  LYS  34           HG3      LYS  34   4.343   9.866   8.404
  232    HG3  LYS  34           HG2      LYS  34   4.452   8.172   7.931
  233    HD2  LYS  34           HD3      LYS  34   5.240   7.581  10.190
  234    HD3  LYS  34           HD2      LYS  34   5.136   9.276  10.669
  235    HE2  LYS  34           HE3      LYS  34   2.751   9.296  10.398
  236    HE3  LYS  34           HE2      LYS  34   2.769   7.722   9.605
  237    HZ1  LYS  34           HZ1      LYS  34   2.104   7.428  11.860
  238    HZ2  LYS  34           HZ2      LYS  34   3.439   8.301  12.435
  239    HZ3  LYS  34           HZ3      LYS  34   3.670   6.790  11.694
  240    H    SER  35           H        SER  35   5.202   6.628   7.670
  241    HA   SER  35           HA       SER  35   7.161   4.581   6.792
  242    HB2  SER  35           HB3      SER  35   7.216   3.500   8.955
  243    HB3  SER  35           HB2      SER  35   7.663   5.189   9.176
  244    HG   SER  35           HG       SER  35   5.213   5.376   9.491
  245    H    GLY  36           H        GLY  36   6.237   2.387   6.826
  246    HA2  GLY  36           HA3      GLY  36   3.284   2.245   7.026
  247    HA3  GLY  36           HA2      GLY  36   4.023   1.811   5.484
  248    H    TYR  37           H        TYR  37   2.531  -0.005   7.197
  249    HA   TYR  37           HA       TYR  37   4.723  -1.927   7.890
  250    HB2  TYR  37           HB3      TYR  37   1.990  -1.851   9.189
  251    HB3  TYR  37           HB2      TYR  37   3.399  -2.779   9.699
  252    HD1  TYR  37           HD1      TYR  37   5.615  -0.998   9.758
  253    HD2  TYR  37           HD2      TYR  37   1.505  -0.155  10.683
  254    HE1  TYR  37           HE1      TYR  37   6.326   0.897  11.189
  255    HE2  TYR  37           HE2      TYR  37   2.216   1.742  12.114
  256    HH   TYR  37           HH       TYR  37   4.323   3.299  12.187
  257    H    CYS  38           H        CYS  38   4.387  -4.088   7.230
  258    HA   CYS  38           HA       CYS  38   2.223  -4.431   5.215
  259    HB2  CYS  38           HB3      CYS  38   4.469  -4.934   4.408
  260    HB3  CYS  38           HB2      CYS  38   4.741  -6.034   5.759
  261    H    GLN  39           H        GLN  39   0.449  -5.541   5.846
  262    HA   GLN  39           HA       GLN  39   0.728  -7.491   8.102
  263    HB2  GLN  39           HB3      GLN  39  -1.663  -5.790   7.331
  264    HB3  GLN  39           HB2      GLN  39  -1.631  -6.969   8.644
  265    HG2  GLN  39           HG3      GLN  39   0.252  -5.702   9.682
  266    HG3  GLN  39           HG2      GLN  39   0.090  -4.484   8.416
  267   HE21  GLN  39          HE22      GLN  39  -3.006  -5.547   8.894
  268   HE22  GLN  39          HE21      GLN  39  -3.513  -4.437  10.073
  269    H    ILE  40           H        ILE  40  -0.952  -9.277   7.996
  270    HA   ILE  40           HA       ILE  40  -1.239 -10.131   5.158
  271    HB   ILE  40           HB       ILE  40  -1.507 -12.400   6.058
  272   HG12  ILE  40          HG13      ILE  40  -1.046 -11.082   8.755
  273   HG13  ILE  40          HG12      ILE  40  -2.587 -11.734   8.201
  274   HG21  ILE  40          HG21      ILE  40   0.874 -11.578   7.575
  275   HG22  ILE  40          HG22      ILE  40   0.809 -10.901   5.948
  276   HG23  ILE  40          HG23      ILE  40   0.745 -12.648   6.179
  277   HD11  ILE  40          HD11      ILE  40  -0.400 -13.134   9.421
  278   HD12  ILE  40          HD12      ILE  40  -0.625 -13.751   7.784
  279   HD13  ILE  40          HD13      ILE  40  -1.969 -13.769   8.927
  280    H    LEU  41           H        LEU  41  -3.211 -10.759   4.342
  281    HA   LEU  41           HA       LEU  41  -5.571 -10.006   5.983
  282    HB2  LEU  41           HB3      LEU  41  -5.003 -10.042   3.030
  283    HB3  LEU  41           HB2      LEU  41  -6.656 -10.053   3.625
  284    HG   LEU  41           HG       LEU  41  -5.792  -7.753   3.147
  285   HD11  LEU  41          HD11      LEU  41  -6.092  -7.583   6.047
  286   HD12  LEU  41          HD12      LEU  41  -7.284  -8.656   5.313
  287   HD13  LEU  41          HD13      LEU  41  -7.154  -6.983   4.775
  288   HD21  LEU  41          HD21      LEU  41  -3.989  -6.829   4.304
  289   HD22  LEU  41          HD22      LEU  41  -3.438  -8.484   4.055
  290   HD23  LEU  41          HD23      LEU  41  -4.101  -7.999   5.615
  291    H    GLY  42           H        GLY  42  -7.201 -11.526   6.311
  292    HA2  GLY  42           HA3      GLY  42  -6.602 -14.286   6.191
  293    HA3  GLY  42           HA2      GLY  42  -8.235 -13.633   6.340
  294    H    THR  43           H        THR  43  -7.957 -12.143   3.762
  295    HA   THR  43           HA       THR  43  -8.615 -14.434   2.012
  296    HB   THR  43           HB       THR  43  -9.651 -12.790   0.554
  297    HG1  THR  43           HG1      THR  43  -9.484 -10.591   1.074
  298   HG21  THR  43          HG21      THR  43 -10.383 -13.265   3.236
  299   HG22  THR  43          HG22      THR  43 -11.432 -12.725   1.925
  300   HG23  THR  43          HG23      THR  43 -10.639 -11.541   2.964
  301    H    TYR  44           H        TYR  44  -7.053 -11.316   1.247
  302    HA   TYR  44           HA       TYR  44  -5.560 -12.380  -0.936
  303    HB2  TYR  44           HB3      TYR  44  -4.939  -9.943   0.759
  304    HB3  TYR  44           HB2      TYR  44  -4.272 -10.284  -0.836
  305    HD1  TYR  44           HD2      TYR  44  -5.839 -10.462  -2.819
  306    HD2  TYR  44           HD1      TYR  44  -7.101  -8.983   1.011
  307    HE1  TYR  44           HE2      TYR  44  -7.834  -9.433  -3.874
  308    HE2  TYR  44           HE1      TYR  44  -9.095  -7.953  -0.043
  309    HH   TYR  44           HH       TYR  44 -10.297  -7.774  -1.913
  310    H    GLY  45           H        GLY  45  -4.679 -11.939   2.484
  311    HA2  GLY  45           HA3      GLY  45  -3.134 -13.442   3.593
  312    HA3  GLY  45           HA2      GLY  45  -2.433 -13.829   2.024
  313    H    ASN  46           H        ASN  46  -2.169 -11.043   1.159
  314    HA   ASN  46           HA       ASN  46  -0.219  -9.995   3.145
  315    HB2  ASN  46           HB3      ASN  46   0.354 -11.072   0.492
  316    HB3  ASN  46           HB2      ASN  46   0.950  -9.425   0.701
  317   HD21  ASN  46          HD22      ASN  46   1.603  -9.447   3.459
  318   HD22  ASN  46          HD21      ASN  46   2.856 -10.563   3.724
  319    H    GLY  47           H        GLY  47  -0.448  -7.846   3.460
  320    HA2  GLY  47           HA3      GLY  47  -1.592  -6.183   1.274
  321    HA3  GLY  47           HA2      GLY  47  -2.360  -6.133   2.863
  322    H    CYS  48           H        CYS  48  -1.147  -3.844   1.656
  323    HA   CYS  48           HA       CYS  48   1.292  -3.490   3.343
  324    HB2  CYS  48           HB3      CYS  48   0.615  -2.674   0.627
  325    HB3  CYS  48           HB2      CYS  48   1.159  -1.317   1.613
  326    H    TRP  49           H        TRP  49   1.265  -1.947   4.923
  327    HA   TRP  49           HA       TRP  49  -1.201  -0.278   5.149
  328    HB2  TRP  49           HB3      TRP  49  -0.305  -2.111   6.940
  329    HB3  TRP  49           HB2      TRP  49   0.561  -0.684   7.507
  330    HD1  TRP  49           HD1      TRP  49  -0.790   1.152   8.732
  331    HE1  TRP  49           HE1      TRP  49  -3.251   1.387   9.453
  332    HE3  TRP  49           HE3      TRP  49  -2.826  -2.769   6.179
  333    HZ2  TRP  49           HZ2      TRP  49  -5.758   0.078   9.004
  334    HZ3  TRP  49           HZ3      TRP  49  -5.249  -3.256   6.343
  335    HH2  TRP  49           HH2      TRP  49  -6.716  -1.840   7.753
  336    H    CYS  50           H        CYS  50  -0.705   1.789   4.470
  337    HA   CYS  50           HA       CYS  50   2.018   2.838   5.142
  338    HB2  CYS  50           HB3      CYS  50   1.110   2.791   2.695
  339    HB3  CYS  50           HB2      CYS  50   0.138   4.173   3.208
  340    H    ILE  51           H        ILE  51   2.096   4.261   6.785
  341    HA   ILE  51           HA       ILE  51  -0.402   5.739   7.483
  342    HB   ILE  51           HB       ILE  51   1.852   4.880   9.313
  343   HG12  ILE  51          HG13      ILE  51  -0.977   3.809   9.164
  344   HG13  ILE  51          HG12      ILE  51   0.374   3.056   8.315
  345   HG21  ILE  51          HG21      ILE  51  -0.879   6.065   9.905
  346   HG22  ILE  51          HG22      ILE  51   0.648   6.941  10.011
  347   HG23  ILE  51          HG23      ILE  51   0.326   5.593  11.101
  348   HD11  ILE  51          HD11      ILE  51   1.149   3.558  11.036
  349   HD12  ILE  51          HD12      ILE  51   1.015   2.014  10.194
  350   HD13  ILE  51          HD13      ILE  51  -0.386   2.691  11.025
  351    H    ALA  52           H        ALA  52  -0.277   7.931   7.627
  352    HA   ALA  52           HA       ALA  52   2.114   9.404   8.203
  353    HB1  ALA  52           HB1      ALA  52   1.259   9.492   5.298
  354    HB2  ALA  52           HB2      ALA  52   2.640   8.563   5.880
  355    HB3  ALA  52           HB3      ALA  52   2.632  10.320   6.032
  356    H    LEU  53           H        LEU  53  -1.093   9.294   6.763
  357    HA   LEU  53           HA       LEU  53  -1.585  12.042   7.838
  358    HB2  LEU  53           HB3      LEU  53  -2.120  10.883   5.182
  359    HB3  LEU  53           HB2      LEU  53  -3.499  11.720   5.895
  360    HG   LEU  53           HG       LEU  53  -2.046  13.696   6.316
  361   HD11  LEU  53          HD11      LEU  53   0.115  13.381   4.656
  362   HD12  LEU  53          HD12      LEU  53  -0.017  11.774   5.371
  363   HD13  LEU  53          HD13      LEU  53   0.169  13.188   6.408
  364   HD21  LEU  53          HD21      LEU  53  -1.552  13.280   3.446
  365   HD22  LEU  53          HD22      LEU  53  -2.550  14.493   4.249
  366   HD23  LEU  53          HD23      LEU  53  -3.198  12.882   3.940
  367    HA   PRO  54           HA       PRO  54  -4.892  10.671  10.383
  368    HB2  PRO  54           HB2      PRO  54  -6.801  12.166   8.633
  369    HB3  PRO  54           HB3      PRO  54  -6.601  12.222  10.391
  370    HG2  PRO  54           HG3      PRO  54  -5.663  14.136   8.740
  371    HG3  PRO  54           HG2      PRO  54  -4.906  13.727  10.286
  372    HD2  PRO  54           HD3      PRO  54  -3.916  13.236   7.556
  373    HD3  PRO  54           HD2      PRO  54  -3.031  13.221   9.095
  374    H    ASP  55           H        ASP  55  -6.802  10.951   7.393
  375    HA   ASP  55           HA       ASP  55  -6.685   8.198   6.634
  376    HB2  ASP  55           HB3      ASP  55  -8.869   7.423   7.457
  377    HB3  ASP  55           HB2      ASP  55  -7.835   7.860   8.815
  378    H    ASN  56           H        ASN  56  -6.732  10.750   5.332
  379    HA   ASN  56           HA       ASN  56  -9.403  10.796   4.024
  380    HB2  ASN  56           HB3      ASN  56  -7.107  12.774   3.944
  381    HB3  ASN  56           HB2      ASN  56  -8.632  12.971   3.079
  382   HD21  ASN  56          HD22      ASN  56  -7.776  14.826   5.116
  383   HD22  ASN  56          HD21      ASN  56  -8.855  14.704   6.421
  384    H    VAL  57           H        VAL  57  -9.628  10.134   1.919
  385    HA   VAL  57           HA       VAL  57  -9.019   9.020  -0.065
  386    HB   VAL  57           HB       VAL  57  -6.624  10.854  -0.092
  387   HG11  VAL  57          HG11      VAL  57  -8.399  10.613  -2.425
  388   HG12  VAL  57          HG12      VAL  57  -7.675   9.084  -1.928
  389   HG13  VAL  57          HG13      VAL  57  -6.645  10.459  -2.327
  390   HG21  VAL  57          HG21      VAL  57  -9.478  11.564   0.098
  391   HG22  VAL  57          HG22      VAL  57  -8.649  12.297  -1.276
  392   HG23  VAL  57          HG23      VAL  57  -8.052  12.567   0.362
  393    HA   PRO  58           HA       PRO  58  -5.622   6.643   2.020
  394    HB2  PRO  58           HB2      PRO  58  -7.021   4.392   2.597
  395    HB3  PRO  58           HB3      PRO  58  -7.030   5.815   3.656
  396    HG2  PRO  58           HG3      PRO  58  -9.101   4.844   1.777
  397    HG3  PRO  58           HG2      PRO  58  -9.278   5.699   3.316
  398    HD2  PRO  58           HD3      PRO  58  -9.469   6.863   0.763
  399    HD3  PRO  58           HD2      PRO  58  -9.270   7.743   2.294
  400    H    ILE  59           H        ILE  59  -8.066   4.629   0.344
  401    HA   ILE  59           HA       ILE  59  -6.016   4.014  -1.721
  402    HB   ILE  59           HB       ILE  59  -6.620   1.647  -1.636
  403   HG12  ILE  59          HG13      ILE  59  -8.421   2.432   0.682
  404   HG13  ILE  59          HG12      ILE  59  -8.990   1.976  -0.924
  405   HG21  ILE  59          HG21      ILE  59  -5.376   1.133   0.256
  406   HG22  ILE  59          HG22      ILE  59  -6.184   2.349   1.245
  407   HG23  ILE  59          HG23      ILE  59  -4.973   2.838   0.060
  408   HD11  ILE  59          HD11      ILE  59  -7.302   0.202   0.865
  409   HD12  ILE  59          HD12      ILE  59  -8.003  -0.241  -0.692
  410   HD13  ILE  59          HD13      ILE  59  -9.052   0.074   0.691
  411    H    ARG  60           H        ARG  60  -6.969   3.239  -3.740
  412    HA   ARG  60           HA       ARG  60  -9.798   4.130  -4.063
  413    HB2  ARG  60           HB3      ARG  60  -8.082   5.549  -5.240
  414    HB3  ARG  60           HB2      ARG  60  -7.611   4.125  -6.164
  415    HG2  ARG  60           HG3      ARG  60  -9.148   5.150  -7.600
  416    HG3  ARG  60           HG2      ARG  60 -10.158   3.980  -6.754
  417    HD2  ARG  60           HD3      ARG  60 -10.875   5.745  -5.173
  418    HD3  ARG  60           HD2      ARG  60  -9.869   6.912  -6.030
  419    HE   ARG  60           HE       ARG  60 -11.521   5.851  -7.997
  420   HH11  ARG  60          HH22      ARG  60 -11.897   7.354  -4.917
  421   HH12  ARG  60          HH21      ARG  60 -13.421   8.077  -5.307
  422   HH21  ARG  60          HH11      ARG  60 -13.511   6.785  -8.524
  423   HH22  ARG  60          HH12      ARG  60 -14.336   7.754  -7.349
  424    H    ILE  61           H        ILE  61 -11.136   2.479  -4.531
  425    HA   ILE  61           HA       ILE  61  -9.968   0.039  -5.821
  426    HB   ILE  61           HB       ILE  61 -12.392   0.201  -4.014
  427   HG12  ILE  61          HG13      ILE  61 -10.249  -1.306  -2.889
  428   HG13  ILE  61          HG12      ILE  61  -9.590   0.250  -3.395
  429   HG21  ILE  61          HG21      ILE  61 -10.792  -2.148  -5.078
  430   HG22  ILE  61          HG22      ILE  61 -12.397  -1.669  -5.633
  431   HG23  ILE  61          HG23      ILE  61 -12.172  -2.254  -3.984
  432   HD11  ILE  61          HD11      ILE  61 -10.525   0.246  -1.052
  433   HD12  ILE  61          HD12      ILE  61 -12.118  -0.044  -1.751
  434   HD13  ILE  61          HD13      ILE  61 -11.253   1.450  -2.116
  435    HA   PRO  62           HA       PRO  62 -13.164   1.668  -8.723
  436    HB2  PRO  62           HB2      PRO  62 -11.654   1.549 -10.977
  437    HB3  PRO  62           HB3      PRO  62 -11.593   2.923  -9.859
  438    HG2  PRO  62           HG3      PRO  62  -9.672   0.704 -10.230
  439    HG3  PRO  62           HG2      PRO  62  -9.383   2.389  -9.774
  440    HD2  PRO  62           HD3      PRO  62  -9.439   0.212  -8.008
  441    HD3  PRO  62           HD2      PRO  62  -9.559   1.921  -7.544
  442    H    GLY  63           H        GLY  63 -11.534  -1.235  -8.261
  443    HA2  GLY  63           HA3      GLY  63 -12.614  -3.368  -8.677
  444    HA3  GLY  63           HA2      GLY  63 -13.435  -2.640 -10.058
  445    H    LYS  64           H        LYS  64 -10.436  -1.449 -10.346
  446    HA   LYS  64           HA       LYS  64  -9.724  -3.062 -12.580
  447    HB2  LYS  64           HB3      LYS  64  -8.859  -0.751 -12.143
  448    HB3  LYS  64           HB2      LYS  64  -7.850  -1.416 -10.857
  449    HG2  LYS  64           HG3      LYS  64  -6.688  -2.850 -12.451
  450    HG3  LYS  64           HG2      LYS  64  -7.759  -2.323 -13.749
  451    HD2  LYS  64           HD3      LYS  64  -5.678  -1.079 -13.915
  452    HD3  LYS  64           HD2      LYS  64  -6.952   0.023 -13.392
  453    HE2  LYS  64           HE3      LYS  64  -6.108   0.203 -11.247
  454    HE3  LYS  64           HE2      LYS  64  -5.372  -1.399 -11.286
  455    HZ1  LYS  64           HZ1      LYS  64  -4.414   1.060 -12.638
  456    HZ2  LYS  64           HZ2      LYS  64  -3.787  -0.484 -12.959
  457    HZ3  LYS  64           HZ3      LYS  64  -3.637   0.187 -11.406
  458    H    CYS  65           H        CYS  65  -8.852  -3.287  -9.161
  459    HA   CYS  65           HA       CYS  65  -6.868  -5.369  -9.561
  460    HB2  CYS  65           HB3      CYS  65  -8.322  -4.247  -7.176
  461    HB3  CYS  65           HB2      CYS  65  -7.371  -5.724  -7.017
  462    H    HIS  66           H        HIS  66  -7.140  -7.629  -9.004
  463    HA   HIS  66           HA       HIS  66  -9.968  -8.571  -8.888
  464    HB2  HIS  66           HB3      HIS  66  -7.814  -9.613 -10.753
  465    HB3  HIS  66           HB2      HIS  66  -9.395 -10.358 -10.525
  466    HD1  HIS  66           HD1      HIS  66  -7.710  -7.393 -12.078
  467    HD2  HIS  66           HD2      HIS  66 -11.580  -8.894 -11.658
  468    HE1  HIS  66           HE1      HIS  66  -9.175  -6.053 -13.654
  469    HE2  HIS  66           HE2      HIS  66 -11.531  -6.960 -13.407
  Start of MODEL    3
    1    H1   ALA   1           H1       ALA   1  -4.116  11.527   3.352
    2    H2   ALA   1           H2       ALA   1  -3.133  10.658   4.432
    3    H3   ALA   1           H3       ALA   1  -4.612  11.308   4.958
    4    HA   ALA   1           HA       ALA   1  -5.818   9.623   4.146
    5    HB1  ALA   1           HB1      ALA   1  -3.876   9.802   1.847
    6    HB2  ALA   1           HB2      ALA   1  -5.613  10.104   1.846
    7    HB3  ALA   1           HB3      ALA   1  -5.005   8.454   1.973
    8    H    ARG   2           H        ARG   2  -5.703   7.298   4.389
    9    HA   ARG   2           HA       ARG   2  -3.011   6.288   5.223
   10    HB2  ARG   2           HB3      ARG   2  -4.432   6.755   7.205
   11    HB3  ARG   2           HB2      ARG   2  -5.671   5.682   6.553
   12    HG2  ARG   2           HG3      ARG   2  -4.010   3.815   6.568
   13    HG3  ARG   2           HG2      ARG   2  -2.847   4.899   7.330
   14    HD2  ARG   2           HD3      ARG   2  -5.567   4.224   8.485
   15    HD3  ARG   2           HD2      ARG   2  -4.059   3.454   8.974
   16    HE   ARG   2           HE       ARG   2  -3.736   6.273   9.214
   17   HH11  ARG   2          HH22      ARG   2  -5.496   3.619  10.532
   18   HH12  ARG   2          HH21      ARG   2  -5.623   4.313  12.113
   19   HH21  ARG   2          HH11      ARG   2  -3.888   7.195  11.278
   20   HH22  ARG   2          HH12      ARG   2  -4.713   6.337  12.534
   21    H    ASP   3           H        ASP   3  -2.480   4.307   4.378
   22    HA   ASP   3           HA       ASP   3  -4.471   3.027   2.592
   23    HB2  ASP   3           HB3      ASP   3  -1.488   2.587   2.924
   24    HB3  ASP   3           HB2      ASP   3  -2.507   1.728   1.770
   25    H    ALA   4           H        ALA   4  -5.094   0.840   2.893
   26    HA   ALA   4           HA       ALA   4  -4.502  -0.224   5.608
   27    HB1  ALA   4           HB1      ALA   4  -6.778  -0.277   5.591
   28    HB2  ALA   4           HB2      ALA   4  -6.542  -1.772   4.684
   29    HB3  ALA   4           HB3      ALA   4  -6.860  -0.263   3.830
   30    H    TYR   5           H        TYR   5  -5.638  -2.028   2.792
   31    HA   TYR   5           HA       TYR   5  -3.356  -3.897   3.192
   32    HB2  TYR   5           HB3      TYR   5  -5.939  -4.242   1.636
   33    HB3  TYR   5           HB2      TYR   5  -4.719  -5.490   1.885
   34    HD1  TYR   5           HD2      TYR   5  -4.239  -6.324   4.203
   35    HD2  TYR   5           HD1      TYR   5  -7.514  -3.678   3.349
   36    HE1  TYR   5           HE2      TYR   5  -5.278  -6.905   6.380
   37    HE2  TYR   5           HE1      TYR   5  -8.552  -4.259   5.525
   38    HH   TYR   5           HH       TYR   5  -6.859  -6.207   7.905
   39    H    ILE   6           H        ILE   6  -3.664  -1.225   1.525
   40    HA   ILE   6           HA       ILE   6  -2.457  -2.350  -0.964
   41    HB   ILE   6           HB       ILE   6  -3.400  -0.475  -2.193
   42   HG12  ILE   6          HG13      ILE   6  -4.551   0.395   0.481
   43   HG13  ILE   6          HG12      ILE   6  -3.250   1.216  -0.384
   44   HG21  ILE   6          HG21      ILE   6  -4.816  -2.492  -1.796
   45   HG22  ILE   6          HG22      ILE   6  -5.770  -1.021  -1.993
   46   HG23  ILE   6          HG23      ILE   6  -5.507  -1.692  -0.383
   47   HD11  ILE   6          HD11      ILE   6  -4.909   2.440  -1.326
   48   HD12  ILE   6          HD12      ILE   6  -6.149   1.269  -0.880
   49   HD13  ILE   6          HD13      ILE   6  -5.179   1.015  -2.330
   50    H    ALA   7           H        ALA   7  -0.849  -0.899  -1.989
   51    HA   ALA   7           HA       ALA   7   0.471   0.930  -0.035
   52    HB1  ALA   7           HB1      ALA   7   1.494  -1.514  -1.131
   53    HB2  ALA   7           HB2      ALA   7   2.300  -0.386  -0.042
   54    HB3  ALA   7           HB3      ALA   7   2.431  -0.173  -1.786
   55    H    LYS   8           H        LYS   8  -1.017   0.617  -2.973
   56    HA   LYS   8           HA       LYS   8   0.586   2.805  -4.204
   57    HB2  LYS   8           HB3      LYS   8  -1.435   1.442  -5.867
   58    HB3  LYS   8           HB2      LYS   8   0.236   1.849  -6.247
   59    HG2  LYS   8           HG3      LYS   8  -0.639  -0.470  -4.492
   60    HG3  LYS   8           HG2      LYS   8  -0.082  -0.601  -6.156
   61    HD2  LYS   8           HD3      LYS   8   1.816   0.932  -4.612
   62    HD3  LYS   8           HD2      LYS   8   1.511  -0.619  -3.831
   63    HE2  LYS   8           HE3      LYS   8   1.989  -1.798  -5.922
   64    HE3  LYS   8           HE2      LYS   8   2.221  -0.261  -6.755
   65    HZ1  LYS   8           HZ1      LYS   8   4.233  -1.589  -5.755
   66    HZ2  LYS   8           HZ2      LYS   8   3.790  -0.770  -4.338
   67    HZ3  LYS   8           HZ3      LYS   8   4.202   0.109  -5.734
   68    HA   PRO   9           HA       PRO   9  -2.683   5.688  -3.592
   69    HB2  PRO   9           HB2      PRO   9  -2.750   6.923  -6.094
   70    HB3  PRO   9           HB3      PRO   9  -1.661   7.347  -4.763
   71    HG2  PRO   9           HG3      PRO   9  -1.149   5.709  -7.178
   72    HG3  PRO   9           HG2      PRO   9  -0.065   6.794  -6.292
   73    HD2  PRO   9           HD3      PRO   9   0.107   4.094  -6.084
   74    HD3  PRO   9           HD2      PRO   9   0.506   5.174  -4.732
   75    H    HIS  10           H        HIS  10  -2.918   3.579  -6.404
   76    HA   HIS  10           HA       HIS  10  -5.857   3.582  -6.030
   77    HB2  HIS  10           HB3      HIS  10  -5.173   5.249  -7.856
   78    HB3  HIS  10           HB2      HIS  10  -4.667   3.843  -8.794
   79    HD1  HIS  10           HD1      HIS  10  -7.766   4.770  -6.756
   80    HD2  HIS  10           HD2      HIS  10  -6.746   2.970 -10.379
   81    HE1  HIS  10           HE1      HIS  10  -9.948   4.152  -7.891
   82    HE2  HIS  10           HE2      HIS  10  -9.338   3.057 -10.096
   83    H    ASN  11           H        ASN  11  -2.933   2.012  -6.827
   84    HA   ASN  11           HA       ASN  11  -4.383  -0.417  -7.766
   85    HB2  ASN  11           HB3      ASN  11  -1.415   0.214  -7.787
   86    HB3  ASN  11           HB2      ASN  11  -2.173  -1.212  -8.495
   87   HD21  ASN  11          HD22      ASN  11  -1.731   2.280  -8.870
   88   HD22  ASN  11          HD21      ASN  11  -2.362   2.370 -10.444
   89    H    CYS  12           H        CYS  12  -3.729  -2.497  -6.771
   90    HA   CYS  12           HA       CYS  12  -2.914  -2.128  -3.912
   91    HB2  CYS  12           HB3      CYS  12  -4.656  -4.313  -5.090
   92    HB3  CYS  12           HB2      CYS  12  -4.300  -4.061  -3.380
   93    H    VAL  13           H        VAL  13  -1.992  -4.280  -2.997
   94    HA   VAL  13           HA       VAL  13   0.073  -5.219  -4.921
   95    HB   VAL  13           HB       VAL  13  -0.072  -5.573  -1.911
   96   HG11  VAL  13          HG11      VAL  13   2.569  -5.716  -2.785
   97   HG12  VAL  13          HG12      VAL  13   1.673  -6.604  -4.017
   98   HG13  VAL  13          HG13      VAL  13   1.558  -7.084  -2.323
   99   HG21  VAL  13          HG21      VAL  13   1.687  -3.672  -3.480
  100   HG22  VAL  13          HG22      VAL  13   1.433  -3.720  -1.735
  101   HG23  VAL  13          HG23      VAL  13   0.134  -3.183  -2.801
  102    H    TYR  14           H        TYR  14   0.114  -7.324  -5.599
  103    HA   TYR  14           HA       TYR  14  -2.180  -9.008  -5.158
  104    HB2  TYR  14           HB3      TYR  14  -1.077 -10.598  -6.572
  105    HB3  TYR  14           HB2      TYR  14  -0.665  -9.004  -7.205
  106    HD1  TYR  14           HD2      TYR  14   1.565  -7.991  -6.687
  107    HD2  TYR  14           HD1      TYR  14   0.596 -12.043  -5.642
  108    HE1  TYR  14           HE2      TYR  14   3.975  -8.489  -6.386
  109    HE2  TYR  14           HE1      TYR  14   3.007 -12.541  -5.342
  110    HH   TYR  14           HH       TYR  14   5.122 -11.758  -5.858
  111    H    GLU  15           H        GLU  15   1.074  -8.905  -3.795
  112    HA   GLU  15           HA       GLU  15   0.266 -10.224  -1.380
  113    HB2  GLU  15           HB3      GLU  15   0.263 -12.188  -2.962
  114    HB3  GLU  15           HB2      GLU  15   1.986 -11.911  -3.221
  115    HG2  GLU  15           HG3      GLU  15   2.362 -12.153  -0.770
  116    HG3  GLU  15           HG2      GLU  15   0.652 -12.537  -0.573
  117    H    CYS  16           H        CYS  16   1.454  -8.543  -0.409
  118    HA   CYS  16           HA       CYS  16   4.097  -7.780  -1.187
  119    HB2  CYS  16           HB3      CYS  16   3.457  -6.157   0.253
  120    HB3  CYS  16           HB2      CYS  16   2.256  -7.203   1.009
  121    H    PHE  17           H        PHE  17   5.799  -9.165  -1.172
  122    HA   PHE  17           HA       PHE  17   5.858 -11.499   0.570
  123    HB2  PHE  17           HB3      PHE  17   7.705 -12.167  -0.663
  124    HB3  PHE  17           HB2      PHE  17   6.946 -11.078  -1.821
  125    HD1  PHE  17           HD2      PHE  17   7.682  -8.580  -1.751
  126    HD2  PHE  17           HD1      PHE  17   9.912 -11.787   0.041
  127    HE1  PHE  17           HE2      PHE  17   9.716  -7.166  -1.748
  128    HE2  PHE  17           HE1      PHE  17  11.945 -10.369   0.046
  129    HZ   PHE  17           HZ       PHE  17  11.847  -8.058  -0.846
  130    H    ASP  18           H        ASP  18   8.681 -11.418   1.249
  131    HA   ASP  18           HA       ASP  18   8.528 -10.109   3.779
  132    HB2  ASP  18           HB3      ASP  18  10.940 -11.015   2.180
  133    HB3  ASP  18           HB2      ASP  18  11.005 -10.492   3.863
  134    H    ALA  19           H        ALA  19   8.885  -8.011   4.333
  135    HA   ALA  19           HA       ALA  19   9.993  -6.197   2.229
  136    HB1  ALA  19           HB1      ALA  19   8.730  -4.405   3.317
  137    HB2  ALA  19           HB2      ALA  19   8.207  -5.513   4.584
  138    HB3  ALA  19           HB3      ALA  19   7.644  -5.739   2.928
  139    H    PHE  20           H        PHE  20  11.474  -7.823   4.287
  140    HA   PHE  20           HA       PHE  20  12.376  -6.248   6.446
  141    HB2  PHE  20           HB3      PHE  20  12.964  -8.651   6.068
  142    HB3  PHE  20           HB2      PHE  20  14.059  -8.145   4.783
  143    HD1  PHE  20           HD2      PHE  20  13.398  -7.985   8.426
  144    HD2  PHE  20           HD1      PHE  20  16.176  -7.103   5.270
  145    HE1  PHE  20           HE2      PHE  20  15.162  -7.527  10.106
  146    HE2  PHE  20           HE1      PHE  20  17.941  -6.644   6.951
  147    HZ   PHE  20           HZ       PHE  20  17.434  -6.856   9.370
  148    H    SER  21           H        SER  21  13.639  -6.390   3.100
  149    HA   SER  21           HA       SER  21  15.735  -4.493   3.508
  150    HB2  SER  21           HB3      SER  21  14.166  -4.981   0.962
  151    HB3  SER  21           HB2      SER  21  15.773  -4.270   1.081
  152    HG   SER  21           HG       SER  21  16.605  -6.193   1.457
  153    H    SER  22           H        SER  22  12.435  -4.054   2.235
  154    HA   SER  22           HA       SER  22  11.500  -1.866   3.485
  155    HB2  SER  22           HB3      SER  22  13.768  -1.005   1.715
  156    HB3  SER  22           HB2      SER  22  12.373   0.054   1.875
  157    HG   SER  22           HG       SER  22  12.891   0.444   3.890
  158    H    TYR  23           H        TYR  23  10.791  -3.988   1.568
  159    HA   TYR  23           HA       TYR  23  10.006  -2.959  -0.957
  160    HB2  TYR  23           HB3      TYR  23   9.933  -5.368  -0.358
  161    HB3  TYR  23           HB2      TYR  23   8.556  -5.041   0.697
  162    HD1  TYR  23           HD2      TYR  23   9.723  -5.139  -2.809
  163    HD2  TYR  23           HD1      TYR  23   6.365  -4.532  -0.200
  164    HE1  TYR  23           HE2      TYR  23   8.188  -5.285  -4.751
  165    HE2  TYR  23           HE1      TYR  23   4.831  -4.675  -2.141
  166    HH   TYR  23           HH       TYR  23   6.073  -4.938  -5.451
  167    H    CYS  24           H        CYS  24   7.685  -3.616   1.672
  168    HA   CYS  24           HA       CYS  24   5.698  -1.851   0.629
  169    HB2  CYS  24           HB3      CYS  24   5.428  -3.716   2.380
  170    HB3  CYS  24           HB2      CYS  24   5.999  -2.533   3.557
  171    H    ASN  25           H        ASN  25   8.036  -1.408   3.283
  172    HA   ASN  25           HA       ASN  25   7.362   1.279   3.899
  173    HB2  ASN  25           HB3      ASN  25  10.081  -0.071   4.013
  174    HB3  ASN  25           HB2      ASN  25   9.658   1.437   4.825
  175   HD21  ASN  25          HD22      ASN  25   6.932  -0.551   4.812
  176   HD22  ASN  25          HD21      ASN  25   7.111  -1.242   6.352
  177    H    GLY  26           H        GLY  26   9.484  -0.104   1.436
  178    HA2  GLY  26           HA3      GLY  26  10.692   2.292   0.513
  179    HA3  GLY  26           HA2      GLY  26  10.416   0.865  -0.487
  180    H    VAL  27           H        VAL  27   7.574   0.785  -0.342
  181    HA   VAL  27           HA       VAL  27   6.890   2.626  -2.416
  182    HB   VAL  27           HB       VAL  27   5.150   1.050  -0.501
  183   HG11  VAL  27          HG11      VAL  27   3.607   1.559  -2.702
  184   HG12  VAL  27          HG12      VAL  27   4.499   3.073  -2.552
  185   HG13  VAL  27          HG13      VAL  27   3.528   2.485  -1.203
  186   HG21  VAL  27          HG21      VAL  27   5.777   0.622  -3.438
  187   HG22  VAL  27          HG22      VAL  27   4.898  -0.473  -2.370
  188   HG23  VAL  27          HG23      VAL  27   6.623  -0.199  -2.125
  189    H    CYS  28           H        CYS  28   6.115   2.653   1.068
  190    HA   CYS  28           HA       CYS  28   4.830   5.249   0.950
  191    HB2  CYS  28           HB3      CYS  28   5.980   3.670   3.272
  192    HB3  CYS  28           HB2      CYS  28   5.079   5.173   3.457
  193    H    THR  29           H        THR  29   8.116   4.171   1.139
  194    HA   THR  29           HA       THR  29   9.333   6.425   2.392
  195    HB   THR  29           HB       THR  29  10.490   4.640   0.236
  196    HG1  THR  29           HG1      THR  29   9.624   4.029   2.617
  197   HG21  THR  29          HG21      THR  29  12.636   5.233   1.456
  198   HG22  THR  29          HG22      THR  29  11.716   6.473   2.309
  199   HG23  THR  29          HG23      THR  29  11.895   6.557   0.557
  200    H    LYS  30           H        LYS  30   8.496   5.850  -1.013
  201    HA   LYS  30           HA       LYS  30   9.883   7.998  -2.183
  202    HB2  LYS  30           HB3      LYS  30   7.177   6.825  -2.867
  203    HB3  LYS  30           HB2      LYS  30   8.009   7.999  -3.886
  204    HG2  LYS  30           HG3      LYS  30   9.124   6.284  -4.829
  205    HG3  LYS  30           HG2      LYS  30   9.939   6.035  -3.286
  206    HD2  LYS  30           HD3      LYS  30   8.929   3.943  -3.830
  207    HD3  LYS  30           HD2      LYS  30   7.911   4.664  -2.584
  208    HE2  LYS  30           HE3      LYS  30   6.228   4.202  -4.057
  209    HE3  LYS  30           HE2      LYS  30   6.756   5.704  -4.817
  210    HZ1  LYS  30           HZ1      LYS  30   7.719   4.614  -6.520
  211    HZ2  LYS  30           HZ2      LYS  30   6.602   3.402  -6.115
  212    HZ3  LYS  30           HZ3      LYS  30   8.206   3.296  -5.566
  213    H    ASN  31           H        ASN  31   6.910   8.045  -0.302
  214    HA   ASN  31           HA       ASN  31   5.978  10.635  -0.942
  215    HB2  ASN  31           HB3      ASN  31   5.966   9.230   1.741
  216    HB3  ASN  31           HB2      ASN  31   4.972  10.626   1.325
  217   HD21  ASN  31          HD22      ASN  31   3.884  10.134  -1.081
  218   HD22  ASN  31          HD21      ASN  31   3.059   8.652  -1.130
  219    H    GLY  32           H        GLY  32   8.664   9.609   1.092
  220    HA2  GLY  32           HA3      GLY  32  10.570  11.084   1.445
  221    HA3  GLY  32           HA2      GLY  32   9.484  12.464   1.296
  222    H    ALA  33           H        ALA  33   7.943  10.154   3.139
  223    HA   ALA  33           HA       ALA  33   9.180  10.388   5.689
  224    HB1  ALA  33           HB1      ALA  33   7.039  12.043   6.325
  225    HB2  ALA  33           HB2      ALA  33   7.665  12.728   4.825
  226    HB3  ALA  33           HB3      ALA  33   8.728  12.534   6.219
  227    H    LYS  34           H        LYS  34   6.309   9.962   3.752
  228    HA   LYS  34           HA       LYS  34   4.490   8.997   5.683
  229    HB2  LYS  34           HB3      LYS  34   4.173   9.352   3.133
  230    HB3  LYS  34           HB2      LYS  34   4.818   7.719   2.970
  231    HG2  LYS  34           HG3      LYS  34   3.047   6.918   4.544
  232    HG3  LYS  34           HG2      LYS  34   2.361   8.543   4.529
  233    HD2  LYS  34           HD3      LYS  34   2.164   8.391   2.041
  234    HD3  LYS  34           HD2      LYS  34   2.695   6.713   2.141
  235    HE2  LYS  34           HE3      LYS  34   0.712   6.663   3.978
  236    HE3  LYS  34           HE2      LYS  34   0.095   7.929   2.917
  237    HZ1  LYS  34           HZ1      LYS  34   0.557   6.354   1.036
  238    HZ2  LYS  34           HZ2      LYS  34  -0.711   5.906   2.068
  239    HZ3  LYS  34           HZ3      LYS  34   0.800   5.143   2.203
  240    H    SER  35           H        SER  35   4.507   7.142   6.941
  241    HA   SER  35           HA       SER  35   6.629   5.136   6.314
  242    HB2  SER  35           HB3      SER  35   6.640   4.607   8.702
  243    HB3  SER  35           HB2      SER  35   6.900   6.334   8.474
  244    HG   SER  35           HG       SER  35   4.782   6.704   9.025
  245    H    GLY  36           H        GLY  36   6.019   2.966   6.145
  246    HA2  GLY  36           HA3      GLY  36   3.240   2.259   6.868
  247    HA3  GLY  36           HA2      GLY  36   3.742   2.001   5.198
  248    H    TYR  37           H        TYR  37   2.866  -0.131   6.662
  249    HA   TYR  37           HA       TYR  37   5.345  -1.757   6.897
  250    HB2  TYR  37           HB3      TYR  37   3.239  -2.469   8.834
  251    HB3  TYR  37           HB2      TYR  37   4.986  -2.362   9.063
  252    HD1  TYR  37           HD1      TYR  37   1.983  -0.188   8.519
  253    HD2  TYR  37           HD2      TYR  37   5.876  -0.577  10.294
  254    HE1  TYR  37           HE1      TYR  37   1.698   2.013   9.622
  255    HE2  TYR  37           HE2      TYR  37   5.591   1.626  11.399
  256    HH   TYR  37           HH       TYR  37   2.559   3.466  11.070
  257    H    CYS  38           H        CYS  38   4.832  -4.116   6.648
  258    HA   CYS  38           HA       CYS  38   2.462  -4.448   4.888
  259    HB2  CYS  38           HB3      CYS  38   4.672  -5.116   3.998
  260    HB3  CYS  38           HB2      CYS  38   4.838  -6.279   5.312
  261    H    GLN  39           H        GLN  39   0.695  -5.382   5.737
  262    HA   GLN  39           HA       GLN  39   1.018  -7.113   8.151
  263    HB2  GLN  39           HB3      GLN  39  -1.413  -5.601   7.141
  264    HB3  GLN  39           HB2      GLN  39  -1.370  -6.605   8.590
  265    HG2  GLN  39           HG3      GLN  39   0.464  -5.148   9.482
  266    HG3  GLN  39           HG2      GLN  39   0.254  -4.096   8.081
  267   HE21  GLN  39          HE22      GLN  39  -2.789  -5.267   8.697
  268   HE22  GLN  39          HE21      GLN  39  -3.361  -4.045   9.726
  269    H    ILE  40           H        ILE  40  -0.672  -8.927   8.240
  270    HA   ILE  40           HA       ILE  40  -0.707 -10.233   5.583
  271    HB   ILE  40           HB       ILE  40  -1.169 -12.287   6.787
  272   HG12  ILE  40          HG13      ILE  40  -1.441 -10.512   9.239
  273   HG13  ILE  40          HG12      ILE  40  -2.757 -11.378   8.445
  274   HG21  ILE  40          HG21      ILE  40   1.120 -10.720   7.122
  275   HG22  ILE  40          HG22      ILE  40   0.983 -12.449   7.442
  276   HG23  ILE  40          HG23      ILE  40   0.740 -11.289   8.747
  277   HD11  ILE  40          HD11      ILE  40  -2.296 -13.088   9.844
  278   HD12  ILE  40          HD12      ILE  40  -0.757 -12.375  10.327
  279   HD13  ILE  40          HD13      ILE  40  -0.854 -13.356   8.864
  280    H    LEU  41           H        LEU  41  -2.581 -10.678   4.479
  281    HA   LEU  41           HA       LEU  41  -4.934  -9.176   5.015
  282    HB2  LEU  41           HB3      LEU  41  -4.177 -10.294   2.810
  283    HB3  LEU  41           HB2      LEU  41  -4.920 -11.761   3.444
  284    HG   LEU  41           HG       LEU  41  -6.393  -9.124   3.274
  285   HD11  LEU  41          HD11      LEU  41  -7.458 -10.637   1.278
  286   HD12  LEU  41          HD12      LEU  41  -5.761 -11.106   1.177
  287   HD13  LEU  41          HD13      LEU  41  -6.217  -9.410   1.027
  288   HD21  LEU  41          HD21      LEU  41  -7.038 -11.874   4.139
  289   HD22  LEU  41          HD22      LEU  41  -8.209 -11.177   3.022
  290   HD23  LEU  41          HD23      LEU  41  -7.835 -10.354   4.534
  291    H    GLY  42           H        GLY  42  -3.970 -12.447   5.896
  292    HA2  GLY  42           HA3      GLY  42  -5.018 -13.056   8.187
  293    HA3  GLY  42           HA2      GLY  42  -6.552 -12.800   7.351
  294    H    THR  43           H        THR  43  -5.431 -13.888   4.817
  295    HA   THR  43           HA       THR  43  -4.470 -16.535   5.106
  296    HB   THR  43           HB       THR  43  -7.140 -17.197   4.389
  297    HG1  THR  43           HG1      THR  43  -7.374 -15.141   5.732
  298   HG21  THR  43          HG21      THR  43  -5.368 -18.603   5.499
  299   HG22  THR  43          HG22      THR  43  -6.958 -18.718   6.254
  300   HG23  THR  43          HG23      THR  43  -5.698 -17.733   6.997
  301    H    TYR  44           H        TYR  44  -6.747 -14.469   3.342
  302    HA   TYR  44           HA       TYR  44  -6.493 -15.797   0.816
  303    HB2  TYR  44           HB3      TYR  44  -7.185 -12.916   1.457
  304    HB3  TYR  44           HB2      TYR  44  -7.386 -13.670  -0.125
  305    HD1  TYR  44           HD2      TYR  44  -9.005 -15.528  -0.439
  306    HD2  TYR  44           HD1      TYR  44  -8.688 -13.400   3.280
  307    HE1  TYR  44           HE2      TYR  44 -11.194 -16.448   0.274
  308    HE2  TYR  44           HE1      TYR  44 -10.879 -14.321   3.993
  309    HH   TYR  44           HH       TYR  44 -12.233 -16.633   3.236
  310    H    GLY  45           H        GLY  45  -4.584 -13.237   2.367
  311    HA2  GLY  45           HA3      GLY  45  -2.237 -13.799   0.893
  312    HA3  GLY  45           HA2      GLY  45  -3.080 -12.510   0.035
  313    H    ASN  46           H        ASN  46  -1.337 -11.059   0.548
  314    HA   ASN  46           HA       ASN  46  -1.304 -10.148   3.382
  315    HB2  ASN  46           HB3      ASN  46   0.888 -10.277   1.308
  316    HB3  ASN  46           HB2      ASN  46   1.018  -9.279   2.750
  317   HD21  ASN  46          HD22      ASN  46   0.934 -10.431   4.883
  318   HD22  ASN  46          HD21      ASN  46   1.382 -12.066   4.967
  319    H    GLY  47           H        GLY  47  -0.951  -7.779   3.617
  320    HA2  GLY  47           HA3      GLY  47  -1.622  -6.210   1.176
  321    HA3  GLY  47           HA2      GLY  47  -2.620  -6.013   2.616
  322    H    CYS  48           H        CYS  48  -1.165  -3.873   1.478
  323    HA   CYS  48           HA       CYS  48   1.083  -3.475   3.382
  324    HB2  CYS  48           HB3      CYS  48   0.533  -2.598   0.631
  325    HB3  CYS  48           HB2      CYS  48   1.135  -1.317   1.682
  326    H    TRP  49           H        TRP  49   0.818  -2.046   5.037
  327    HA   TRP  49           HA       TRP  49  -1.602  -0.300   4.985
  328    HB2  TRP  49           HB3      TRP  49  -0.974  -2.180   6.837
  329    HB3  TRP  49           HB2      TRP  49  -0.148  -0.785   7.529
  330    HD1  TRP  49           HD1      TRP  49  -1.825   1.538   7.525
  331    HE1  TRP  49           HE1      TRP  49  -4.255   1.653   8.368
  332    HE3  TRP  49           HE3      TRP  49  -3.076  -3.400   7.252
  333    HZ2  TRP  49           HZ2      TRP  49  -6.450  -0.123   8.857
  334    HZ3  TRP  49           HZ3      TRP  49  -5.338  -4.163   7.908
  335    HH2  TRP  49           HH2      TRP  49  -7.026  -2.533   8.710
  336    H    CYS  50           H        CYS  50  -1.065   1.812   4.561
  337    HA   CYS  50           HA       CYS  50   1.639   2.741   5.409
  338    HB2  CYS  50           HB3      CYS  50   0.780   2.866   2.932
  339    HB3  CYS  50           HB2      CYS  50  -0.085   4.290   3.516
  340    H    ILE  51           H        ILE  51   1.676   3.976   7.201
  341    HA   ILE  51           HA       ILE  51  -0.744   5.612   7.824
  342    HB   ILE  51           HB       ILE  51   1.198   4.378   9.793
  343   HG12  ILE  51          HG13      ILE  51  -1.638   3.555   9.090
  344   HG13  ILE  51          HG12      ILE  51  -0.188   2.713   8.543
  345   HG21  ILE  51          HG21      ILE  51  -0.722   6.469  10.020
  346   HG22  ILE  51          HG22      ILE  51   0.194   5.698  11.314
  347   HG23  ILE  51          HG23      ILE  51  -1.383   5.060  10.850
  348   HD11  ILE  51          HD11      ILE  51  -0.381   1.491  10.438
  349   HD12  ILE  51          HD12      ILE  51  -1.509   2.640  11.160
  350   HD13  ILE  51          HD13      ILE  51   0.229   2.924  11.267
  351    H    ALA  52           H        ALA  52  -0.422   7.755   8.193
  352    HA   ALA  52           HA       ALA  52   1.907   8.954   9.272
  353    HB1  ALA  52           HB1      ALA  52   3.256   9.502   7.521
  354    HB2  ALA  52           HB2      ALA  52   1.899   9.733   6.420
  355    HB3  ALA  52           HB3      ALA  52   2.503   8.110   6.746
  356    H    LEU  53           H        LEU  53  -0.691   9.371   6.885
  357    HA   LEU  53           HA       LEU  53  -1.382  11.942   8.250
  358    HB2  LEU  53           HB3      LEU  53  -0.304  12.343   6.028
  359    HB3  LEU  53           HB2      LEU  53  -1.589  11.399   5.274
  360    HG   LEU  53           HG       LEU  53  -3.266  12.978   6.229
  361   HD11  LEU  53          HD11      LEU  53  -1.971  15.252   6.881
  362   HD12  LEU  53          HD12      LEU  53  -0.780  14.077   7.440
  363   HD13  LEU  53          HD13      LEU  53  -2.422  14.041   8.081
  364   HD21  LEU  53          HD21      LEU  53  -1.288  14.696   4.783
  365   HD22  LEU  53          HD22      LEU  53  -3.016  14.496   4.497
  366   HD23  LEU  53          HD23      LEU  53  -1.884  13.252   3.966
  367    HA   PRO  54           HA       PRO  54  -5.078   9.164   7.958
  368    HB2  PRO  54           HB2      PRO  54  -5.545   8.830  10.595
  369    HB3  PRO  54           HB3      PRO  54  -4.355   7.850   9.718
  370    HG2  PRO  54           HG3      PRO  54  -3.933  10.112  11.585
  371    HG3  PRO  54           HG2      PRO  54  -2.934   8.678  11.299
  372    HD2  PRO  54           HD3      PRO  54  -2.465  11.250  10.242
  373    HD3  PRO  54           HD2      PRO  54  -1.697   9.743   9.701
  374    H    ASP  55           H        ASP  55  -4.853  12.155   7.938
  375    HA   ASP  55           HA       ASP  55  -6.518  13.440   9.796
  376    HB2  ASP  55           HB3      ASP  55  -5.240  14.535   7.907
  377    HB3  ASP  55           HB2      ASP  55  -6.519  14.001   6.817
  378    H    ASN  56           H        ASN  56  -7.394  11.472   6.992
  379    HA   ASN  56           HA       ASN  56 -10.212  11.493   7.976
  380    HB2  ASN  56           HB3      ASN  56  -9.244  11.583   5.108
  381    HB3  ASN  56           HB2      ASN  56 -10.925  11.339   5.587
  382   HD21  ASN  56          HD22      ASN  56 -10.094  13.626   4.041
  383   HD22  ASN  56          HD21      ASN  56 -10.313  15.012   4.996
  384    H    VAL  57           H        VAL  57  -7.516   9.731   6.654
  385    HA   VAL  57           HA       VAL  57  -7.198   7.433   6.271
  386    HB   VAL  57           HB       VAL  57  -9.255   7.345   8.498
  387   HG11  VAL  57          HG11      VAL  57  -9.292   5.129   8.013
  388   HG12  VAL  57          HG12      VAL  57  -7.671   5.097   8.706
  389   HG13  VAL  57          HG13      VAL  57  -7.880   5.248   6.962
  390   HG21  VAL  57          HG21      VAL  57  -7.072   8.569   8.908
  391   HG22  VAL  57          HG22      VAL  57  -6.242   7.041   8.615
  392   HG23  VAL  57          HG23      VAL  57  -7.356   7.193   9.974
  393    HA   PRO  58           HA       PRO  58 -11.185   6.900   3.935
  394    HB2  PRO  58           HB2      PRO  58 -10.636   8.011   1.594
  395    HB3  PRO  58           HB3      PRO  58 -10.920   9.061   3.003
  396    HG2  PRO  58           HG3      PRO  58  -8.348   8.252   1.733
  397    HG3  PRO  58           HG2      PRO  58  -8.841   9.834   2.364
  398    HD2  PRO  58           HD3      PRO  58  -7.300   7.924   3.752
  399    HD3  PRO  58           HD2      PRO  58  -8.128   9.316   4.485
  400    H    ILE  59           H        ILE  59 -11.564   5.320   2.225
  401    HA   ILE  59           HA       ILE  59  -9.106   3.907   1.292
  402    HB   ILE  59           HB       ILE  59 -11.751   2.642   2.057
  403   HG12  ILE  59          HG13      ILE  59  -9.092   2.445   3.489
  404   HG13  ILE  59          HG12      ILE  59 -10.317   3.632   3.934
  405   HG21  ILE  59          HG21      ILE  59 -10.934   0.724   1.171
  406   HG22  ILE  59          HG22      ILE  59  -9.353   0.976   1.910
  407   HG23  ILE  59          HG23      ILE  59  -9.734   1.731   0.363
  408   HD11  ILE  59          HD11      ILE  59 -11.368   0.907   3.633
  409   HD12  ILE  59          HD12      ILE  59 -11.627   2.078   4.924
  410   HD13  ILE  59          HD13      ILE  59 -10.178   1.072   4.925
  411    H    ARG  60           H        ARG  60  -8.970   3.943  -0.889
  412    HA   ARG  60           HA       ARG  60 -11.435   4.530  -2.425
  413    HB2  ARG  60           HB3      ARG  60  -8.659   5.248  -2.694
  414    HB3  ARG  60           HB2      ARG  60  -9.191   4.411  -4.152
  415    HG2  ARG  60           HG3      ARG  60 -10.626   6.756  -2.868
  416    HG3  ARG  60           HG2      ARG  60  -9.601   6.853  -4.302
  417    HD2  ARG  60           HD3      ARG  60 -11.318   4.797  -4.952
  418    HD3  ARG  60           HD2      ARG  60 -12.366   5.882  -4.039
  419    HE   ARG  60           HE       ARG  60 -12.322   7.297  -5.913
  420   HH11  ARG  60          HH22      ARG  60  -9.458   5.389  -5.705
  421   HH12  ARG  60          HH21      ARG  60  -8.771   6.022  -7.163
  422   HH21  ARG  60          HH11      ARG  60 -11.441   8.135  -7.817
  423   HH22  ARG  60          HH12      ARG  60  -9.893   7.578  -8.359
  424    H    ILE  61           H        ILE  61 -12.395   2.446  -2.427
  425    HA   ILE  61           HA       ILE  61 -10.934   0.431  -4.086
  426    HB   ILE  61           HB       ILE  61 -12.412  -1.223  -2.670
  427   HG12  ILE  61          HG13      ILE  61 -12.064   1.122  -0.779
  428   HG13  ILE  61          HG12      ILE  61 -13.599   0.622  -1.487
  429   HG21  ILE  61          HG21      ILE  61  -9.924  -1.135  -2.729
  430   HG22  ILE  61          HG22      ILE  61 -10.538  -1.501  -1.116
  431   HG23  ILE  61          HG23      ILE  61  -9.960   0.122  -1.494
  432   HD11  ILE  61          HD11      ILE  61 -13.442  -1.553  -0.397
  433   HD12  ILE  61          HD12      ILE  61 -13.260  -0.286   0.816
  434   HD13  ILE  61          HD13      ILE  61 -11.842  -1.156   0.230
  435    HA   PRO  62           HA       PRO  62 -15.086   1.358  -5.913
  436    HB2  PRO  62           HB2      PRO  62 -14.216   1.899  -8.439
  437    HB3  PRO  62           HB3      PRO  62 -14.274   3.124  -7.157
  438    HG2  PRO  62           HG3      PRO  62 -11.957   1.660  -8.270
  439    HG3  PRO  62           HG2      PRO  62 -12.054   3.300  -7.612
  440    HD2  PRO  62           HD3      PRO  62 -11.045   1.064  -6.258
  441    HD3  PRO  62           HD2      PRO  62 -11.533   2.594  -5.501
  442    H    GLY  63           H        GLY  63 -13.174  -1.146  -5.795
  443    HA2  GLY  63           HA3      GLY  63 -13.942  -3.370  -6.434
  444    HA3  GLY  63           HA2      GLY  63 -14.658  -2.659  -7.881
  445    H    LYS  64           H        LYS  64 -12.103  -0.982  -8.116
  446    HA   LYS  64           HA       LYS  64 -10.752  -2.607 -10.027
  447    HB2  LYS  64           HB3      LYS  64 -10.612  -0.128  -9.972
  448    HB3  LYS  64           HB2      LYS  64  -9.672  -0.231  -8.483
  449    HG2  LYS  64           HG3      LYS  64  -7.965  -1.587  -9.694
  450    HG3  LYS  64           HG2      LYS  64  -8.884  -1.364 -11.183
  451    HD2  LYS  64           HD3      LYS  64  -8.625   1.078 -10.984
  452    HD3  LYS  64           HD2      LYS  64  -7.711   0.863  -9.490
  453    HE2  LYS  64           HE3      LYS  64  -5.836   0.614 -10.700
  454    HE3  LYS  64           HE2      LYS  64  -6.525  -0.832 -11.433
  455    HZ1  LYS  64           HZ1      LYS  64  -7.670   1.488 -12.572
  456    HZ2  LYS  64           HZ2      LYS  64  -6.803   0.245 -13.332
  457    HZ3  LYS  64           HZ3      LYS  64  -5.977   1.576 -12.673
  458    H    CYS  65           H        CYS  65 -10.109  -1.970  -6.600
  459    HA   CYS  65           HA       CYS  65  -7.589  -3.266  -6.422
  460    HB2  CYS  65           HB3      CYS  65  -8.772  -1.870  -4.639
  461    HB3  CYS  65           HB2      CYS  65  -9.701  -3.321  -4.259
  462    H    HIS  66           H        HIS  66 -10.877  -4.569  -6.378
  463    HA   HIS  66           HA       HIS  66 -10.335  -7.189  -5.481
  464    HB2  HIS  66           HB3      HIS  66 -12.615  -6.280  -5.948
  465    HB3  HIS  66           HB2      HIS  66 -12.276  -6.400  -7.675
  466    HD1  HIS  66           HD1      HIS  66 -12.137  -8.724  -4.637
  467    HD2  HIS  66           HD2      HIS  66 -13.069  -8.832  -8.702
  468    HE1  HIS  66           HE1      HIS  66 -12.909 -11.087  -5.135
  469    HE2  HIS  66           HE2      HIS  66 -13.478 -11.163  -7.606
  Start of MODEL    4
    1    H1   ALA   1           H1       ALA   1  -2.216  10.753   4.095
    2    H2   ALA   1           H2       ALA   1  -3.132  10.664   2.667
    3    H3   ALA   1           H3       ALA   1  -2.076   9.401   3.082
    4    HA   ALA   1           HA       ALA   1  -4.221  10.114   4.951
    5    HB1  ALA   1           HB1      ALA   1  -4.992   9.785   2.426
    6    HB2  ALA   1           HB2      ALA   1  -5.894   9.050   3.752
    7    HB3  ALA   1           HB3      ALA   1  -4.752   8.082   2.819
    8    H    ARG   2           H        ARG   2  -5.073   7.307   4.820
    9    HA   ARG   2           HA       ARG   2  -2.615   5.994   5.914
   10    HB2  ARG   2           HB3      ARG   2  -4.201   6.656   7.710
   11    HB3  ARG   2           HB2      ARG   2  -5.462   5.706   6.922
   12    HG2  ARG   2           HG3      ARG   2  -4.055   3.675   7.160
   13    HG3  ARG   2           HG2      ARG   2  -2.839   4.635   8.000
   14    HD2  ARG   2           HD3      ARG   2  -4.197   3.533   9.667
   15    HD3  ARG   2           HD2      ARG   2  -4.591   5.252   9.690
   16    HE   ARG   2           HE       ARG   2  -6.771   4.684   9.005
   17   HH11  ARG   2          HH22      ARG   2  -4.504   2.185   8.292
   18   HH12  ARG   2          HH21      ARG   2  -5.706   1.075   7.725
   19   HH21  ARG   2          HH11      ARG   2  -8.352   3.249   8.268
   20   HH22  ARG   2          HH12      ARG   2  -7.885   1.677   7.710
   21    H    ASP   3           H        ASP   3  -2.176   4.025   5.002
   22    HA   ASP   3           HA       ASP   3  -4.214   2.895   3.158
   23    HB2  ASP   3           HB3      ASP   3  -1.272   2.229   3.460
   24    HB3  ASP   3           HB2      ASP   3  -2.353   1.572   2.237
   25    H    ALA   4           H        ALA   4  -4.926   0.750   3.404
   26    HA   ALA   4           HA       ALA   4  -4.266  -0.488   6.035
   27    HB1  ALA   4           HB1      ALA   4  -6.458  -1.823   5.365
   28    HB2  ALA   4           HB2      ALA   4  -6.735  -0.414   4.344
   29    HB3  ALA   4           HB3      ALA   4  -6.571  -0.219   6.088
   30    H    TYR   5           H        TYR   5  -5.762  -2.049   3.250
   31    HA   TYR   5           HA       TYR   5  -3.559  -4.051   3.302
   32    HB2  TYR   5           HB3      TYR   5  -6.142  -4.233   1.742
   33    HB3  TYR   5           HB2      TYR   5  -5.080  -5.544   2.247
   34    HD1  TYR   5           HD1      TYR   5  -4.881  -6.113   4.696
   35    HD2  TYR   5           HD2      TYR   5  -7.823  -3.374   3.186
   36    HE1  TYR   5           HE1      TYR   5  -6.173  -6.344   6.801
   37    HE2  TYR   5           HE2      TYR   5  -9.118  -3.603   5.292
   38    HH   TYR   5           HH       TYR   5  -9.098  -4.410   7.380
   39    H    ILE   6           H        ILE   6  -5.077  -1.631   1.294
   40    HA   ILE   6           HA       ILE   6  -3.367  -2.407  -1.008
   41    HB   ILE   6           HB       ILE   6  -5.715  -0.505  -0.820
   42   HG12  ILE   6          HG13      ILE   6  -5.476  -3.227  -2.137
   43   HG13  ILE   6          HG12      ILE   6  -6.225  -2.948  -0.564
   44   HG21  ILE   6          HG21      ILE   6  -3.698  -1.041  -2.903
   45   HG22  ILE   6          HG22      ILE   6  -4.747   0.358  -2.684
   46   HG23  ILE   6          HG23      ILE   6  -5.369  -1.095  -3.464
   47   HD11  ILE   6          HD11      ILE   6  -8.010  -2.958  -2.158
   48   HD12  ILE   6          HD12      ILE   6  -7.123  -1.898  -3.252
   49   HD13  ILE   6          HD13      ILE   6  -7.745  -1.268  -1.727
   50    H    ALA   7           H        ALA   7  -1.797  -1.020  -1.792
   51    HA   ALA   7           HA       ALA   7  -1.268   1.404  -0.133
   52    HB1  ALA   7           HB1      ALA   7   0.879   0.729  -0.144
   53    HB2  ALA   7           HB2      ALA   7   0.895   0.765  -1.907
   54    HB3  ALA   7           HB3      ALA   7   0.403  -0.701  -1.059
   55    H    LYS   8           H        LYS   8  -2.492   0.437  -3.085
   56    HA   LYS   8           HA       LYS   8  -1.922   3.108  -4.284
   57    HB2  LYS   8           HB3      LYS   8  -2.505   0.794  -6.067
   58    HB3  LYS   8           HB2      LYS   8  -1.429   2.168  -6.325
   59    HG2  LYS   8           HG3      LYS   8  -0.053   1.087  -4.356
   60    HG3  LYS   8           HG2      LYS   8  -0.918  -0.378  -4.814
   61    HD2  LYS   8           HD3      LYS   8   0.651   1.335  -6.762
   62    HD3  LYS   8           HD2      LYS   8   1.296  -0.104  -5.974
   63    HE2  LYS   8           HE3      LYS   8  -1.197  -0.877  -7.021
   64    HE3  LYS   8           HE2      LYS   8  -0.427   0.078  -8.288
   65    HZ1  LYS   8           HZ1      LYS   8   1.446  -1.653  -7.053
   66    HZ2  LYS   8           HZ2      LYS   8   0.993  -1.556  -8.685
   67    HZ3  LYS   8           HZ3      LYS   8   0.111  -2.541  -7.617
   68    HA   PRO   9           HA       PRO   9  -6.465   2.801  -3.403
   69    HB2  PRO   9           HB2      PRO   9  -6.132   5.611  -4.375
   70    HB3  PRO   9           HB3      PRO   9  -7.066   4.999  -2.996
   71    HG2  PRO   9           HG3      PRO   9  -4.722   6.214  -2.654
   72    HG3  PRO   9           HG2      PRO   9  -5.224   4.853  -1.636
   73    HD2  PRO   9           HD3      PRO   9  -3.176   4.930  -3.795
   74    HD3  PRO   9           HD2      PRO   9  -3.267   3.880  -2.362
   75    H    HIS  10           H        HIS  10  -4.740   3.905  -6.263
   76    HA   HIS  10           HA       HIS  10  -7.157   3.737  -7.935
   77    HB2  HIS  10           HB3      HIS  10  -4.243   4.196  -8.649
   78    HB3  HIS  10           HB2      HIS  10  -5.584   4.273  -9.792
   79    HD1  HIS  10           HD1      HIS  10  -3.976   6.145  -6.978
   80    HD2  HIS  10           HD2      HIS  10  -7.301   6.549  -9.464
   81    HE1  HIS  10           HE1      HIS  10  -4.830   8.510  -6.657
   82    HE2  HIS  10           HE2      HIS  10  -6.853   8.766  -8.166
   83    H    ASN  11           H        ASN  11  -4.583   1.709  -6.865
   84    HA   ASN  11           HA       ASN  11  -5.627  -0.470  -8.597
   85    HB2  ASN  11           HB3      ASN  11  -2.703   0.249  -8.274
   86    HB3  ASN  11           HB2      ASN  11  -3.295  -1.211  -9.067
   87   HD21  ASN  11          HD22      ASN  11  -4.089   2.317  -9.206
   88   HD22  ASN  11          HD21      ASN  11  -4.116   2.388 -10.903
   89    H    CYS  12           H        CYS  12  -3.437  -2.237  -7.646
   90    HA   CYS  12           HA       CYS  12  -3.978  -2.364  -4.732
   91    HB2  CYS  12           HB3      CYS  12  -4.521  -4.548  -6.749
   92    HB3  CYS  12           HB2      CYS  12  -4.364  -4.860  -5.021
   93    H    VAL  13           H        VAL  13  -2.597  -4.385  -3.865
   94    HA   VAL  13           HA       VAL  13   0.127  -3.992  -5.006
   95    HB   VAL  13           HB       VAL  13  -0.691  -5.227  -2.353
   96   HG11  VAL  13          HG11      VAL  13   1.516  -5.949  -3.223
   97   HG12  VAL  13          HG12      VAL  13   1.685  -4.932  -1.792
   98   HG13  VAL  13          HG13      VAL  13   1.991  -4.259  -3.393
   99   HG21  VAL  13          HG21      VAL  13   0.618  -2.828  -1.868
  100   HG22  VAL  13          HG22      VAL  13  -1.125  -3.079  -1.772
  101   HG23  VAL  13          HG23      VAL  13  -0.407  -2.449  -3.253
  102    H    TYR  14           H        TYR  14   1.068  -5.640  -6.121
  103    HA   TYR  14           HA       TYR  14  -0.374  -8.080  -6.638
  104    HB2  TYR  14           HB3      TYR  14   1.477  -8.697  -8.013
  105    HB3  TYR  14           HB2      TYR  14   1.335  -6.946  -8.164
  106    HD1  TYR  14           HD2      TYR  14   2.889  -5.448  -6.921
  107    HD2  TYR  14           HD1      TYR  14   3.380  -9.715  -6.952
  108    HE1  TYR  14           HE2      TYR  14   5.215  -5.186  -6.108
  109    HE2  TYR  14           HE1      TYR  14   5.708  -9.452  -6.140
  110    HH   TYR  14           HH       TYR  14   6.966  -7.557  -4.749
  111    H    GLU  15           H        GLU  15   2.245  -7.211  -4.431
  112    HA   GLU  15           HA       GLU  15   1.657  -9.440  -2.701
  113    HB2  GLU  15           HB3      GLU  15   2.901 -10.566  -4.624
  114    HB3  GLU  15           HB2      GLU  15   4.317  -9.633  -4.131
  115    HG2  GLU  15           HG3      GLU  15   4.125 -10.596  -1.846
  116    HG3  GLU  15           HG2      GLU  15   2.783 -11.596  -2.406
  117    H    CYS  16           H        CYS  16   1.736  -7.798  -1.085
  118    HA   CYS  16           HA       CYS  16   4.036  -6.051  -0.824
  119    HB2  CYS  16           HB3      CYS  16   2.745  -5.028   0.725
  120    HB3  CYS  16           HB2      CYS  16   1.491  -6.212   0.359
  121    H    PHE  17           H        PHE  17   5.987  -6.620  -0.012
  122    HA   PHE  17           HA       PHE  17   6.260  -9.278   1.244
  123    HB2  PHE  17           HB3      PHE  17   7.863  -8.785  -0.486
  124    HB3  PHE  17           HB2      PHE  17   8.297  -7.259   0.280
  125    HD1  PHE  17           HD2      PHE  17   8.464 -10.948   0.580
  126    HD2  PHE  17           HD1      PHE  17   9.770  -7.185   2.189
  127    HE1  PHE  17           HE2      PHE  17  10.147 -12.125   1.972
  128    HE2  PHE  17           HE1      PHE  17  11.449  -8.363   3.582
  129    HZ   PHE  17           HZ       PHE  17  11.635 -10.832   3.475
  130    H    ASP  18           H        ASP  18   7.552  -9.498   3.242
  131    HA   ASP  18           HA       ASP  18   6.582  -8.142   5.429
  132    HB2  ASP  18           HB3      ASP  18   9.396  -9.197   5.040
  133    HB3  ASP  18           HB2      ASP  18   8.719  -8.735   6.602
  134    H    ALA  19           H        ALA  19   6.689  -6.083   6.141
  135    HA   ALA  19           HA       ALA  19   8.265  -4.099   4.730
  136    HB1  ALA  19           HB1      ALA  19   7.261  -2.504   6.244
  137    HB2  ALA  19           HB2      ALA  19   6.806  -3.784   7.368
  138    HB3  ALA  19           HB3      ALA  19   6.017  -3.670   5.795
  139    H    PHE  20           H        PHE  20   8.946  -6.251   7.270
  140    HA   PHE  20           HA       PHE  20  10.603  -4.791   9.002
  141    HB2  PHE  20           HB3      PHE  20  10.032  -7.213   9.255
  142    HB3  PHE  20           HB2      PHE  20  11.160  -7.581   7.951
  143    HD1  PHE  20           HD1      PHE  20  10.857  -6.262  11.401
  144    HD2  PHE  20           HD2      PHE  20  13.544  -7.515   8.292
  145    HE1  PHE  20           HE1      PHE  20  12.737  -6.249  13.019
  146    HE2  PHE  20           HE2      PHE  20  15.423  -7.503   9.910
  147    HZ   PHE  20           HZ       PHE  20  15.019  -6.870  12.275
  148    H    SER  21           H        SER  21  11.478  -6.300   5.876
  149    HA   SER  21           HA       SER  21  14.213  -5.416   5.952
  150    HB2  SER  21           HB3      SER  21  12.499  -6.002   3.523
  151    HB3  SER  21           HB2      SER  21  14.259  -5.965   3.572
  152    HG   SER  21           HG       SER  21  14.274  -7.793   4.746
  153    H    SER  22           H        SER  22  11.525  -4.206   3.935
  154    HA   SER  22           HA       SER  22  11.402  -1.555   4.465
  155    HB2  SER  22           HB3      SER  22  14.032  -2.153   3.170
  156    HB3  SER  22           HB2      SER  22  13.192  -0.682   2.692
  157    HG   SER  22           HG       SER  22  13.862   0.139   4.495
  158    H    TYR  23           H        TYR  23  10.982  -4.098   2.438
  159    HA   TYR  23           HA       TYR  23  10.639  -2.967  -0.136
  160    HB2  TYR  23           HB3      TYR  23  10.554  -5.399   0.328
  161    HB3  TYR  23           HB2      TYR  23   9.005  -5.175   1.141
  162    HD1  TYR  23           HD2      TYR  23  10.758  -5.130  -2.100
  163    HD2  TYR  23           HD1      TYR  23   6.986  -4.631  -0.106
  164    HE1  TYR  23           HE2      TYR  23   9.589  -5.246  -4.284
  165    HE2  TYR  23           HE1      TYR  23   5.817  -4.748  -2.291
  166    HH   TYR  23           HH       TYR  23   7.583  -4.755  -5.321
  167    H    CYS  24           H        CYS  24   8.140  -3.451   2.388
  168    HA   CYS  24           HA       CYS  24   6.111  -2.033   0.931
  169    HB2  CYS  24           HB3      CYS  24   5.705  -3.600   2.873
  170    HB3  CYS  24           HB2      CYS  24   6.295  -2.327   3.940
  171    H    ASN  25           H        ASN  25   8.466  -1.041   3.384
  172    HA   ASN  25           HA       ASN  25   7.547   1.624   3.742
  173    HB2  ASN  25           HB3      ASN  25  10.393   0.576   3.829
  174    HB3  ASN  25           HB2      ASN  25   9.843   2.106   4.512
  175   HD21  ASN  25          HD22      ASN  25   7.421  -0.276   4.797
  176   HD22  ASN  25          HD21      ASN  25   7.716  -0.726   6.407
  177    H    GLY  26           H        GLY  26   9.698   0.194   1.317
  178    HA2  GLY  26           HA3      GLY  26  10.496   2.644   0.075
  179    HA3  GLY  26           HA2      GLY  26  10.489   1.066  -0.716
  180    H    VAL  27           H        VAL  27   7.836   0.377  -0.693
  181    HA   VAL  27           HA       VAL  27   6.760   1.975  -2.826
  182    HB   VAL  27           HB       VAL  27   5.458  -0.093  -1.031
  183   HG11  VAL  27          HG11      VAL  27   4.355   1.713  -3.054
  184   HG12  VAL  27          HG12      VAL  27   3.516   0.681  -1.895
  185   HG13  VAL  27          HG13      VAL  27   4.066   0.015  -3.434
  186   HG21  VAL  27          HG21      VAL  27   7.167  -1.120  -2.341
  187   HG22  VAL  27          HG22      VAL  27   6.759  -0.158  -3.762
  188   HG23  VAL  27          HG23      VAL  27   5.667  -1.430  -3.215
  189    H    CYS  28           H        CYS  28   6.020   1.744   0.635
  190    HA   CYS  28           HA       CYS  28   3.848   3.604   0.639
  191    HB2  CYS  28           HB3      CYS  28   4.464   2.013   2.505
  192    HB3  CYS  28           HB2      CYS  28   5.798   3.095   2.900
  193    H    THR  29           H        THR  29   7.348   4.026   0.878
  194    HA   THR  29           HA       THR  29   7.436   6.716   1.725
  195    HB   THR  29           HB       THR  29   9.273   5.401  -0.295
  196    HG1  THR  29           HG1      THR  29   9.146   5.360   2.525
  197   HG21  THR  29          HG21      THR  29  10.527   7.208   1.554
  198   HG22  THR  29          HG22      THR  29   9.175   8.028   0.772
  199   HG23  THR  29          HG23      THR  29  10.456   7.309  -0.205
  200    H    LYS  30           H        LYS  30   7.052   5.414  -1.573
  201    HA   LYS  30           HA       LYS  30   7.134   7.917  -2.929
  202    HB2  LYS  30           HB3      LYS  30   5.749   5.307  -3.566
  203    HB3  LYS  30           HB2      LYS  30   5.650   6.699  -4.642
  204    HG2  LYS  30           HG3      LYS  30   7.485   5.450  -5.466
  205    HG3  LYS  30           HG2      LYS  30   8.228   6.743  -4.527
  206    HD2  LYS  30           HD3      LYS  30   8.608   5.278  -2.660
  207    HD3  LYS  30           HD2      LYS  30   7.619   4.008  -3.382
  208    HE2  LYS  30           HE3      LYS  30   9.216   3.690  -5.166
  209    HE3  LYS  30           HE2      LYS  30  10.152   5.089  -4.639
  210    HZ1  LYS  30           HZ1      LYS  30   9.991   2.414  -3.481
  211    HZ2  LYS  30           HZ2      LYS  30  10.156   3.712  -2.403
  212    HZ3  LYS  30           HZ3      LYS  30  11.321   3.462  -3.614
  213    H    ASN  31           H        ASN  31   4.485   6.219  -1.314
  214    HA   ASN  31           HA       ASN  31   2.356   7.910  -2.147
  215    HB2  ASN  31           HB3      ASN  31   2.743   6.450   0.486
  216    HB3  ASN  31           HB2      ASN  31   1.222   7.158  -0.058
  217   HD21  ASN  31          HD22      ASN  31   1.461   4.340   0.419
  218   HD22  ASN  31          HD21      ASN  31   1.317   3.533  -1.067
  219    H    GLY  32           H        GLY  32   4.887   8.337   0.231
  220    HA2  GLY  32           HA3      GLY  32   5.590  10.561   0.921
  221    HA3  GLY  32           HA2      GLY  32   3.943  11.130   0.643
  222    H    ALA  33           H        ALA  33   3.615   8.204   2.087
  223    HA   ALA  33           HA       ALA  33   2.732   9.328   4.588
  224    HB1  ALA  33           HB1      ALA  33   1.862   7.258   4.974
  225    HB2  ALA  33           HB2      ALA  33   3.364   6.441   4.542
  226    HB3  ALA  33           HB3      ALA  33   2.257   6.979   3.279
  227    H    LYS  34           H        LYS  34   3.696   9.076   6.677
  228    HA   LYS  34           HA       LYS  34   6.495   9.487   6.830
  229    HB2  LYS  34           HB3      LYS  34   4.822  10.041   8.618
  230    HB3  LYS  34           HB2      LYS  34   4.714   8.321   8.989
  231    HG2  LYS  34           HG3      LYS  34   7.423   8.697   9.031
  232    HG3  LYS  34           HG2      LYS  34   6.851  10.253   9.631
  233    HD2  LYS  34           HD3      LYS  34   6.019   7.547  10.718
  234    HD3  LYS  34           HD2      LYS  34   7.176   8.640  11.481
  235    HE2  LYS  34           HE3      LYS  34   5.096  10.340  11.132
  236    HE3  LYS  34           HE2      LYS  34   4.217   8.823  11.330
  237    HZ1  LYS  34           HZ1      LYS  34   6.404   9.426  13.185
  238    HZ2  LYS  34           HZ2      LYS  34   4.976   8.550  13.447
  239    HZ3  LYS  34           HZ3      LYS  34   4.930  10.248  13.387
  240    H    SER  35           H        SER  35   4.715   6.552   7.872
  241    HA   SER  35           HA       SER  35   6.963   4.906   6.857
  242    HB2  SER  35           HB3      SER  35   5.895   4.725   9.691
  243    HB3  SER  35           HB2      SER  35   7.087   3.645   8.974
  244    HG   SER  35           HG       SER  35   7.658   5.748  10.260
  245    H    GLY  36           H        GLY  36   6.336   2.572   6.757
  246    HA2  GLY  36           HA3      GLY  36   3.417   2.112   6.931
  247    HA3  GLY  36           HA2      GLY  36   4.193   1.855   5.370
  248    H    TYR  37           H        TYR  37   2.844  -0.178   6.843
  249    HA   TYR  37           HA       TYR  37   5.126  -2.042   7.306
  250    HB2  TYR  37           HB3      TYR  37   2.607  -2.072   8.982
  251    HB3  TYR  37           HB2      TYR  37   4.100  -2.969   9.260
  252    HD1  TYR  37           HD2      TYR  37   6.278  -1.488   9.511
  253    HD2  TYR  37           HD1      TYR  37   2.269  -0.065  10.110
  254    HE1  TYR  37           HE2      TYR  37   7.149   0.396  10.870
  255    HE2  TYR  37           HE1      TYR  37   3.139   1.819  11.467
  256    HH   TYR  37           HH       TYR  37   4.945   2.843  12.245
  257    H    CYS  38           H        CYS  38   4.443  -4.343   7.012
  258    HA   CYS  38           HA       CYS  38   2.310  -4.515   4.959
  259    HB2  CYS  38           HB3      CYS  38   4.833  -5.922   5.469
  260    HB3  CYS  38           HB2      CYS  38   3.492  -7.000   5.085
  261    H    GLN  39           H        GLN  39   0.379  -5.322   5.527
  262    HA   GLN  39           HA       GLN  39   0.192  -6.903   8.052
  263    HB2  GLN  39           HB3      GLN  39  -1.160  -4.771   7.827
  264    HB3  GLN  39           HB2      GLN  39  -2.064  -5.567   6.535
  265    HG2  GLN  39           HG3      GLN  39  -2.753  -7.343   8.059
  266    HG3  GLN  39           HG2      GLN  39  -1.777  -6.646   9.353
  267   HE21  GLN  39          HE22      GLN  39  -2.485  -4.554  10.258
  268   HE22  GLN  39          HE21      GLN  39  -4.087  -4.029  10.064
  269    H    ILE  40           H        ILE  40  -1.152  -8.851   7.998
  270    HA   ILE  40           HA       ILE  40  -1.011 -10.141   5.343
  271    HB   ILE  40           HB       ILE  40  -1.376 -12.226   6.533
  272   HG12  ILE  40          HG13      ILE  40  -1.756 -10.476   8.988
  273   HG13  ILE  40          HG12      ILE  40  -3.026 -11.396   8.182
  274   HG21  ILE  40          HG21      ILE  40   0.903 -11.225   6.533
  275   HG22  ILE  40          HG22      ILE  40   0.607 -12.188   7.980
  276   HG23  ILE  40          HG23      ILE  40   0.533 -10.427   8.062
  277   HD11  ILE  40          HD11      ILE  40  -2.433 -12.906   9.831
  278   HD12  ILE  40          HD12      ILE  40  -0.750 -12.378   9.854
  279   HD13  ILE  40          HD13      ILE  40  -1.334 -13.408   8.547
  280    H    LEU  41           H        LEU  41  -2.782 -11.071   4.312
  281    HA   LEU  41           HA       LEU  41  -5.360  -9.818   4.874
  282    HB2  LEU  41           HB3      LEU  41  -4.569 -11.875   2.792
  283    HB3  LEU  41           HB2      LEU  41  -6.075 -10.970   2.827
  284    HG   LEU  41           HG       LEU  41  -3.304  -9.784   2.545
  285   HD11  LEU  41          HD11      LEU  41  -5.231 -10.808   0.644
  286   HD12  LEU  41          HD12      LEU  41  -3.611 -10.174   0.346
  287   HD13  LEU  41          HD13      LEU  41  -4.991  -9.079   0.399
  288   HD21  LEU  41          HD21      LEU  41  -4.953  -7.774   1.923
  289   HD22  LEU  41          HD22      LEU  41  -4.432  -8.058   3.583
  290   HD23  LEU  41          HD23      LEU  41  -6.012  -8.629   3.043
  291    H    GLY  42           H        GLY  42  -7.320 -11.077   5.293
  292    HA2  GLY  42           HA3      GLY  42  -7.198 -12.979   7.317
  293    HA3  GLY  42           HA2      GLY  42  -8.528 -12.924   6.153
  294    H    THR  43           H        THR  43  -6.363 -13.327   4.016
  295    HA   THR  43           HA       THR  43  -6.090 -16.279   4.349
  296    HB   THR  43           HB       THR  43  -6.420 -16.541   1.996
  297    HG1  THR  43           HG1      THR  43  -6.854 -14.006   1.246
  298   HG21  THR  43          HG21      THR  43  -8.384 -15.570   3.608
  299   HG22  THR  43          HG22      THR  43  -8.648 -16.062   1.935
  300   HG23  THR  43          HG23      THR  43  -8.394 -14.361   2.323
  301    H    TYR  44           H        TYR  44  -4.212 -17.081   2.830
  302    HA   TYR  44           HA       TYR  44  -1.760 -16.145   3.758
  303    HB2  TYR  44           HB3      TYR  44  -0.727 -17.395   2.011
  304    HB3  TYR  44           HB2      TYR  44  -2.238 -18.236   2.354
  305    HD1  TYR  44           HD1      TYR  44  -4.201 -17.962   0.850
  306    HD2  TYR  44           HD2      TYR  44  -0.368 -16.262  -0.084
  307    HE1  TYR  44           HE1      TYR  44  -4.916 -17.643  -1.503
  308    HE2  TYR  44           HE2      TYR  44  -1.084 -15.943  -2.438
  309    HH   TYR  44           HH       TYR  44  -4.146 -15.940  -3.442
  310    H    GLY  45           H        GLY  45  -3.876 -14.446   1.747
  311    HA2  GLY  45           HA3      GLY  45  -2.077 -13.053   0.024
  312    HA3  GLY  45           HA2      GLY  45  -3.646 -12.445   0.548
  313    H    ASN  46           H        ASN  46  -1.431 -10.735   0.273
  314    HA   ASN  46           HA       ASN  46  -1.093  -9.857   3.085
  315    HB2  ASN  46           HB3      ASN  46   0.948 -11.156   2.287
  316    HB3  ASN  46           HB2      ASN  46   1.209  -9.855   1.122
  317   HD21  ASN  46          HD22      ASN  46   3.043 -10.456   3.312
  318   HD22  ASN  46          HD21      ASN  46   3.051  -9.111   4.347
  319    H    GLY  47           H        GLY  47  -0.631  -7.541   3.257
  320    HA2  GLY  47           HA3      GLY  47  -0.965  -5.990   0.744
  321    HA3  GLY  47           HA2      GLY  47  -2.091  -5.696   2.069
  322    H    CYS  48           H        CYS  48  -0.716  -3.529   1.348
  323    HA   CYS  48           HA       CYS  48   1.606  -3.320   3.199
  324    HB2  CYS  48           HB3      CYS  48   1.013  -2.178   0.581
  325    HB3  CYS  48           HB2      CYS  48   1.498  -0.952   1.751
  326    H    TRP  49           H        TRP  49   1.732  -1.358   4.539
  327    HA   TRP  49           HA       TRP  49  -0.931  -0.119   5.083
  328    HB2  TRP  49           HB3      TRP  49   0.027  -1.987   6.709
  329    HB3  TRP  49           HB2      TRP  49   1.008  -0.651   7.307
  330    HD1  TRP  49           HD1      TRP  49  -0.282   1.444   8.361
  331    HE1  TRP  49           HE1      TRP  49  -2.607   1.625   9.461
  332    HE3  TRP  49           HE3      TRP  49  -2.369  -2.900   6.697
  333    HZ2  TRP  49           HZ2      TRP  49  -5.038   0.116   9.609
  334    HZ3  TRP  49           HZ3      TRP  49  -4.686  -3.507   7.325
  335    HH2  TRP  49           HH2      TRP  49  -6.022  -2.008   8.781
  336    H    CYS  50           H        CYS  50  -0.839   2.127   5.519
  337    HA   CYS  50           HA       CYS  50   1.884   3.327   5.808
  338    HB2  CYS  50           HB3      CYS  50  -0.250   4.174   3.840
  339    HB3  CYS  50           HB2      CYS  50   1.089   5.213   4.307
  340    H    ILE  51           H        ILE  51   1.973   4.833   7.403
  341    HA   ILE  51           HA       ILE  51  -0.599   5.991   8.381
  342    HB   ILE  51           HB       ILE  51   1.779   5.102  10.036
  343   HG12  ILE  51          HG13      ILE  51  -0.889   4.037  10.627
  344   HG13  ILE  51          HG12      ILE  51  -0.316   3.605   9.017
  345   HG21  ILE  51          HG21      ILE  51  -0.621   6.783  10.601
  346   HG22  ILE  51          HG22      ILE  51   0.998   6.868  11.296
  347   HG23  ILE  51          HG23      ILE  51  -0.132   5.628  11.839
  348   HD11  ILE  51          HD11      ILE  51   1.381   3.276  11.498
  349   HD12  ILE  51          HD12      ILE  51   1.673   2.600   9.895
  350   HD13  ILE  51          HD13      ILE  51   0.340   1.995  10.879
  351    H    ALA  52           H        ALA  52  -0.601   8.191   8.563
  352    HA   ALA  52           HA       ALA  52   1.663   9.793   9.216
  353    HB1  ALA  52           HB1      ALA  52   1.930   8.856   6.660
  354    HB2  ALA  52           HB2      ALA  52   2.615  10.377   7.228
  355    HB3  ALA  52           HB3      ALA  52   1.070  10.368   6.379
  356    H    LEU  53           H        LEU  53  -1.306   9.701   7.258
  357    HA   LEU  53           HA       LEU  53  -2.191  12.173   8.686
  358    HB2  LEU  53           HB3      LEU  53  -1.430  12.687   6.348
  359    HB3  LEU  53           HB2      LEU  53  -2.675  11.592   5.750
  360    HG   LEU  53           HG       LEU  53  -4.163  13.140   7.414
  361   HD11  LEU  53          HD11      LEU  53  -3.448  15.367   7.469
  362   HD12  LEU  53          HD12      LEU  53  -2.335  15.146   6.119
  363   HD13  LEU  53          HD13      LEU  53  -1.936  14.493   7.708
  364   HD21  LEU  53          HD21      LEU  53  -4.921  14.288   5.389
  365   HD22  LEU  53          HD22      LEU  53  -4.585  12.599   5.013
  366   HD23  LEU  53          HD23      LEU  53  -3.430  13.850   4.555
  367    HA   PRO  54           HA       PRO  54  -5.210   8.615   9.065
  368    HB2  PRO  54           HB2      PRO  54  -5.586   9.864  11.718
  369    HB3  PRO  54           HB3      PRO  54  -5.271   8.171  11.302
  370    HG2  PRO  54           HG3      PRO  54  -3.418   9.746  12.436
  371    HG3  PRO  54           HG2      PRO  54  -3.008   8.449  11.301
  372    HD2  PRO  54           HD3      PRO  54  -3.061  11.404  10.847
  373    HD3  PRO  54           HD2      PRO  54  -1.995  10.170  10.141
  374    H    ASP  55           H        ASP  55  -7.574   8.754   9.586
  375    HA   ASP  55           HA       ASP  55  -9.665   9.744   9.245
  376    HB2  ASP  55           HB3      ASP  55  -8.209  12.111  10.460
  377    HB3  ASP  55           HB2      ASP  55  -9.952  12.024  10.217
  378    H    ASN  56           H        ASN  56  -8.112   9.637   6.945
  379    HA   ASN  56           HA       ASN  56  -9.130  12.015   5.519
  380    HB2  ASN  56           HB3      ASN  56  -6.754  12.507   6.134
  381    HB3  ASN  56           HB2      ASN  56  -6.266  11.068   5.238
  382   HD21  ASN  56          HD22      ASN  56  -8.094  14.136   4.768
  383   HD22  ASN  56          HD21      ASN  56  -7.655  14.318   3.139
  384    H    VAL  57           H        VAL  57  -9.225  11.636   3.164
  385    HA   VAL  57           HA       VAL  57 -10.415   9.342   2.291
  386    HB   VAL  57           HB       VAL  57  -8.287  10.550   0.540
  387   HG11  VAL  57          HG11      VAL  57 -10.124  10.314  -1.139
  388   HG12  VAL  57          HG12      VAL  57 -11.136   9.600   0.116
  389   HG13  VAL  57          HG13      VAL  57  -9.667   8.776  -0.407
  390   HG21  VAL  57          HG21      VAL  57 -10.619  11.890   1.820
  391   HG22  VAL  57          HG22      VAL  57 -10.373  12.202   0.101
  392   HG23  VAL  57          HG23      VAL  57  -9.096  12.579   1.257
  393    HA   PRO  58           HA       PRO  58  -6.830   6.602   2.995
  394    HB2  PRO  58           HB2      PRO  58  -8.191   4.426   3.818
  395    HB3  PRO  58           HB3      PRO  58  -7.934   5.827   4.876
  396    HG2  PRO  58           HG3      PRO  58 -10.373   4.979   3.428
  397    HG3  PRO  58           HG2      PRO  58 -10.207   5.798   4.987
  398    HD2  PRO  58           HD3      PRO  58 -10.817   7.031   2.518
  399    HD3  PRO  58           HD2      PRO  58 -10.347   7.857   4.017
  400    H    ILE  59           H        ILE  59  -9.710   4.825   1.813
  401    HA   ILE  59           HA       ILE  59  -8.090   3.993  -0.553
  402    HB   ILE  59           HB       ILE  59 -10.209   2.388   0.903
  403   HG12  ILE  59          HG13      ILE  59  -7.200   1.997   0.799
  404   HG13  ILE  59          HG12      ILE  59  -8.067   2.689   2.173
  405   HG21  ILE  59          HG21      ILE  59  -8.544   0.791  -0.736
  406   HG22  ILE  59          HG22      ILE  59  -9.016   2.181  -1.714
  407   HG23  ILE  59          HG23      ILE  59 -10.251   1.159  -0.981
  408   HD11  ILE  59          HD11      ILE  59  -9.297   0.203   1.317
  409   HD12  ILE  59          HD12      ILE  59  -8.675   0.647   2.906
  410   HD13  ILE  59          HD13      ILE  59  -7.591  -0.036   1.695
  411    H    ARG  60           H        ARG  60  -9.029   4.353  -2.518
  412    HA   ARG  60           HA       ARG  60 -11.941   4.965  -2.580
  413    HB2  ARG  60           HB3      ARG  60 -10.702   7.088  -2.706
  414    HB3  ARG  60           HB2      ARG  60  -9.735   6.458  -4.036
  415    HG2  ARG  60           HG3      ARG  60 -11.445   7.833  -5.013
  416    HG3  ARG  60           HG2      ARG  60 -11.902   6.164  -5.336
  417    HD2  ARG  60           HD3      ARG  60 -13.521   6.188  -3.541
  418    HD3  ARG  60           HD2      ARG  60 -12.952   7.761  -2.983
  419    HE   ARG  60           HE       ARG  60 -14.809   7.298  -5.158
  420   HH11  ARG  60          HH22      ARG  60 -12.250   9.280  -3.971
  421   HH12  ARG  60          HH21      ARG  60 -12.759  10.689  -4.840
  422   HH21  ARG  60          HH11      ARG  60 -15.490   9.127  -6.299
  423   HH22  ARG  60          HH12      ARG  60 -14.593  10.603  -6.158
  424    H    ILE  61           H        ILE  61 -12.144   2.738  -3.300
  425    HA   ILE  61           HA       ILE  61 -11.347   2.384  -6.163
  426    HB   ILE  61           HB       ILE  61 -11.478   0.235  -4.038
  427   HG12  ILE  61          HG13      ILE  61  -8.988   1.157  -5.458
  428   HG13  ILE  61          HG12      ILE  61  -9.548   2.006  -4.017
  429   HG21  ILE  61          HG21      ILE  61 -12.030  -0.495  -6.359
  430   HG22  ILE  61          HG22      ILE  61 -10.527  -1.204  -5.771
  431   HG23  ILE  61          HG23      ILE  61 -10.481   0.148  -6.902
  432   HD11  ILE  61          HD11      ILE  61  -9.513  -0.098  -2.746
  433   HD12  ILE  61          HD12      ILE  61  -7.927   0.231  -3.443
  434   HD13  ILE  61          HD13      ILE  61  -8.986  -0.967  -4.186
  435    HA   PRO  62           HA       PRO  62 -15.983   2.313  -5.822
  436    HB2  PRO  62           HB2      PRO  62 -15.510   2.587  -8.756
  437    HB3  PRO  62           HB3      PRO  62 -16.651   3.455  -7.712
  438    HG2  PRO  62           HG3      PRO  62 -14.419   4.607  -8.599
  439    HG3  PRO  62           HG2      PRO  62 -15.063   4.941  -6.982
  440    HD2  PRO  62           HD3      PRO  62 -12.693   3.307  -7.761
  441    HD3  PRO  62           HD2      PRO  62 -12.984   4.238  -6.275
  442    H    GLY  63           H        GLY  63 -13.645   0.414  -7.559
  443    HA2  GLY  63           HA3      GLY  63 -14.545  -2.092  -7.188
  444    HA3  GLY  63           HA2      GLY  63 -15.653  -1.554  -8.449
  445    H    LYS  64           H        LYS  64 -12.869   0.118  -8.980
  446    HA   LYS  64           HA       LYS  64 -12.213  -1.248 -11.382
  447    HB2  LYS  64           HB3      LYS  64 -10.489   0.572  -9.675
  448    HB3  LYS  64           HB2      LYS  64 -10.121   0.098 -11.335
  449    HG2  LYS  64           HG3      LYS  64 -12.363   1.054 -12.009
  450    HG3  LYS  64           HG2      LYS  64 -12.503   1.704 -10.374
  451    HD2  LYS  64           HD3      LYS  64 -10.200   2.287 -12.257
  452    HD3  LYS  64           HD2      LYS  64 -11.573   3.362 -11.998
  453    HE2  LYS  64           HE3      LYS  64 -10.931   3.093  -9.458
  454    HE3  LYS  64           HE2      LYS  64  -9.357   2.636 -10.110
  455    HZ1  LYS  64           HZ1      LYS  64  -9.195   4.695 -11.250
  456    HZ2  LYS  64           HZ2      LYS  64  -9.626   5.050  -9.649
  457    HZ3  LYS  64           HZ3      LYS  64 -10.799   5.113 -10.877
  458    H    CYS  65           H        CYS  65 -10.961  -1.606  -8.095
  459    HA   CYS  65           HA       CYS  65  -9.088  -3.712  -9.052
  460    HB2  CYS  65           HB3      CYS  65  -8.781  -1.730  -7.151
  461    HB3  CYS  65           HB2      CYS  65  -9.146  -3.148  -6.170
  462    H    HIS  66           H        HIS  66  -9.560  -5.842  -8.735
  463    HA   HIS  66           HA       HIS  66 -11.990  -6.480  -7.124
  464    HB2  HIS  66           HB3      HIS  66 -10.563  -8.052  -9.292
  465    HB3  HIS  66           HB2      HIS  66 -11.968  -8.632  -8.398
  466    HD1  HIS  66           HD1      HIS  66 -10.941  -6.203 -11.055
  467    HD2  HIS  66           HD2      HIS  66 -14.425  -7.298  -9.039
  468    HE1  HIS  66           HE1      HIS  66 -12.865  -5.146 -12.322
  469    HE2  HIS  66           HE2      HIS  66 -14.990  -5.806 -11.102
  Start of MODEL    5
    1    H1   ALA   1           H1       ALA   1  -3.035  10.950   5.550
    2    H2   ALA   1           H2       ALA   1  -4.350  11.707   4.784
    3    H3   ALA   1           H3       ALA   1  -3.548  10.417   4.024
    4    HA   ALA   1           HA       ALA   1  -5.203  10.278   6.485
    5    HB1  ALA   1           HB1      ALA   1  -5.533   9.007   3.749
    6    HB2  ALA   1           HB2      ALA   1  -6.431  10.412   4.320
    7    HB3  ALA   1           HB3      ALA   1  -6.642   8.850   5.112
    8    H    ARG   2           H        ARG   2  -5.729   7.574   6.296
    9    HA   ARG   2           HA       ARG   2  -3.020   6.313   6.449
   10    HB2  ARG   2           HB3      ARG   2  -3.928   6.776   8.719
   11    HB3  ARG   2           HB2      ARG   2  -5.355   5.819   8.320
   12    HG2  ARG   2           HG3      ARG   2  -3.861   3.858   7.878
   13    HG3  ARG   2           HG2      ARG   2  -2.493   4.823   8.427
   14    HD2  ARG   2           HD3      ARG   2  -3.701   5.170  10.603
   15    HD3  ARG   2           HD2      ARG   2  -4.924   4.029  10.042
   16    HE   ARG   2           HE       ARG   2  -2.195   2.978   9.941
   17   HH11  ARG   2          HH22      ARG   2  -5.079   3.469  11.763
   18   HH12  ARG   2          HH21      ARG   2  -4.783   2.144  12.840
   19   HH21  ARG   2          HH11      ARG   2  -1.790   1.247  11.336
   20   HH22  ARG   2          HH12      ARG   2  -2.921   0.887  12.598
   21    H    ASP   3           H        ASP   3  -2.867   4.382   5.389
   22    HA   ASP   3           HA       ASP   3  -5.402   3.206   4.335
   23    HB2  ASP   3           HB3      ASP   3  -2.580   3.018   3.256
   24    HB3  ASP   3           HB2      ASP   3  -3.986   2.210   2.565
   25    H    ALA   4           H        ALA   4  -5.611   0.889   4.448
   26    HA   ALA   4           HA       ALA   4  -3.998  -0.269   6.646
   27    HB1  ALA   4           HB1      ALA   4  -6.703  -0.841   5.492
   28    HB2  ALA   4           HB2      ALA   4  -6.238  -0.589   7.175
   29    HB3  ALA   4           HB3      ALA   4  -5.856  -2.113   6.374
   30    H    TYR   5           H        TYR   5  -5.505  -1.723   3.749
   31    HA   TYR   5           HA       TYR   5  -3.097  -3.458   3.509
   32    HB2  TYR   5           HB3      TYR   5  -5.647  -3.739   1.925
   33    HB3  TYR   5           HB2      TYR   5  -4.465  -4.983   2.331
   34    HD1  TYR   5           HD1      TYR   5  -4.312  -5.865   4.651
   35    HD2  TYR   5           HD2      TYR   5  -7.352  -3.070   3.474
   36    HE1  TYR   5           HE1      TYR   5  -5.601  -6.407   6.701
   37    HE2  TYR   5           HE2      TYR   5  -8.645  -3.612   5.524
   38    HH   TYR   5           HH       TYR   5  -8.051  -6.297   7.411
   39    H    ILE   6           H        ILE   6  -4.266  -0.613   2.186
   40    HA   ILE   6           HA       ILE   6  -3.050  -1.186  -0.475
   41    HB   ILE   6           HB       ILE   6  -4.879   1.083   0.345
   42   HG12  ILE   6          HG13      ILE   6  -5.471  -1.436  -1.241
   43   HG13  ILE   6          HG12      ILE   6  -5.963  -1.161   0.431
   44   HG21  ILE   6          HG21      ILE   6  -3.231   0.582  -1.970
   45   HG22  ILE   6          HG22      ILE   6  -4.251   1.978  -1.621
   46   HG23  ILE   6          HG23      ILE   6  -4.933   0.568  -2.432
   47   HD11  ILE   6          HD11      ILE   6  -7.748   0.033  -0.241
   48   HD12  ILE   6          HD12      ILE   6  -7.347  -0.381  -1.908
   49   HD13  ILE   6          HD13      ILE   6  -6.716   1.102  -1.191
   50    H    ALA   7           H        ALA   7  -1.314   0.009  -1.182
   51    HA   ALA   7           HA       ALA   7  -0.248   2.069   0.703
   52    HB1  ALA   7           HB1      ALA   7   0.975  -0.256  -0.512
   53    HB2  ALA   7           HB2      ALA   7   1.627   0.820   0.722
   54    HB3  ALA   7           HB3      ALA   7   1.831   1.210  -0.985
   55    H    LYS   8           H        LYS   8  -1.994   2.020  -1.924
   56    HA   LYS   8           HA       LYS   8  -0.446   4.181  -3.278
   57    HB2  LYS   8           HB3      LYS   8  -2.439   2.827  -4.945
   58    HB3  LYS   8           HB2      LYS   8  -0.762   3.220  -5.309
   59    HG2  LYS   8           HG3      LYS   8  -1.646   0.881  -3.587
   60    HG3  LYS   8           HG2      LYS   8  -1.164   0.764  -5.276
   61    HD2  LYS   8           HD3      LYS   8   0.802   2.235  -3.719
   62    HD3  LYS   8           HD2      LYS   8   0.539   0.616  -3.068
   63    HE2  LYS   8           HE3      LYS   8   0.885  -0.338  -5.326
   64    HE3  LYS   8           HE2      LYS   8   1.181   1.282  -5.957
   65    HZ1  LYS   8           HZ1      LYS   8   3.301   0.770  -5.486
   66    HZ2  LYS   8           HZ2      LYS   8   2.890  -0.424  -4.353
   67    HZ3  LYS   8           HZ3      LYS   8   2.875   1.215  -3.902
   68    HA   PRO   9           HA       PRO   9  -3.916   6.798  -2.550
   69    HB2  PRO   9           HB2      PRO   9  -4.035   8.201  -4.939
   70    HB3  PRO   9           HB3      PRO   9  -2.918   8.559  -3.609
   71    HG2  PRO   9           HG3      PRO   9  -2.436   7.097  -6.146
   72    HG3  PRO   9           HG2      PRO   9  -1.362   8.171  -5.234
   73    HD2  PRO   9           HD3      PRO   9  -1.109   5.457  -5.191
   74    HD3  PRO   9           HD2      PRO   9  -0.656   6.485  -3.814
   75    H    HIS  10           H        HIS  10  -3.938   5.123  -5.688
   76    HA   HIS  10           HA       HIS  10  -6.858   4.700  -5.323
   77    HB2  HIS  10           HB3      HIS  10  -5.603   5.477  -7.970
   78    HB3  HIS  10           HB2      HIS  10  -7.319   5.245  -7.638
   79    HD1  HIS  10           HD1      HIS  10  -8.313   6.950  -5.720
   80    HD2  HIS  10           HD2      HIS  10  -4.760   8.086  -7.587
   81    HE1  HIS  10           HE1      HIS  10  -8.033   9.431  -5.284
   82    HE2  HIS  10           HE2      HIS  10  -5.874  10.132  -6.415
   83    H    ASN  11           H        ASN  11  -3.841   3.409  -5.848
   84    HA   ASN  11           HA       ASN  11  -4.951   1.024  -7.272
   85    HB2  ASN  11           HB3      ASN  11  -2.068   1.933  -7.000
   86    HB3  ASN  11           HB2      ASN  11  -2.622   0.518  -7.897
   87   HD21  ASN  11          HD22      ASN  11  -2.276   3.993  -8.009
   88   HD22  ASN  11          HD21      ASN  11  -2.915   4.206  -9.567
   89    H    CYS  12           H        CYS  12  -3.830  -1.075  -6.547
   90    HA   CYS  12           HA       CYS  12  -3.517  -1.028  -3.568
   91    HB2  CYS  12           HB3      CYS  12  -4.334  -3.482  -5.102
   92    HB3  CYS  12           HB2      CYS  12  -4.670  -3.060  -3.424
   93    H    VAL  13           H        VAL  13  -2.352  -3.275  -2.938
   94    HA   VAL  13           HA       VAL  13   0.195  -3.255  -4.479
   95    HB   VAL  13           HB       VAL  13  -0.414  -4.475  -1.767
   96   HG11  VAL  13          HG11      VAL  13   2.332  -3.769  -2.224
   97   HG12  VAL  13          HG12      VAL  13   1.773  -4.772  -3.563
   98   HG13  VAL  13          HG13      VAL  13   1.649  -5.364  -1.906
   99   HG21  VAL  13          HG21      VAL  13   0.086  -1.733  -2.613
  100   HG22  VAL  13          HG22      VAL  13   1.323  -2.295  -1.489
  101   HG23  VAL  13          HG23      VAL  13  -0.378  -2.341  -1.024
  102    H    TYR  14           H        TYR  14   0.841  -5.049  -5.615
  103    HA   TYR  14           HA       TYR  14  -1.066  -7.154  -6.127
  104    HB2  TYR  14           HB3      TYR  14   0.569  -8.043  -7.627
  105    HB3  TYR  14           HB2      TYR  14   0.731  -6.290  -7.721
  106    HD1  TYR  14           HD2      TYR  14   2.575  -5.135  -6.486
  107    HD2  TYR  14           HD1      TYR  14   2.332  -9.415  -6.750
  108    HE1  TYR  14           HE2      TYR  14   4.951  -5.311  -5.797
  109    HE2  TYR  14           HE1      TYR  14   4.709  -9.591  -6.062
  110    HH   TYR  14           HH       TYR  14   6.735  -6.727  -5.701
  111    H    GLU  15           H        GLU  15   1.962  -7.009  -4.262
  112    HA   GLU  15           HA       GLU  15   1.079  -8.967  -2.363
  113    HB2  GLU  15           HB3      GLU  15   1.487 -10.445  -4.389
  114    HB3  GLU  15           HB2      GLU  15   3.186  -9.983  -4.288
  115    HG2  GLU  15           HG3      GLU  15   3.246 -10.823  -1.945
  116    HG3  GLU  15           HG2      GLU  15   1.579 -11.372  -2.127
  117    H    CYS  16           H        CYS  16   1.997  -7.610  -0.803
  118    HA   CYS  16           HA       CYS  16   4.631  -6.464  -1.100
  119    HB2  CYS  16           HB3      CYS  16   3.539  -5.252   0.502
  120    HB3  CYS  16           HB2      CYS  16   2.590  -6.633   1.050
  121    H    PHE  17           H        PHE  17   6.274  -7.935  -1.396
  122    HA   PHE  17           HA       PHE  17   6.500 -10.538  -0.459
  123    HB2  PHE  17           HB3      PHE  17   8.278 -10.005  -1.816
  124    HB3  PHE  17           HB2      PHE  17   8.449  -8.390  -1.134
  125    HD1  PHE  17           HD2      PHE  17   9.155 -11.990  -0.583
  126    HD2  PHE  17           HD1      PHE  17   9.891  -7.971   0.739
  127    HE1  PHE  17           HE2      PHE  17  11.002 -12.803   0.860
  128    HE2  PHE  17           HE1      PHE  17  11.737  -8.782   2.182
  129    HZ   PHE  17           HZ       PHE  17  12.294 -11.199   2.242
  130    H    ASP  18           H        ASP  18   7.403 -11.476   1.477
  131    HA   ASP  18           HA       ASP  18   6.686 -10.046   3.885
  132    HB2  ASP  18           HB3      ASP  18   6.544 -12.530   3.635
  133    HB3  ASP  18           HB2      ASP  18   8.308 -12.594   3.622
  134    H    ALA  19           H        ALA  19   7.912  -8.454   4.730
  135    HA   ALA  19           HA       ALA  19  10.827  -8.903   5.014
  136    HB1  ALA  19           HB1      ALA  19  10.107  -6.148   4.213
  137    HB2  ALA  19           HB2      ALA  19   9.952  -7.357   2.939
  138    HB3  ALA  19           HB3      ALA  19  11.500  -7.126   3.750
  139    H    PHE  20           H        PHE  20  11.719  -7.715   6.794
  140    HA   PHE  20           HA       PHE  20   9.963  -7.260   8.984
  141    HB2  PHE  20           HB3      PHE  20  12.771  -6.227   8.482
  142    HB3  PHE  20           HB2      PHE  20  11.934  -6.116  10.032
  143    HD1  PHE  20           HD2      PHE  20  11.300  -8.187  11.268
  144    HD2  PHE  20           HD1      PHE  20  13.690  -8.308   7.701
  145    HE1  PHE  20           HE2      PHE  20  11.994 -10.505  11.812
  146    HE2  PHE  20           HE1      PHE  20  14.384 -10.626   8.245
  147    HZ   PHE  20           HZ       PHE  20  13.535 -11.725  10.300
  148    H    SER  21           H        SER  21  11.380  -5.014   6.626
  149    HA   SER  21           HA       SER  21   9.250  -3.204   6.570
  150    HB2  SER  21           HB3      SER  21  10.981  -2.925   8.935
  151    HB3  SER  21           HB2      SER  21  10.736  -1.427   8.043
  152    HG   SER  21           HG       SER  21   9.127  -2.165   9.745
  153    H    SER  22           H        SER  22  10.291  -3.508   4.395
  154    HA   SER  22           HA       SER  22  12.150  -1.291   3.878
  155    HB2  SER  22           HB3      SER  22  13.030  -4.060   4.012
  156    HB3  SER  22           HB2      SER  22  13.319  -3.370   2.418
  157    HG   SER  22           HG       SER  22  14.767  -2.082   3.252
  158    H    TYR  23           H        TYR  23  11.119  -4.249   2.126
  159    HA   TYR  23           HA       TYR  23  10.767  -2.951  -0.368
  160    HB2  TYR  23           HB3      TYR  23  10.856  -5.408  -0.104
  161    HB3  TYR  23           HB2      TYR  23   9.286  -5.370   0.700
  162    HD1  TYR  23           HD2      TYR  23  11.057  -4.943  -2.504
  163    HD2  TYR  23           HD1      TYR  23   7.241  -4.898  -0.532
  164    HE1  TYR  23           HE2      TYR  23   9.918  -4.996  -4.708
  165    HE2  TYR  23           HE1      TYR  23   6.102  -4.953  -2.736
  166    HH   TYR  23           HH       TYR  23   6.598  -5.656  -5.044
  167    H    CYS  24           H        CYS  24   8.301  -3.753   2.092
  168    HA   CYS  24           HA       CYS  24   6.182  -2.396   0.683
  169    HB2  CYS  24           HB3      CYS  24   5.689  -4.113   2.353
  170    HB3  CYS  24           HB2      CYS  24   6.435  -3.131   3.614
  171    H    ASN  25           H        ASN  25   8.307  -1.461   3.376
  172    HA   ASN  25           HA       ASN  25   7.178   1.104   3.844
  173    HB2  ASN  25           HB3      ASN  25  10.073   0.237   4.115
  174    HB3  ASN  25           HB2      ASN  25   9.355   1.665   4.862
  175   HD21  ASN  25          HD22      ASN  25   7.140  -0.946   4.704
  176   HD22  ASN  25          HD21      ASN  25   7.308  -1.488   6.304
  177    H    GLY  26           H        GLY  26   9.636   0.016   1.534
  178    HA2  GLY  26           HA3      GLY  26  10.357   2.606   0.555
  179    HA3  GLY  26           HA2      GLY  26  10.536   1.099  -0.347
  180    H    VAL  27           H        VAL  27   7.870   0.275  -0.484
  181    HA   VAL  27           HA       VAL  27   6.894   1.859  -2.671
  182    HB   VAL  27           HB       VAL  27   5.521  -0.249  -0.979
  183   HG11  VAL  27          HG11      VAL  27   3.958  -0.397  -2.934
  184   HG12  VAL  27          HG12      VAL  27   4.715   1.052  -3.596
  185   HG13  VAL  27          HG13      VAL  27   3.843   1.133  -2.066
  186   HG21  VAL  27          HG21      VAL  27   6.863  -1.645  -2.140
  187   HG22  VAL  27          HG22      VAL  27   7.491  -0.314  -3.111
  188   HG23  VAL  27          HG23      VAL  27   6.014  -1.143  -3.601
  189    H    CYS  28           H        CYS  28   5.954   1.603   0.740
  190    HA   CYS  28           HA       CYS  28   3.706   3.356   0.626
  191    HB2  CYS  28           HB3      CYS  28   4.304   1.859   2.558
  192    HB3  CYS  28           HB2      CYS  28   5.607   2.977   2.958
  193    H    THR  29           H        THR  29   7.167   3.973   0.958
  194    HA   THR  29           HA       THR  29   7.095   6.681   1.746
  195    HB   THR  29           HB       THR  29   9.033   5.442  -0.227
  196    HG1  THR  29           HG1      THR  29   8.684   5.223   2.526
  197   HG21  THR  29          HG21      THR  29   9.141   7.909  -0.025
  198   HG22  THR  29          HG22      THR  29  10.583   7.137   0.638
  199   HG23  THR  29          HG23      THR  29   9.330   7.746   1.721
  200    H    LYS  30           H        LYS  30   6.845   5.282  -1.519
  201    HA   LYS  30           HA       LYS  30   6.785   7.750  -2.943
  202    HB2  LYS  30           HB3      LYS  30   5.602   5.029  -3.522
  203    HB3  LYS  30           HB2      LYS  30   5.416   6.379  -4.640
  204    HG2  LYS  30           HG3      LYS  30   7.355   5.203  -5.377
  205    HG3  LYS  30           HG2      LYS  30   7.959   6.631  -4.540
  206    HD2  LYS  30           HD3      LYS  30   8.505   5.376  -2.584
  207    HD3  LYS  30           HD2      LYS  30   7.596   3.973  -3.148
  208    HE2  LYS  30           HE3      LYS  30   9.355   3.211  -4.333
  209    HE3  LYS  30           HE2      LYS  30   9.603   4.785  -5.089
  210    HZ1  LYS  30           HZ1      LYS  30  11.319   3.704  -3.381
  211    HZ2  LYS  30           HZ2      LYS  30  10.354   4.573  -2.290
  212    HZ3  LYS  30           HZ3      LYS  30  11.130   5.382  -3.567
  213    H    ASN  31           H        ASN  31   4.256   5.919  -1.295
  214    HA   ASN  31           HA       ASN  31   1.998   7.382  -2.196
  215    HB2  ASN  31           HB3      ASN  31   2.030   5.266  -0.751
  216    HB3  ASN  31           HB2      ASN  31   2.337   6.332   0.622
  217   HD21  ASN  31          HD22      ASN  31   0.463   6.995   1.669
  218   HD22  ASN  31          HD21      ASN  31  -1.063   7.146   0.942
  219    H    GLY  32           H        GLY  32   4.474   8.142   0.162
  220    HA2  GLY  32           HA3      GLY  32   4.982  10.472   0.693
  221    HA3  GLY  32           HA2      GLY  32   3.278  10.858   0.441
  222    H    ALA  33           H        ALA  33   3.218   8.005   2.021
  223    HA   ALA  33           HA       ALA  33   2.347   9.169   4.506
  224    HB1  ALA  33           HB1      ALA  33   2.053   6.712   3.298
  225    HB2  ALA  33           HB2      ALA  33   1.608   7.071   4.966
  226    HB3  ALA  33           HB3      ALA  33   3.176   6.347   4.608
  227    H    LYS  34           H        LYS  34   3.425   9.205   6.526
  228    HA   LYS  34           HA       LYS  34   6.212   9.722   6.516
  229    HB2  LYS  34           HB3      LYS  34   4.622  10.412   8.318
  230    HB3  LYS  34           HB2      LYS  34   4.537   8.732   8.843
  231    HG2  LYS  34           HG3      LYS  34   7.266   9.189   8.714
  232    HG3  LYS  34           HG2      LYS  34   6.635  10.725   9.311
  233    HD2  LYS  34           HD3      LYS  34   6.044   7.991  10.483
  234    HD3  LYS  34           HD2      LYS  34   7.106   9.212  11.190
  235    HE2  LYS  34           HE3      LYS  34   4.884  10.707  10.868
  236    HE3  LYS  34           HE2      LYS  34   4.134   9.124  11.075
  237    HZ1  LYS  34           HZ1      LYS  34   6.259  10.010  12.913
  238    HZ2  LYS  34           HZ2      LYS  34   5.022   8.879  13.174
  239    HZ3  LYS  34           HZ3      LYS  34   4.660  10.539  13.141
  240    H    SER  35           H        SER  35   4.503   6.800   7.686
  241    HA   SER  35           HA       SER  35   6.850   5.187   6.869
  242    HB2  SER  35           HB3      SER  35   7.026   4.088   9.018
  243    HB3  SER  35           HB2      SER  35   7.126   5.825   9.296
  244    HG   SER  35           HG       SER  35   5.544   5.422  10.634
  245    H    GLY  36           H        GLY  36   6.293   2.844   6.803
  246    HA2  GLY  36           HA3      GLY  36   3.387   2.286   6.897
  247    HA3  GLY  36           HA2      GLY  36   4.217   2.018   5.366
  248    H    TYR  37           H        TYR  37   2.894   0.066   7.153
  249    HA   TYR  37           HA       TYR  37   5.244  -1.727   7.628
  250    HB2  TYR  37           HB3      TYR  37   2.655  -1.648   9.211
  251    HB3  TYR  37           HB2      TYR  37   4.013  -2.735   9.498
  252    HD1  TYR  37           HD2      TYR  37   6.289  -1.710  10.067
  253    HD2  TYR  37           HD1      TYR  37   2.619   0.518  10.152
  254    HE1  TYR  37           HE2      TYR  37   7.367   0.010  11.493
  255    HE2  TYR  37           HE1      TYR  37   3.694   2.237  11.577
  256    HH   TYR  37           HH       TYR  37   5.849   2.101  13.311
  257    H    CYS  38           H        CYS  38   4.855  -3.971   7.077
  258    HA   CYS  38           HA       CYS  38   2.632  -4.277   5.138
  259    HB2  CYS  38           HB3      CYS  38   4.954  -4.768   4.394
  260    HB3  CYS  38           HB2      CYS  38   5.027  -6.068   5.581
  261    H    GLN  39           H        GLN  39   0.873  -5.378   5.730
  262    HA   GLN  39           HA       GLN  39   1.127  -7.402   7.918
  263    HB2  GLN  39           HB3      GLN  39  -1.197  -5.565   7.273
  264    HB3  GLN  39           HB2      GLN  39  -1.254  -6.868   8.461
  265    HG2  GLN  39           HG3      GLN  39   0.628  -5.810   9.685
  266    HG3  GLN  39           HG2      GLN  39   0.620  -4.485   8.520
  267   HE21  GLN  39          HE22      GLN  39  -0.146  -4.710  11.543
  268   HE22  GLN  39          HE21      GLN  39  -1.655  -3.937  11.616
  269    H    ILE  40           H        ILE  40  -1.360  -8.589   7.657
  270    HA   ILE  40           HA       ILE  40  -1.214  -9.699   4.883
  271    HB   ILE  40           HB       ILE  40  -1.855 -11.833   5.771
  272   HG12  ILE  40          HG13      ILE  40  -2.241 -10.378   8.410
  273   HG13  ILE  40          HG12      ILE  40  -3.519 -11.075   7.415
  274   HG21  ILE  40          HG21      ILE  40   0.123 -10.590   7.703
  275   HG22  ILE  40          HG22      ILE  40   0.528 -11.129   6.073
  276   HG23  ILE  40          HG23      ILE  40  -0.004 -12.298   7.283
  277   HD11  ILE  40          HD11      ILE  40  -1.542 -12.432   9.172
  278   HD12  ILE  40          HD12      ILE  40  -1.952 -13.246   7.663
  279   HD13  ILE  40          HD13      ILE  40  -3.218 -12.855   8.825
  280    H    LEU  41           H        LEU  41  -3.249 -10.352   3.928
  281    HA   LEU  41           HA       LEU  41  -5.356  -8.469   4.244
  282    HB2  LEU  41           HB3      LEU  41  -4.992 -11.045   2.798
  283    HB3  LEU  41           HB2      LEU  41  -6.651 -10.513   3.063
  284    HG   LEU  41           HG       LEU  41  -5.581  -9.715   0.900
  285   HD11  LEU  41          HD11      LEU  41  -7.250  -8.219   1.088
  286   HD12  LEU  41          HD12      LEU  41  -6.151  -7.152   1.962
  287   HD13  LEU  41          HD13      LEU  41  -7.161  -8.297   2.847
  288   HD21  LEU  41          HD21      LEU  41  -4.200  -7.600   2.493
  289   HD22  LEU  41          HD22      LEU  41  -3.804  -8.248   0.903
  290   HD23  LEU  41          HD23      LEU  41  -3.405  -9.166   2.352
  291    H    GLY  42           H        GLY  42  -4.622 -11.419   5.910
  292    HA2  GLY  42           HA3      GLY  42  -5.624 -11.887   8.090
  293    HA3  GLY  42           HA2      GLY  42  -7.091 -11.067   7.544
  294    H    THR  43           H        THR  43  -6.030 -12.773   4.970
  295    HA   THR  43           HA       THR  43  -7.084 -15.410   5.711
  296    HB   THR  43           HB       THR  43  -8.743 -15.265   3.746
  297    HG1  THR  43           HG1      THR  43  -8.200 -12.530   4.242
  298   HG21  THR  43          HG21      THR  43 -10.493 -14.441   5.170
  299   HG22  THR  43          HG22      THR  43  -9.350 -13.484   6.115
  300   HG23  THR  43          HG23      THR  43  -9.319 -15.246   6.212
  301    H    TYR  44           H        TYR  44  -7.045 -13.860   2.530
  302    HA   TYR  44           HA       TYR  44  -4.669 -15.538   1.822
  303    HB2  TYR  44           HB3      TYR  44  -7.061 -14.896   0.070
  304    HB3  TYR  44           HB2      TYR  44  -5.651 -15.838  -0.414
  305    HD1  TYR  44           HD2      TYR  44  -5.149 -18.013   0.762
  306    HD2  TYR  44           HD1      TYR  44  -8.828 -15.873   1.339
  307    HE1  TYR  44           HE2      TYR  44  -6.190 -20.056   1.706
  308    HE2  TYR  44           HE1      TYR  44  -9.869 -17.916   2.284
  309    HH   TYR  44           HH       TYR  44  -9.473 -19.994   3.045
  310    H    GLY  45           H        GLY  45  -3.098 -14.510   0.566
  311    HA2  GLY  45           HA3      GLY  45  -2.212 -12.776  -0.828
  312    HA3  GLY  45           HA2      GLY  45  -3.681 -11.840  -0.560
  313    H    ASN  46           H        ASN  46  -1.696 -10.255  -0.293
  314    HA   ASN  46           HA       ASN  46  -1.289  -9.931   2.626
  315    HB2  ASN  46           HB3      ASN  46   0.750 -11.010   1.584
  316    HB3  ASN  46           HB2      ASN  46   0.940  -9.550   0.613
  317   HD21  ASN  46          HD22      ASN  46   0.705 -10.619   4.041
  318   HD22  ASN  46          HD21      ASN  46   1.654  -9.354   4.656
  319    H    GLY  47           H        GLY  47  -0.713  -7.624   3.158
  320    HA2  GLY  47           HA3      GLY  47  -1.327  -5.720   0.948
  321    HA3  GLY  47           HA2      GLY  47  -2.283  -5.637   2.425
  322    H    CYS  48           H        CYS  48  -0.775  -3.451   1.556
  323    HA   CYS  48           HA       CYS  48   1.556  -3.407   3.398
  324    HB2  CYS  48           HB3      CYS  48   0.943  -2.099   0.828
  325    HB3  CYS  48           HB2      CYS  48   1.685  -1.045   2.030
  326    H    TRP  49           H        TRP  49   1.751  -1.582   4.864
  327    HA   TRP  49           HA       TRP  49  -0.870  -0.271   5.454
  328    HB2  TRP  49           HB3      TRP  49   0.298  -1.984   7.102
  329    HB3  TRP  49           HB2      TRP  49   1.285  -0.583   7.515
  330    HD1  TRP  49           HD1      TRP  49   0.116   1.436   8.741
  331    HE1  TRP  49           HE1      TRP  49  -2.143   1.655   9.962
  332    HE3  TRP  49           HE3      TRP  49  -2.187  -2.808   7.091
  333    HZ2  TRP  49           HZ2      TRP  49  -4.609   0.216  10.203
  334    HZ3  TRP  49           HZ3      TRP  49  -4.486  -3.362   7.826
  335    HH2  TRP  49           HH2      TRP  49  -5.700  -1.858   9.381
  336    H    CYS  50           H        CYS  50  -0.860   1.980   5.631
  337    HA   CYS  50           HA       CYS  50   1.813   3.326   5.616
  338    HB2  CYS  50           HB3      CYS  50  -0.513   3.793   3.756
  339    HB3  CYS  50           HB2      CYS  50   0.673   5.058   4.071
  340    H    ILE  51           H        ILE  51   1.954   5.018   7.018
  341    HA   ILE  51           HA       ILE  51  -0.577   6.017   8.244
  342    HB   ILE  51           HB       ILE  51   2.099   5.604   9.600
  343   HG12  ILE  51          HG13      ILE  51  -0.290   4.192  10.584
  344   HG13  ILE  51          HG12      ILE  51   0.202   3.703   8.963
  345   HG21  ILE  51          HG21      ILE  51  -0.187   7.239  10.240
  346   HG22  ILE  51          HG22      ILE  51   1.318   7.050  11.139
  347   HG23  ILE  51          HG23      ILE  51  -0.031   5.953  11.437
  348   HD11  ILE  51          HD11      ILE  51   2.329   3.001   9.682
  349   HD12  ILE  51          HD12      ILE  51   1.271   2.478  10.993
  350   HD13  ILE  51          HD13      ILE  51   2.236   3.945  11.170
  351    H    ALA  52           H        ALA  52  -0.806   8.213   8.322
  352    HA   ALA  52           HA       ALA  52   1.515   9.992   8.161
  353    HB1  ALA  52           HB1      ALA  52   1.384  10.614   5.987
  354    HB2  ALA  52           HB2      ALA  52  -0.378  10.685   6.036
  355    HB3  ALA  52           HB3      ALA  52   0.435   9.146   5.752
  356    H    LEU  53           H        LEU  53  -1.991  10.028   7.478
  357    HA   LEU  53           HA       LEU  53  -2.272  12.123   9.594
  358    HB2  LEU  53           HB3      LEU  53  -2.469  13.121   7.330
  359    HB3  LEU  53           HB2      LEU  53  -3.767  11.990   6.958
  360    HG   LEU  53           HG       LEU  53  -4.508  13.146   9.407
  361   HD11  LEU  53          HD11      LEU  53  -2.763  14.878   8.974
  362   HD12  LEU  53          HD12      LEU  53  -4.395  15.549   8.986
  363   HD13  LEU  53          HD13      LEU  53  -3.567  15.269   7.453
  364   HD21  LEU  53          HD21      LEU  53  -5.936  12.489   7.442
  365   HD22  LEU  53          HD22      LEU  53  -5.393  13.951   6.619
  366   HD23  LEU  53          HD23      LEU  53  -6.337  14.074   8.102
  367    HA   PRO  54           HA       PRO  54  -4.734   8.297  10.629
  368    HB2  PRO  54           HB2      PRO  54  -4.508   9.719  13.241
  369    HB3  PRO  54           HB3      PRO  54  -4.294   7.999  12.869
  370    HG2  PRO  54           HG3      PRO  54  -2.213   9.598  13.335
  371    HG3  PRO  54           HG2      PRO  54  -2.136   8.281  12.152
  372    HD2  PRO  54           HD3      PRO  54  -2.309  11.219  11.684
  373    HD3  PRO  54           HD2      PRO  54  -1.564   9.957  10.677
  374    H    ASP  55           H        ASP  55  -6.802   8.305  12.150
  375    HA   ASP  55           HA       ASP  55  -9.022   9.014  12.369
  376    HB2  ASP  55           HB3      ASP  55  -7.639  11.715  12.452
  377    HB3  ASP  55           HB2      ASP  55  -9.332  11.443  12.863
  378    H    ASN  56           H        ASN  56  -8.191   8.474   9.748
  379    HA   ASN  56           HA       ASN  56 -10.046  10.227   8.266
  380    HB2  ASN  56           HB3      ASN  56  -7.661  11.132   8.047
  381    HB3  ASN  56           HB2      ASN  56  -7.295   9.656   7.152
  382   HD21  ASN  56          HD22      ASN  56 -10.470  10.163   6.456
  383   HD22  ASN  56          HD21      ASN  56 -10.322  11.118   5.061
  384    H    VAL  57           H        VAL  57 -11.420   8.805   7.314
  385    HA   VAL  57           HA       VAL  57 -10.276   6.263   6.237
  386    HB   VAL  57           HB       VAL  57 -11.682   5.913   8.271
  387   HG11  VAL  57          HG11      VAL  57 -14.190   6.459   6.845
  388   HG12  VAL  57          HG12      VAL  57 -13.247   7.911   7.179
  389   HG13  VAL  57          HG13      VAL  57 -13.733   6.851   8.502
  390   HG21  VAL  57          HG21      VAL  57 -13.110   4.899   5.804
  391   HG22  VAL  57          HG22      VAL  57 -12.915   4.088   7.357
  392   HG23  VAL  57          HG23      VAL  57 -11.528   4.288   6.288
  393    HA   PRO  58           HA       PRO  58 -12.467   8.587   2.869
  394    HB2  PRO  58           HB2      PRO  58 -10.411   8.683   1.102
  395    HB3  PRO  58           HB3      PRO  58 -10.597   9.871   2.407
  396    HG2  PRO  58           HG3      PRO  58  -8.763   7.545   2.213
  397    HG3  PRO  58           HG2      PRO  58  -8.498   9.139   2.936
  398    HD2  PRO  58           HD3      PRO  58  -9.109   6.830   4.369
  399    HD3  PRO  58           HD2      PRO  58  -9.332   8.487   4.967
  400    H    ILE  59           H        ILE  59  -9.937   6.218   1.946
  401    HA   ILE  59           HA       ILE  59 -10.071   4.486   0.347
  402    HB   ILE  59           HB       ILE  59 -12.415   3.975   2.194
  403   HG12  ILE  59          HG13      ILE  59  -9.672   2.694   2.030
  404   HG13  ILE  59          HG12      ILE  59 -10.070   4.017   3.127
  405   HG21  ILE  59          HG21      ILE  59 -11.520   2.580  -0.241
  406   HG22  ILE  59          HG22      ILE  59 -13.049   2.453   0.630
  407   HG23  ILE  59          HG23      ILE  59 -11.645   1.536   1.175
  408   HD11  ILE  59          HD11      ILE  59 -11.281   2.672   4.515
  409   HD12  ILE  59          HD12      ILE  59 -10.332   1.382   3.777
  410   HD13  ILE  59          HD13      ILE  59 -11.953   1.736   3.179
  411    H    ARG  60           H        ARG  60 -10.809   6.459  -1.135
  412    HA   ARG  60           HA       ARG  60 -13.466   6.809  -1.996
  413    HB2  ARG  60           HB3      ARG  60 -10.995   6.675  -3.758
  414    HB3  ARG  60           HB2      ARG  60 -12.508   7.494  -4.146
  415    HG2  ARG  60           HG3      ARG  60 -12.186   9.100  -2.391
  416    HG3  ARG  60           HG2      ARG  60 -10.824   8.190  -1.731
  417    HD2  ARG  60           HD3      ARG  60  -9.877   9.989  -3.002
  418    HD3  ARG  60           HD2      ARG  60  -9.665   8.524  -3.962
  419    HE   ARG  60           HE       ARG  60 -11.167   9.413  -5.558
  420   HH11  ARG  60          HH22      ARG  60 -11.286  11.099  -2.554
  421   HH12  ARG  60          HH21      ARG  60 -12.308  12.363  -3.151
  422   HH21  ARG  60          HH11      ARG  60 -12.503  11.053  -6.356
  423   HH22  ARG  60          HH12      ARG  60 -12.997  12.337  -5.303
  424    H    ILE  61           H        ILE  61 -11.136   4.290  -2.680
  425    HA   ILE  61           HA       ILE  61 -12.529   2.939  -4.766
  426    HB   ILE  61           HB       ILE  61 -10.443   2.230  -2.751
  427   HG12  ILE  61          HG13      ILE  61  -9.057   1.968  -4.699
  428   HG13  ILE  61          HG12      ILE  61 -10.458   2.007  -5.769
  429   HG21  ILE  61          HG21      ILE  61 -12.093   0.314  -4.352
  430   HG22  ILE  61          HG22      ILE  61 -11.421   0.130  -2.734
  431   HG23  ILE  61          HG23      ILE  61 -10.375  -0.019  -4.145
  432   HD11  ILE  61          HD11      ILE  61  -9.073   4.181  -5.528
  433   HD12  ILE  61          HD12      ILE  61  -9.825   4.321  -3.940
  434   HD13  ILE  61          HD13      ILE  61 -10.825   4.314  -5.392
  435    HA   PRO  62           HA       PRO  62 -15.786   1.310  -2.105
  436    HB2  PRO  62           HB2      PRO  62 -17.106  -0.166  -3.950
  437    HB3  PRO  62           HB3      PRO  62 -17.184   1.605  -3.915
  438    HG2  PRO  62           HG3      PRO  62 -15.583  -0.182  -5.675
  439    HG3  PRO  62           HG2      PRO  62 -16.447   1.314  -6.070
  440    HD2  PRO  62           HD3      PRO  62 -13.729   1.195  -5.642
  441    HD3  PRO  62           HD2      PRO  62 -14.706   2.657  -5.388
  442    H    GLY  63           H        GLY  63 -13.121  -0.105  -2.386
  443    HA2  GLY  63           HA3      GLY  63 -12.512  -2.128  -1.212
  444    HA3  GLY  63           HA2      GLY  63 -14.105  -2.785  -1.585
  445    H    LYS  64           H        LYS  64 -12.982  -1.296  -4.332
  446    HA   LYS  64           HA       LYS  64 -11.692  -3.794  -5.329
  447    HB2  LYS  64           HB3      LYS  64 -13.688  -2.026  -6.774
  448    HB3  LYS  64           HB2      LYS  64 -12.825  -3.379  -7.505
  449    HG2  LYS  64           HG3      LYS  64 -13.837  -4.922  -5.876
  450    HG3  LYS  64           HG2      LYS  64 -14.686  -3.573  -5.119
  451    HD2  LYS  64           HD3      LYS  64 -16.212  -4.699  -6.645
  452    HD3  LYS  64           HD2      LYS  64 -15.811  -3.114  -7.307
  453    HE2  LYS  64           HE3      LYS  64 -13.967  -5.264  -8.125
  454    HE3  LYS  64           HE2      LYS  64 -15.620  -5.470  -8.701
  455    HZ1  LYS  64           HZ1      LYS  64 -14.295  -4.164 -10.244
  456    HZ2  LYS  64           HZ2      LYS  64 -13.970  -3.023  -9.032
  457    HZ3  LYS  64           HZ3      LYS  64 -15.559  -3.233  -9.595
  458    H    CYS  65           H        CYS  65  -9.819  -3.452  -6.481
  459    HA   CYS  65           HA       CYS  65  -8.496  -0.936  -6.354
  460    HB2  CYS  65           HB3      CYS  65  -8.006  -3.263  -8.234
  461    HB3  CYS  65           HB2      CYS  65  -6.877  -1.941  -7.934
  462    H    HIS  66           H        HIS  66 -10.696  -2.285  -8.717
  463    HA   HIS  66           HA       HIS  66 -10.181   0.035 -10.524
  464    HB2  HIS  66           HB3      HIS  66 -11.765  -2.500 -11.043
  465    HB3  HIS  66           HB2      HIS  66 -11.387  -1.249 -12.227
  466    HD1  HIS  66           HD1      HIS  66  -8.676  -0.820 -12.536
  467    HD2  HIS  66           HD2      HIS  66  -9.838  -4.483 -10.914
  468    HE1  HIS  66           HE1      HIS  66  -6.691  -2.378 -12.783
  469    HE2  HIS  66           HE2      HIS  66  -7.388  -4.609 -11.799
  Start of MODEL    6
    1    H1   ALA   1           H1       ALA   1  -6.244   9.846   1.941
    2    H2   ALA   1           H2       ALA   1  -5.142   8.561   2.083
    3    H3   ALA   1           H3       ALA   1  -4.616  10.162   2.297
    4    HA   ALA   1           HA       ALA   1  -5.507  10.356   4.374
    5    HB1  ALA   1           HB1      ALA   1  -7.355   8.049   3.693
    6    HB2  ALA   1           HB2      ALA   1  -7.798   9.753   3.587
    7    HB3  ALA   1           HB3      ALA   1  -7.411   9.038   5.152
    8    H    ARG   2           H        ARG   2  -6.360   7.107   4.795
    9    HA   ARG   2           HA       ARG   2  -3.544   6.388   5.512
   10    HB2  ARG   2           HB3      ARG   2  -4.940   6.900   7.520
   11    HB3  ARG   2           HB2      ARG   2  -6.058   5.626   7.030
   12    HG2  ARG   2           HG3      ARG   2  -4.169   3.994   7.108
   13    HG3  ARG   2           HG2      ARG   2  -3.129   5.279   7.723
   14    HD2  ARG   2           HD3      ARG   2  -5.670   4.294   9.053
   15    HD3  ARG   2           HD2      ARG   2  -4.029   3.906   9.569
   16    HE   ARG   2           HE       ARG   2  -3.973   6.625   9.630
   17   HH11  ARG   2          HH22      ARG   2  -6.259   4.283  10.718
   18   HH12  ARG   2          HH21      ARG   2  -6.829   5.256  12.032
   19   HH21  ARG   2          HH11      ARG   2  -4.706   7.908  11.340
   20   HH22  ARG   2          HH12      ARG   2  -5.949   7.308  12.385
   21    H    ASP   3           H        ASP   3  -2.884   4.427   4.691
   22    HA   ASP   3           HA       ASP   3  -4.907   2.850   3.199
   23    HB2  ASP   3           HB3      ASP   3  -1.880   2.706   3.205
   24    HB3  ASP   3           HB2      ASP   3  -2.937   1.714   2.205
   25    H    ALA   4           H        ALA   4  -5.460   0.779   3.816
   26    HA   ALA   4           HA       ALA   4  -4.281  -0.175   6.371
   27    HB1  ALA   4           HB1      ALA   4  -6.950  -0.331   5.119
   28    HB2  ALA   4           HB2      ALA   4  -6.507  -0.291   6.826
   29    HB3  ALA   4           HB3      ALA   4  -6.420  -1.806   5.928
   30    H    TYR   5           H        TYR   5  -5.538  -1.635   3.354
   31    HA   TYR   5           HA       TYR   5  -3.470  -3.776   3.677
   32    HB2  TYR   5           HB3      TYR   5  -5.983  -3.922   2.001
   33    HB3  TYR   5           HB2      TYR   5  -4.958  -5.256   2.535
   34    HD1  TYR   5           HD1      TYR   5  -4.982  -6.011   4.879
   35    HD2  TYR   5           HD2      TYR   5  -7.557  -2.853   3.510
   36    HE1  TYR   5           HE1      TYR   5  -6.335  -6.218   6.947
   37    HE2  TYR   5           HE2      TYR   5  -8.911  -3.064   5.578
   38    HH   TYR   5           HH       TYR   5  -8.829  -3.905   7.751
   39    H    ILE   6           H        ILE   6  -3.708  -0.988   2.070
   40    HA   ILE   6           HA       ILE   6  -2.508  -2.131  -0.415
   41    HB   ILE   6           HB       ILE   6  -3.497  -0.333  -1.698
   42   HG12  ILE   6          HG13      ILE   6  -4.567   0.640   0.973
   43   HG13  ILE   6          HG12      ILE   6  -3.354   1.450  -0.019
   44   HG21  ILE   6          HG21      ILE   6  -5.732  -1.056  -1.655
   45   HG22  ILE   6          HG22      ILE   6  -5.732  -1.258   0.097
   46   HG23  ILE   6          HG23      ILE   6  -4.871  -2.410  -0.924
   47   HD11  ILE   6          HD11      ILE   6  -6.283   1.048  -0.614
   48   HD12  ILE   6          HD12      ILE   6  -5.126   1.430  -1.889
   49   HD13  ILE   6          HD13      ILE   6  -5.374   2.558  -0.556
   50    H    ALA   7           H        ALA   7  -0.983  -0.604  -1.503
   51    HA   ALA   7           HA       ALA   7   0.319   1.266   0.421
   52    HB1  ALA   7           HB1      ALA   7   2.317   0.183  -1.280
   53    HB2  ALA   7           HB2      ALA   7   1.393  -1.179  -0.650
   54    HB3  ALA   7           HB3      ALA   7   2.154  -0.040   0.461
   55    H    LYS   8           H        LYS   8  -0.922   0.653  -2.683
   56    HA   LYS   8           HA       LYS   8   0.555   2.945  -3.862
   57    HB2  LYS   8           HB3      LYS   8  -1.370   1.498  -5.565
   58    HB3  LYS   8           HB2      LYS   8   0.305   1.939  -5.891
   59    HG2  LYS   8           HG3      LYS   8  -0.577  -0.369  -4.123
   60    HG3  LYS   8           HG2      LYS   8   0.014  -0.520  -5.774
   61    HD2  LYS   8           HD3      LYS   8   1.833   1.069  -4.151
   62    HD3  LYS   8           HD2      LYS   8   1.579  -0.534  -3.460
   63    HE2  LYS   8           HE3      LYS   8   2.245  -1.611  -5.495
   64    HE3  LYS   8           HE2      LYS   8   2.216  -0.087  -6.384
   65    HZ1  LYS   8           HZ1      LYS   8   4.000   0.705  -4.891
   66    HZ2  LYS   8           HZ2      LYS   8   4.466  -0.618  -5.844
   67    HZ3  LYS   8           HZ3      LYS   8   4.084  -0.848  -4.204
   68    HA   PRO   9           HA       PRO   9  -2.895   5.645  -3.402
   69    HB2  PRO   9           HB2      PRO   9  -2.811   7.019  -5.804
   70    HB3  PRO   9           HB3      PRO   9  -1.775   7.361  -4.407
   71    HG2  PRO   9           HG3      PRO   9  -1.170   5.847  -6.886
   72    HG3  PRO   9           HG2      PRO   9  -0.131   6.913  -5.927
   73    HD2  PRO   9           HD3      PRO   9   0.058   4.197  -5.816
   74    HD3  PRO   9           HD2      PRO   9   0.432   5.240  -4.427
   75    H    HIS  10           H        HIS  10  -2.765   3.861  -6.473
   76    HA   HIS  10           HA       HIS  10  -5.742   3.703  -6.375
   77    HB2  HIS  10           HB3      HIS  10  -4.097   4.067  -8.893
   78    HB3  HIS  10           HB2      HIS  10  -5.855   3.965  -8.795
   79    HD1  HIS  10           HD1      HIS  10  -6.957   5.915  -7.157
   80    HD2  HIS  10           HD2      HIS  10  -3.167   6.664  -8.730
   81    HE1  HIS  10           HE1      HIS  10  -6.579   8.413  -6.959
   82    HE2  HIS  10           HE2      HIS  10  -4.276   8.880  -7.913
   83    H    ASN  11           H        ASN  11  -2.959   1.999  -6.183
   84    HA   ASN  11           HA       ASN  11  -4.255  -0.426  -7.357
   85    HB2  ASN  11           HB3      ASN  11  -1.298   0.232  -7.466
   86    HB3  ASN  11           HB2      ASN  11  -2.076  -1.201  -8.138
   87   HD21  ASN  11          HD22      ASN  11  -1.548   2.252  -8.612
   88   HD22  ASN  11          HD21      ASN  11  -2.251   2.335 -10.156
   89    H    CYS  12           H        CYS  12  -3.217  -2.467  -6.425
   90    HA   CYS  12           HA       CYS  12  -2.616  -2.024  -3.526
   91    HB2  CYS  12           HB3      CYS  12  -3.849  -4.479  -4.808
   92    HB3  CYS  12           HB2      CYS  12  -3.686  -4.152  -3.082
   93    H    VAL  13           H        VAL  13  -1.489  -4.214  -2.675
   94    HA   VAL  13           HA       VAL  13   0.927  -4.514  -4.377
   95    HB   VAL  13           HB       VAL  13   0.430  -5.440  -1.529
   96   HG11  VAL  13          HG11      VAL  13   2.218  -6.712  -2.468
   97   HG12  VAL  13          HG12      VAL  13   2.992  -5.420  -1.550
   98   HG13  VAL  13          HG13      VAL  13   2.875  -5.306  -3.306
   99   HG21  VAL  13          HG21      VAL  13   2.071  -3.442  -1.134
  100   HG22  VAL  13          HG22      VAL  13   0.361  -3.094  -1.392
  101   HG23  VAL  13          HG23      VAL  13   1.512  -2.889  -2.713
  102    H    TYR  14           H        TYR  14   1.431  -6.438  -5.359
  103    HA   TYR  14           HA       TYR  14  -0.586  -8.458  -5.649
  104    HB2  TYR  14           HB3      TYR  14   1.004  -9.623  -7.004
  105    HB3  TYR  14           HB2      TYR  14   1.296  -7.906  -7.282
  106    HD1  TYR  14           HD2      TYR  14   3.202  -6.759  -6.145
  107    HD2  TYR  14           HD1      TYR  14   2.641 -11.012  -5.929
  108    HE1  TYR  14           HE2      TYR  14   5.545  -7.028  -5.378
  109    HE2  TYR  14           HE1      TYR  14   4.984 -11.281  -5.163
  110    HH   TYR  14           HH       TYR  14   7.272  -8.738  -5.319
  111    H    GLU  15           H        GLU  15   2.437  -8.361  -3.769
  112    HA   GLU  15           HA       GLU  15   1.382  -9.996  -1.668
  113    HB2  GLU  15           HB3      GLU  15   1.628 -11.740  -3.490
  114    HB3  GLU  15           HB2      GLU  15   3.363 -11.427  -3.461
  115    HG2  GLU  15           HG3      GLU  15   3.394 -11.982  -1.034
  116    HG3  GLU  15           HG2      GLU  15   1.681 -12.391  -1.133
  117    H    CYS  16           H        CYS  16   2.421  -8.485  -0.321
  118    HA   CYS  16           HA       CYS  16   5.153  -7.663  -0.687
  119    HB2  CYS  16           HB3      CYS  16   4.289  -6.178   0.793
  120    HB3  CYS  16           HB2      CYS  16   3.046  -7.308   1.326
  121    H    PHE  17           H        PHE  17   7.029  -8.642   0.001
  122    HA   PHE  17           HA       PHE  17   6.719 -11.276   1.375
  123    HB2  PHE  17           HB3      PHE  17   8.519 -12.070   0.144
  124    HB3  PHE  17           HB2      PHE  17   7.833 -10.923  -1.002
  125    HD1  PHE  17           HD2      PHE  17   8.700  -8.412  -0.697
  126    HD2  PHE  17           HD1      PHE  17  10.796 -11.930   0.601
  127    HE1  PHE  17           HE2      PHE  17  10.832  -7.144  -0.698
  128    HE2  PHE  17           HE1      PHE  17  12.926 -10.663   0.601
  129    HZ   PHE  17           HZ       PHE  17  12.943  -8.272  -0.046
  130    H    ASP  18           H        ASP  18   9.662 -11.285   1.917
  131    HA   ASP  18           HA       ASP  18   9.623 -10.309   4.571
  132    HB2  ASP  18           HB3      ASP  18  11.292 -11.942   3.630
  133    HB3  ASP  18           HB2      ASP  18  12.083 -10.588   2.823
  134    H    ALA  19           H        ALA  19   9.903  -8.305   5.420
  135    HA   ALA  19           HA       ALA  19   9.983  -6.002   3.678
  136    HB1  ALA  19           HB1      ALA  19  10.451  -4.898   6.069
  137    HB2  ALA  19           HB2      ALA  19   9.898  -6.478   6.623
  138    HB3  ALA  19           HB3      ALA  19   8.850  -5.480   5.615
  139    H    PHE  20           H        PHE  20  12.410  -8.068   4.364
  140    HA   PHE  20           HA       PHE  20  14.591  -6.560   5.282
  141    HB2  PHE  20           HB3      PHE  20  14.657  -9.001   4.727
  142    HB3  PHE  20           HB2      PHE  20  14.667  -8.575   3.016
  143    HD1  PHE  20           HD2      PHE  20  16.563  -8.342   6.193
  144    HD2  PHE  20           HD1      PHE  20  16.638  -7.710   1.945
  145    HE1  PHE  20           HE2      PHE  20  19.019  -8.007   6.286
  146    HE2  PHE  20           HE1      PHE  20  19.093  -7.376   2.037
  147    HZ   PHE  20           HZ       PHE  20  20.284  -7.525   4.208
  148    H    SER  21           H        SER  21  13.262  -6.755   1.980
  149    HA   SER  21           HA       SER  21  15.186  -4.750   1.016
  150    HB2  SER  21           HB3      SER  21  12.790  -6.018  -0.342
  151    HB3  SER  21           HB2      SER  21  13.968  -4.975  -1.129
  152    HG   SER  21           HG       SER  21  14.505  -7.445   0.173
  153    H    SER  22           H        SER  22  12.638  -4.502   2.981
  154    HA   SER  22           HA       SER  22  11.040  -2.838   3.440
  155    HB2  SER  22           HB3      SER  22  13.293  -1.282   2.153
  156    HB3  SER  22           HB2      SER  22  11.885  -0.500   2.866
  157    HG   SER  22           HG       SER  22  14.014  -1.204   4.121
  158    H    TYR  23           H        TYR  23  10.593  -4.299   1.002
  159    HA   TYR  23           HA       TYR  23  10.064  -2.655  -1.252
  160    HB2  TYR  23           HB3      TYR  23  10.008  -5.114  -1.349
  161    HB3  TYR  23           HB2      TYR  23   8.579  -5.127  -0.314
  162    HD1  TYR  23           HD1      TYR  23   6.415  -4.305  -1.130
  163    HD2  TYR  23           HD2      TYR  23   9.876  -4.410  -3.674
  164    HE1  TYR  23           HE1      TYR  23   4.965  -3.996  -3.118
  165    HE2  TYR  23           HE2      TYR  23   8.425  -4.097  -5.662
  166    HH   TYR  23           HH       TYR  23   6.353  -3.595  -6.362
  167    H    CYS  24           H        CYS  24   7.872  -3.639   1.389
  168    HA   CYS  24           HA       CYS  24   5.676  -2.021   0.451
  169    HB2  CYS  24           HB3      CYS  24   5.502  -3.984   2.034
  170    HB3  CYS  24           HB2      CYS  24   6.185  -2.951   3.289
  171    H    ASN  25           H        ASN  25   7.873  -1.591   3.231
  172    HA   ASN  25           HA       ASN  25   7.068   1.056   3.862
  173    HB2  ASN  25           HB3      ASN  25   9.817  -0.196   4.175
  174    HB3  ASN  25           HB2      ASN  25   9.236   1.239   5.023
  175   HD21  ASN  25          HD22      ASN  25   6.721  -1.025   4.535
  176   HD22  ASN  25          HD21      ASN  25   6.739  -1.733   6.078
  177    H    GLY  26           H        GLY  26   9.384  -0.199   1.520
  178    HA2  GLY  26           HA3      GLY  26  10.621   2.253   0.784
  179    HA3  GLY  26           HA2      GLY  26  10.449   0.858  -0.285
  180    H    VAL  27           H        VAL  27   7.608   0.715  -0.327
  181    HA   VAL  27           HA       VAL  27   7.005   2.602  -2.384
  182    HB   VAL  27           HB       VAL  27   5.187   0.932  -0.625
  183   HG11  VAL  27          HG11      VAL  27   4.630   2.862  -2.846
  184   HG12  VAL  27          HG12      VAL  27   3.682   2.517  -1.399
  185   HG13  VAL  27          HG13      VAL  27   3.664   1.390  -2.756
  186   HG21  VAL  27          HG21      VAL  27   5.637   0.461  -3.542
  187   HG22  VAL  27          HG22      VAL  27   5.345  -0.704  -2.251
  188   HG23  VAL  27          HG23      VAL  27   6.940   0.025  -2.437
  189    H    CYS  28           H        CYS  28   6.089   2.502   1.056
  190    HA   CYS  28           HA       CYS  28   4.690   5.035   0.983
  191    HB2  CYS  28           HB3      CYS  28   5.842   3.390   3.252
  192    HB3  CYS  28           HB2      CYS  28   4.960   4.894   3.511
  193    H    THR  29           H        THR  29   8.025   4.096   1.339
  194    HA   THR  29           HA       THR  29   9.046   6.424   2.628
  195    HB   THR  29           HB       THR  29  10.442   4.677   0.585
  196    HG1  THR  29           HG1      THR  29   9.680   4.321   3.218
  197   HG21  THR  29          HG21      THR  29  11.674   6.720   1.054
  198   HG22  THR  29          HG22      THR  29  12.467   5.376   1.875
  199   HG23  THR  29          HG23      THR  29  11.454   6.493   2.789
  200    H    LYS  30           H        LYS  30   8.183   5.863  -0.739
  201    HA   LYS  30           HA       LYS  30   9.642   7.898  -2.002
  202    HB2  LYS  30           HB3      LYS  30   6.913   6.743  -2.513
  203    HB3  LYS  30           HB2      LYS  30   7.514   8.075  -3.501
  204    HG2  LYS  30           HG3      LYS  30   8.101   5.996  -4.595
  205    HG3  LYS  30           HG2      LYS  30   9.579   6.714  -3.953
  206    HD2  LYS  30           HD3      LYS  30   9.601   5.224  -2.082
  207    HD3  LYS  30           HD2      LYS  30   7.963   4.667  -2.424
  208    HE2  LYS  30           HE3      LYS  30   9.393   2.953  -3.250
  209    HE3  LYS  30           HE2      LYS  30   8.869   3.851  -4.674
  210    HZ1  LYS  30           HZ1      LYS  30  11.122   3.744  -4.995
  211    HZ2  LYS  30           HZ2      LYS  30  11.487   3.845  -3.342
  212    HZ3  LYS  30           HZ3      LYS  30  10.992   5.233  -4.187
  213    H    ASN  31           H        ASN  31   6.729   8.203  -0.019
  214    HA   ASN  31           HA       ASN  31   6.042  10.873  -0.674
  215    HB2  ASN  31           HB3      ASN  31   4.813   9.232   0.891
  216    HB3  ASN  31           HB2      ASN  31   5.926   9.795   2.139
  217   HD21  ASN  31          HD22      ASN  31   5.843  12.506   0.482
  218   HD22  ASN  31          HD21      ASN  31   4.446  13.254   1.092
  219    H    GLY  32           H        GLY  32   8.580   9.596   1.413
  220    HA2  GLY  32           HA3      GLY  32  10.625  10.855   1.804
  221    HA3  GLY  32           HA2      GLY  32   9.709  12.346   1.580
  222    H    ALA  33           H        ALA  33   7.825  10.300   3.380
  223    HA   ALA  33           HA       ALA  33   9.008  10.568   5.999
  224    HB1  ALA  33           HB1      ALA  33   8.480  12.746   6.356
  225    HB2  ALA  33           HB2      ALA  33   6.823  12.162   6.515
  226    HB3  ALA  33           HB3      ALA  33   7.390  12.797   4.970
  227    H    LYS  34           H        LYS  34   6.242  10.059   3.932
  228    HA   LYS  34           HA       LYS  34   4.355   9.044   5.757
  229    HB2  LYS  34           HB3      LYS  34   4.011   9.390   3.293
  230    HB3  LYS  34           HB2      LYS  34   4.963   7.937   3.003
  231    HG2  LYS  34           HG3      LYS  34   3.360   6.595   4.256
  232    HG3  LYS  34           HG2      LYS  34   2.429   8.036   4.645
  233    HD2  LYS  34           HD3      LYS  34   2.355   8.398   2.066
  234    HD3  LYS  34           HD2      LYS  34   2.783   6.692   1.981
  235    HE2  LYS  34           HE3      LYS  34   0.758   6.665   3.840
  236    HE3  LYS  34           HE2      LYS  34   0.237   7.959   2.762
  237    HZ1  LYS  34           HZ1      LYS  34  -0.338   5.478   2.249
  238    HZ2  LYS  34           HZ2      LYS  34   1.220   5.464   1.581
  239    HZ3  LYS  34           HZ3      LYS  34   0.057   6.555   0.995
  240    H    SER  35           H        SER  35   4.266   7.159   6.951
  241    HA   SER  35           HA       SER  35   6.497   5.219   6.512
  242    HB2  SER  35           HB3      SER  35   5.033   5.866   9.084
  243    HB3  SER  35           HB2      SER  35   6.342   4.699   8.912
  244    HG   SER  35           HG       SER  35   6.404   7.513   8.616
  245    H    GLY  36           H        GLY  36   5.940   3.046   6.319
  246    HA2  GLY  36           HA3      GLY  36   3.142   2.283   6.905
  247    HA3  GLY  36           HA2      GLY  36   3.743   2.020   5.269
  248    H    TYR  37           H        TYR  37   2.814  -0.009   7.063
  249    HA   TYR  37           HA       TYR  37   5.329  -1.600   7.365
  250    HB2  TYR  37           HB3      TYR  37   2.866  -1.846   9.119
  251    HB3  TYR  37           HB2      TYR  37   4.416  -2.656   9.341
  252    HD1  TYR  37           HD2      TYR  37   6.508  -1.112   9.611
  253    HD2  TYR  37           HD1      TYR  37   2.457   0.196  10.180
  254    HE1  TYR  37           HE2      TYR  37   7.319   0.816  10.944
  255    HE2  TYR  37           HE1      TYR  37   3.267   2.125  11.513
  256    HH   TYR  37           HH       TYR  37   5.673   3.463  11.533
  257    H    CYS  38           H        CYS  38   5.025  -3.902   6.902
  258    HA   CYS  38           HA       CYS  38   2.722  -4.346   5.070
  259    HB2  CYS  38           HB3      CYS  38   4.794  -4.847   4.010
  260    HB3  CYS  38           HB2      CYS  38   5.378  -5.748   5.408
  261    H    GLN  39           H        GLN  39   1.038  -5.497   5.805
  262    HA   GLN  39           HA       GLN  39   1.509  -7.450   8.025
  263    HB2  GLN  39           HB3      GLN  39  -0.905  -5.668   7.568
  264    HB3  GLN  39           HB2      GLN  39  -0.763  -6.885   8.837
  265    HG2  GLN  39           HG3      GLN  39   1.253  -5.694   9.703
  266    HG3  GLN  39           HG2      GLN  39   0.992  -4.437   8.492
  267   HE21  GLN  39          HE22      GLN  39  -2.057  -5.474   9.281
  268   HE22  GLN  39          HE21      GLN  39  -2.418  -4.373  10.522
  269    H    ILE  40           H        ILE  40  -0.835  -8.762   8.096
  270    HA   ILE  40           HA       ILE  40  -0.888 -10.093   5.452
  271    HB   ILE  40           HB       ILE  40  -2.216 -10.890   8.055
  272   HG12  ILE  40          HG13      ILE  40   0.341 -11.913   6.778
  273   HG13  ILE  40          HG12      ILE  40   0.283 -10.824   8.164
  274   HG21  ILE  40          HG21      ILE  40  -1.687 -13.090   6.357
  275   HG22  ILE  40          HG22      ILE  40  -2.425 -11.846   5.348
  276   HG23  ILE  40          HG23      ILE  40  -3.262 -12.422   6.790
  277   HD11  ILE  40          HD11      ILE  40  -1.448 -13.095   8.615
  278   HD12  ILE  40          HD12      ILE  40  -0.073 -12.545   9.571
  279   HD13  ILE  40          HD13      ILE  40   0.179 -13.643   8.215
  280    H    LEU  41           H        LEU  41  -2.783 -10.297   4.237
  281    HA   LEU  41           HA       LEU  41  -4.606  -8.160   4.190
  282    HB2  LEU  41           HB3      LEU  41  -4.205  -9.870   2.375
  283    HB3  LEU  41           HB2      LEU  41  -5.200 -10.993   3.298
  284    HG   LEU  41           HG       LEU  41  -7.053  -9.298   3.242
  285   HD11  LEU  41          HD11      LEU  41  -4.959  -7.846   1.675
  286   HD12  LEU  41          HD12      LEU  41  -6.157  -7.212   2.804
  287   HD13  LEU  41          HD13      LEU  41  -6.640  -7.672   1.171
  288   HD21  LEU  41          HD21      LEU  41  -7.456  -9.614   0.710
  289   HD22  LEU  41          HD22      LEU  41  -7.250 -11.072   1.681
  290   HD23  LEU  41          HD23      LEU  41  -5.913 -10.467   0.702
  291    H    GLY  42           H        GLY  42  -4.852 -11.288   5.847
  292    HA2  GLY  42           HA3      GLY  42  -6.045 -11.014   8.114
  293    HA3  GLY  42           HA2      GLY  42  -7.364 -10.339   7.155
  294    H    THR  43           H        THR  43  -7.693 -11.918   5.077
  295    HA   THR  43           HA       THR  43  -8.338 -14.554   6.276
  296    HB   THR  43           HB       THR  43  -9.252 -13.363   3.641
  297    HG1  THR  43           HG1      THR  43 -10.587 -12.291   4.824
  298   HG21  THR  43          HG21      THR  43 -10.295 -15.326   3.264
  299   HG22  THR  43          HG22      THR  43 -10.933 -15.373   4.907
  300   HG23  THR  43          HG23      THR  43  -9.318 -15.995   4.571
  301    H    TYR  44           H        TYR  44  -7.384 -13.463   3.023
  302    HA   TYR  44           HA       TYR  44  -5.196 -15.476   3.042
  303    HB2  TYR  44           HB3      TYR  44  -5.860 -16.444   0.970
  304    HB3  TYR  44           HB2      TYR  44  -7.340 -16.371   1.929
  305    HD1  TYR  44           HD2      TYR  44  -9.030 -14.598   1.502
  306    HD2  TYR  44           HD1      TYR  44  -5.568 -15.079  -0.995
  307    HE1  TYR  44           HE2      TYR  44 -10.094 -13.194  -0.242
  308    HE2  TYR  44           HE1      TYR  44  -6.632 -13.674  -2.739
  309    HH   TYR  44           HH       TYR  44  -9.853 -12.975  -2.824
  310    H    GLY  45           H        GLY  45  -3.584 -15.005   1.322
  311    HA2  GLY  45           HA3      GLY  45  -2.422 -13.545  -0.143
  312    HA3  GLY  45           HA2      GLY  45  -3.807 -12.453  -0.100
  313    H    ASN  46           H        ASN  46  -2.040 -10.792   0.140
  314    HA   ASN  46           HA       ASN  46  -1.504 -10.359   3.025
  315    HB2  ASN  46           HB3      ASN  46   0.524 -11.370   1.814
  316    HB3  ASN  46           HB2      ASN  46   0.622  -9.839   0.943
  317   HD21  ASN  46          HD22      ASN  46   1.640  -8.112   2.008
  318   HD22  ASN  46          HD21      ASN  46   2.093  -8.130   3.642
  319    H    GLY  47           H        GLY  47  -0.965  -8.033   3.464
  320    HA2  GLY  47           HA3      GLY  47  -1.787  -6.198   1.268
  321    HA3  GLY  47           HA2      GLY  47  -2.650  -6.116   2.803
  322    H    CYS  48           H        CYS  48  -1.163  -3.948   1.701
  323    HA   CYS  48           HA       CYS  48   1.232  -3.799   3.452
  324    HB2  CYS  48           HB3      CYS  48   0.493  -2.648   0.849
  325    HB3  CYS  48           HB2      CYS  48   1.212  -1.483   1.960
  326    H    TRP  49           H        TRP  49   1.503  -1.817   4.742
  327    HA   TRP  49           HA       TRP  49  -1.092  -0.475   5.374
  328    HB2  TRP  49           HB3      TRP  49  -0.020  -2.223   7.055
  329    HB3  TRP  49           HB2      TRP  49   1.014  -0.857   7.469
  330    HD1  TRP  49           HD1      TRP  49  -0.180   1.339   8.456
  331    HE1  TRP  49           HE1      TRP  49  -2.415   1.627   9.709
  332    HE3  TRP  49           HE3      TRP  49  -2.422  -3.092   7.281
  333    HZ2  TRP  49           HZ2      TRP  49  -4.836   0.165  10.154
  334    HZ3  TRP  49           HZ3      TRP  49  -4.688  -3.621   8.131
  335    HH2  TRP  49           HH2      TRP  49  -5.896  -1.999   9.565
  336    H    CYS  50           H        CYS  50  -0.953   1.695   5.010
  337    HA   CYS  50           HA       CYS  50   1.720   2.995   5.342
  338    HB2  CYS  50           HB3      CYS  50   0.542   2.745   2.939
  339    HB3  CYS  50           HB2      CYS  50  -0.238   4.229   3.489
  340    H    ILE  51           H        ILE  51   1.745   4.807   6.632
  341    HA   ILE  51           HA       ILE  51  -0.902   5.746   7.644
  342    HB   ILE  51           HB       ILE  51   1.758   5.672   9.085
  343   HG12  ILE  51          HG13      ILE  51  -0.466   4.162  10.211
  344   HG13  ILE  51          HG12      ILE  51  -0.072   3.615   8.582
  345   HG21  ILE  51          HG21      ILE  51  -0.445   5.999  10.838
  346   HG22  ILE  51          HG22      ILE  51  -0.665   7.168   9.535
  347   HG23  ILE  51          HG23      ILE  51   0.823   7.172  10.482
  348   HD11  ILE  51          HD11      ILE  51   1.218   2.512  10.512
  349   HD12  ILE  51          HD12      ILE  51   2.063   4.051  10.673
  350   HD13  ILE  51          HD13      ILE  51   2.177   3.136   9.169
  351    H    ALA  52           H        ALA  52  -1.352   7.867   7.530
  352    HA   ALA  52           HA       ALA  52   0.338  10.072   7.722
  353    HB1  ALA  52           HB1      ALA  52   1.612   9.760   5.831
  354    HB2  ALA  52           HB2      ALA  52   0.243  10.582   5.085
  355    HB3  ALA  52           HB3      ALA  52   0.358   8.824   5.016
  356    H    LEU  53           H        LEU  53  -0.867  12.015   7.449
  357    HA   LEU  53           HA       LEU  53  -3.656  11.661   6.427
  358    HB2  LEU  53           HB3      LEU  53  -3.536  11.663   8.945
  359    HB3  LEU  53           HB2      LEU  53  -2.889  13.302   8.855
  360    HG   LEU  53           HG       LEU  53  -5.150  13.324   7.191
  361   HD11  LEU  53          HD11      LEU  53  -5.760  11.955   9.830
  362   HD12  LEU  53          HD12      LEU  53  -5.810  11.167   8.252
  363   HD13  LEU  53          HD13      LEU  53  -6.940  12.470   8.624
  364   HD21  LEU  53          HD21      LEU  53  -6.082  14.739   9.065
  365   HD22  LEU  53          HD22      LEU  53  -4.454  15.194   8.562
  366   HD23  LEU  53          HD23      LEU  53  -4.693  14.260  10.040
  367    HA   PRO  54           HA       PRO  54  -1.668  15.405   4.565
  368    HB2  PRO  54           HB2      PRO  54  -1.776  14.652   1.973
  369    HB3  PRO  54           HB3      PRO  54  -0.477  14.111   3.054
  370    HG2  PRO  54           HG3      PRO  54  -2.852  12.638   2.064
  371    HG3  PRO  54           HG2      PRO  54  -1.221  12.048   2.420
  372    HD2  PRO  54           HD3      PRO  54  -3.456  11.793   4.108
  373    HD3  PRO  54           HD2      PRO  54  -1.761  11.568   4.587
  374    H    ASP  55           H        ASP  55  -3.600  14.279   1.917
  375    HA   ASP  55           HA       ASP  55  -5.491  16.517   2.360
  376    HB2  ASP  55           HB3      ASP  55  -5.017  14.692  -0.015
  377    HB3  ASP  55           HB2      ASP  55  -6.231  15.971   0.024
  378    H    ASN  56           H        ASN  56  -5.394  13.568   3.558
  379    HA   ASN  56           HA       ASN  56  -7.033  12.077   4.337
  380    HB2  ASN  56           HB3      ASN  56  -8.144  14.430   4.725
  381    HB3  ASN  56           HB2      ASN  56  -9.168  13.956   3.369
  382   HD21  ASN  56          HD22      ASN  56  -8.436  11.040   4.611
  383   HD22  ASN  56          HD21      ASN  56  -9.675  10.862   5.757
  384    H    VAL  57           H        VAL  57  -6.031  11.606   1.781
  385    HA   VAL  57           HA       VAL  57  -8.079  11.293  -0.209
  386    HB   VAL  57           HB       VAL  57  -5.556   9.650   0.025
  387   HG11  VAL  57          HG11      VAL  57  -5.892   9.132  -2.177
  388   HG12  VAL  57          HG12      VAL  57  -6.574  10.716  -2.549
  389   HG13  VAL  57          HG13      VAL  57  -7.575   9.483  -1.782
  390   HG21  VAL  57          HG21      VAL  57  -4.821  11.908   0.297
  391   HG22  VAL  57          HG22      VAL  57  -5.974  12.501  -0.899
  392   HG23  VAL  57          HG23      VAL  57  -4.590  11.538  -1.412
  393    HA   PRO  58           HA       PRO  58  -9.666   7.543   1.829
  394    HB2  PRO  58           HB2      PRO  58 -12.068   7.427   0.642
  395    HB3  PRO  58           HB3      PRO  58 -11.702   8.697   1.829
  396    HG2  PRO  58           HG3      PRO  58 -11.821   8.855  -1.135
  397    HG3  PRO  58           HG2      PRO  58 -12.303  10.047   0.082
  398    HD2  PRO  58           HD3      PRO  58  -9.872  10.043  -1.338
  399    HD3  PRO  58           HD2      PRO  58 -10.228  10.985   0.129
  400    H    ILE  59           H        ILE  59 -10.368   5.342   1.014
  401    HA   ILE  59           HA       ILE  59  -9.221   4.847  -1.695
  402    HB   ILE  59           HB       ILE  59  -9.665   2.802   0.486
  403   HG12  ILE  59          HG13      ILE  59  -8.116   4.429   1.394
  404   HG13  ILE  59          HG12      ILE  59  -7.173   3.040   0.850
  405   HG21  ILE  59          HG21      ILE  59  -7.576   2.634  -1.634
  406   HG22  ILE  59          HG22      ILE  59  -9.251   2.405  -2.131
  407   HG23  ILE  59          HG23      ILE  59  -8.542   1.351  -0.907
  408   HD11  ILE  59          HD11      ILE  59  -5.967   4.829  -0.054
  409   HD12  ILE  59          HD12      ILE  59  -7.420   5.761  -0.405
  410   HD13  ILE  59          HD13      ILE  59  -7.006   4.370  -1.403
  411    H    ARG  60           H        ARG  60 -10.555   4.086  -3.256
  412    HA   ARG  60           HA       ARG  60 -13.246   3.088  -2.429
  413    HB2  ARG  60           HB3      ARG  60 -13.646   3.875  -5.001
  414    HB3  ARG  60           HB2      ARG  60 -13.957   4.910  -3.611
  415    HG2  ARG  60           HG3      ARG  60 -12.620   6.154  -5.205
  416    HG3  ARG  60           HG2      ARG  60 -11.605   5.787  -3.815
  417    HD2  ARG  60           HD3      ARG  60 -10.628   3.875  -5.016
  418    HD3  ARG  60           HD2      ARG  60 -11.682   4.189  -6.393
  419    HE   ARG  60           HE       ARG  60  -9.967   6.444  -5.606
  420   HH11  ARG  60          HH22      ARG  60 -10.456   3.627  -7.535
  421   HH12  ARG  60          HH21      ARG  60  -9.324   4.105  -8.756
  422   HH21  ARG  60          HH11      ARG  60  -8.486   7.083  -7.189
  423   HH22  ARG  60          HH12      ARG  60  -8.208   6.061  -8.560
  424    H    ILE  61           H        ILE  61 -12.439   0.912  -2.411
  425    HA   ILE  61           HA       ILE  61 -11.870  -0.175  -5.142
  426    HB   ILE  61           HB       ILE  61 -10.685  -2.028  -3.675
  427   HG12  ILE  61          HG13      ILE  61 -10.414   0.444  -1.934
  428   HG13  ILE  61          HG12      ILE  61 -11.441  -0.934  -1.538
  429   HG21  ILE  61          HG21      ILE  61  -8.576  -0.548  -3.754
  430   HG22  ILE  61          HG22      ILE  61  -9.626   0.705  -4.412
  431   HG23  ILE  61          HG23      ILE  61  -9.418  -0.816  -5.279
  432   HD11  ILE  61          HD11      ILE  61  -9.110  -0.945  -0.492
  433   HD12  ILE  61          HD12      ILE  61  -8.489  -1.230  -2.118
  434   HD13  ILE  61          HD13      ILE  61  -9.568  -2.406  -1.368
  435    HA   PRO  62           HA       PRO  62 -15.888  -1.925  -3.563
  436    HB2  PRO  62           HB2      PRO  62 -16.094  -2.384  -6.499
  437    HB3  PRO  62           HB3      PRO  62 -17.291  -1.715  -5.375
  438    HG2  PRO  62           HG3      PRO  62 -15.952  -0.172  -7.097
  439    HG3  PRO  62           HG2      PRO  62 -16.415   0.396  -5.485
  440    HD2  PRO  62           HD3      PRO  62 -13.725  -0.404  -6.496
  441    HD3  PRO  62           HD2      PRO  62 -14.156   0.783  -5.244
  442    H    GLY  63           H        GLY  63 -13.240  -3.159  -5.440
  443    HA2  GLY  63           HA3      GLY  63 -13.054  -5.659  -4.289
  444    HA3  GLY  63           HA2      GLY  63 -14.222  -5.899  -5.590
  445    H    LYS  64           H        LYS  64 -12.562  -3.548  -6.912
  446    HA   LYS  64           HA       LYS  64 -11.115  -5.167  -8.741
  447    HB2  LYS  64           HB3      LYS  64 -10.690  -2.255  -8.007
  448    HB3  LYS  64           HB2      LYS  64 -10.013  -3.047  -9.429
  449    HG2  LYS  64           HG3      LYS  64 -12.373  -3.654 -10.105
  450    HG3  LYS  64           HG2      LYS  64 -12.943  -2.618  -8.795
  451    HD2  LYS  64           HD3      LYS  64 -11.127  -1.699 -11.043
  452    HD3  LYS  64           HD2      LYS  64 -12.871  -1.434 -10.993
  453    HE2  LYS  64           HE3      LYS  64 -12.400  -0.380  -8.654
  454    HE3  LYS  64           HE2      LYS  64 -10.735  -0.265  -9.223
  455    HZ1  LYS  64           HZ1      LYS  64 -12.845   1.442  -9.802
  456    HZ2  LYS  64           HZ2      LYS  64 -12.491   0.618 -11.241
  457    HZ3  LYS  64           HZ3      LYS  64 -11.271   1.486 -10.439
  458    H    CYS  65           H        CYS  65 -10.149  -3.693  -5.688
  459    HA   CYS  65           HA       CYS  65  -7.340  -3.967  -5.898
  460    HB2  CYS  65           HB3      CYS  65  -8.512  -2.822  -4.020
  461    HB3  CYS  65           HB2      CYS  65  -9.042  -4.393  -3.422
  462    H    HIS  66           H        HIS  66  -9.832  -6.364  -5.181
  463    HA   HIS  66           HA       HIS  66  -8.045  -8.443  -4.314
  464    HB2  HIS  66           HB3      HIS  66 -10.792  -8.596  -5.593
  465    HB3  HIS  66           HB2      HIS  66  -9.952  -9.965  -4.861
  466    HD1  HIS  66           HD1      HIS  66 -11.694  -6.749  -4.003
  467    HD2  HIS  66           HD2      HIS  66  -9.823  -9.901  -2.012
  468    HE1  HIS  66           HE1      HIS  66 -12.264  -6.486  -1.548
  469    HE2  HIS  66           HE2      HIS  66 -11.129  -8.399  -0.327
  Start of MODEL    7
    1    H1   ALA   1           H1       ALA   1  -0.800  11.474   2.277
    2    H2   ALA   1           H2       ALA   1  -1.251  11.439   0.639
    3    H3   ALA   1           H3       ALA   1  -0.462  10.105   1.335
    4    HA   ALA   1           HA       ALA   1  -3.040  11.021   2.423
    5    HB1  ALA   1           HB1      ALA   1  -2.811   8.959   0.228
    6    HB2  ALA   1           HB2      ALA   1  -3.120  10.658  -0.131
    7    HB3  ALA   1           HB3      ALA   1  -4.265   9.742   0.847
    8    H    ARG   2           H        ARG   2  -4.081   8.384   2.404
    9    HA   ARG   2           HA       ARG   2  -2.066   6.895   4.037
   10    HB2  ARG   2           HB3      ARG   2  -3.722   7.990   5.510
   11    HB3  ARG   2           HB2      ARG   2  -5.026   7.190   4.633
   12    HG2  ARG   2           HG3      ARG   2  -4.052   4.983   5.257
   13    HG3  ARG   2           HG2      ARG   2  -2.816   5.820   6.194
   14    HD2  ARG   2           HD3      ARG   2  -4.624   6.883   7.546
   15    HD3  ARG   2           HD2      ARG   2  -5.806   5.917   6.664
   16    HE   ARG   2           HE       ARG   2  -4.036   4.950   8.772
   17   HH11  ARG   2          HH22      ARG   2  -5.825   4.208   5.920
   18   HH12  ARG   2          HH21      ARG   2  -6.005   2.529   6.309
   19   HH21  ARG   2          HH11      ARG   2  -4.261   2.762   9.296
   20   HH22  ARG   2          HH12      ARG   2  -5.120   1.711   8.220
   21    H    ASP   3           H        ASP   3  -1.970   4.715   3.637
   22    HA   ASP   3           HA       ASP   3  -3.845   3.650   1.573
   23    HB2  ASP   3           HB3      ASP   3  -1.045   2.799   2.347
   24    HB3  ASP   3           HB2      ASP   3  -2.058   1.944   1.190
   25    H    ALA   4           H        ALA   4  -4.770   1.546   1.959
   26    HA   ALA   4           HA       ALA   4  -4.810   0.821   4.848
   27    HB1  ALA   4           HB1      ALA   4  -7.035   0.986   4.445
   28    HB2  ALA   4           HB2      ALA   4  -6.853  -0.598   3.689
   29    HB3  ALA   4           HB3      ALA   4  -6.819   0.861   2.699
   30    H    TYR   5           H        TYR   5  -5.738  -1.264   2.156
   31    HA   TYR   5           HA       TYR   5  -3.830  -3.288   3.208
   32    HB2  TYR   5           HB3      TYR   5  -6.036  -3.630   1.155
   33    HB3  TYR   5           HB2      TYR   5  -5.160  -4.912   1.993
   34    HD1  TYR   5           HD1      TYR   5  -5.453  -5.227   4.455
   35    HD2  TYR   5           HD2      TYR   5  -7.842  -2.454   2.209
   36    HE1  TYR   5           HE1      TYR   5  -7.088  -5.127   6.318
   37    HE2  TYR   5           HE2      TYR   5  -9.478  -2.355   4.070
   38    HH   TYR   5           HH       TYR   5  -9.136  -2.872   6.846
   39    H    ILE   6           H        ILE   6  -3.656  -0.891   1.042
   40    HA   ILE   6           HA       ILE   6  -2.170  -2.506  -0.977
   41    HB   ILE   6           HB       ILE   6  -2.551  -0.665  -2.524
   42   HG12  ILE   6          HG13      ILE   6  -3.875   0.704  -0.161
   43   HG13  ILE   6          HG12      ILE   6  -2.366   1.196  -0.932
   44   HG21  ILE   6          HG21      ILE   6  -5.254  -0.797  -1.338
   45   HG22  ILE   6          HG22      ILE   6  -4.481  -2.360  -1.603
   46   HG23  ILE   6          HG23      ILE   6  -4.711  -1.249  -2.953
   47   HD11  ILE   6          HD11      ILE   6  -3.965   1.119  -3.104
   48   HD12  ILE   6          HD12      ILE   6  -3.757   2.568  -2.120
   49   HD13  ILE   6          HD13      ILE   6  -5.160   1.529  -1.873
   50    H    ALA   7           H        ALA   7  -0.062  -1.811  -1.575
   51    HA   ALA   7           HA       ALA   7   1.233  -0.058   0.450
   52    HB1  ALA   7           HB1      ALA   7   2.017  -2.500  -0.206
   53    HB2  ALA   7           HB2      ALA   7   3.208  -1.235   0.096
   54    HB3  ALA   7           HB3      ALA   7   2.777  -1.660  -1.559
   55    H    LYS   8           H        LYS   8  -0.073   0.141  -2.575
   56    HA   LYS   8           HA       LYS   8   1.733   2.396  -3.297
   57    HB2  LYS   8           HB3      LYS   8   0.504   1.093  -5.604
   58    HB3  LYS   8           HB2      LYS   8   2.199   1.499  -5.319
   59    HG2  LYS   8           HG3      LYS   8   2.316  -0.498  -3.767
   60    HG3  LYS   8           HG2      LYS   8   0.717  -0.955  -4.352
   61    HD2  LYS   8           HD3      LYS   8   2.088  -0.475  -6.698
   62    HD3  LYS   8           HD2      LYS   8   3.331  -1.188  -5.674
   63    HE2  LYS   8           HE3      LYS   8   0.584  -2.397  -6.097
   64    HE3  LYS   8           HE2      LYS   8   2.030  -2.889  -6.977
   65    HZ1  LYS   8           HZ1      LYS   8   2.209  -2.803  -4.068
   66    HZ2  LYS   8           HZ2      LYS   8   2.912  -3.888  -5.165
   67    HZ3  LYS   8           HZ3      LYS   8   1.274  -4.051  -4.742
   68    HA   PRO   9           HA       PRO   9  -1.657   5.095  -4.000
   69    HB2  PRO   9           HB2      PRO   9  -1.370   4.875  -6.967
   70    HB3  PRO   9           HB3      PRO   9  -1.440   6.321  -5.941
   71    HG2  PRO   9           HG3      PRO   9   0.857   5.458  -6.964
   72    HG3  PRO   9           HG2      PRO   9   0.770   6.173  -5.346
   73    HD2  PRO   9           HD3      PRO   9   1.136   3.320  -6.123
   74    HD3  PRO   9           HD2      PRO   9   1.716   4.183  -4.680
   75    H    HIS  10           H        HIS  10  -2.146   3.297  -7.042
   76    HA   HIS  10           HA       HIS  10  -4.867   2.590  -6.046
   77    HB2  HIS  10           HB3      HIS  10  -3.876   2.634  -8.907
   78    HB3  HIS  10           HB2      HIS  10  -5.548   2.493  -8.363
   79    HD1  HIS  10           HD1      HIS  10  -6.210   4.659  -6.644
   80    HD2  HIS  10           HD2      HIS  10  -3.279   5.243  -9.555
   81    HE1  HIS  10           HE1      HIS  10  -6.014   7.166  -6.974
   82    HE2  HIS  10           HE2      HIS  10  -4.234   7.531  -8.744
   83    H    ASN  11           H        ASN  11  -1.840   1.227  -6.676
   84    HA   ASN  11           HA       ASN  11  -3.014  -1.435  -7.321
   85    HB2  ASN  11           HB3      ASN  11  -0.107  -0.576  -7.293
   86    HB3  ASN  11           HB2      ASN  11  -0.747  -2.097  -7.915
   87   HD21  ASN  11          HD22      ASN  11  -0.047   1.175  -8.745
   88   HD22  ASN  11          HD21      ASN  11  -0.793   1.178 -10.271
   89    H    CYS  12           H        CYS  12  -2.343  -3.291  -6.032
   90    HA   CYS  12           HA       CYS  12  -1.486  -2.537  -3.263
   91    HB2  CYS  12           HB3      CYS  12  -2.995  -4.126  -2.364
   92    HB3  CYS  12           HB2      CYS  12  -3.918  -3.293  -3.614
   93    H    VAL  13           H        VAL  13  -0.751  -4.677  -2.078
   94    HA   VAL  13           HA       VAL  13   1.264  -5.953  -3.866
   95    HB   VAL  13           HB       VAL  13   1.164  -5.613  -0.857
   96   HG11  VAL  13          HG11      VAL  13   3.125  -7.082  -2.640
   97   HG12  VAL  13          HG12      VAL  13   2.180  -7.756  -1.311
   98   HG13  VAL  13          HG13      VAL  13   3.485  -6.616  -0.978
   99   HG21  VAL  13          HG21      VAL  13   1.776  -3.609  -2.193
  100   HG22  VAL  13          HG22      VAL  13   3.053  -4.539  -2.976
  101   HG23  VAL  13          HG23      VAL  13   3.140  -4.204  -1.246
  102    H    TYR  14           H        TYR  14   1.261  -8.147  -4.152
  103    HA   TYR  14           HA       TYR  14  -1.057  -9.648  -3.151
  104    HB2  TYR  14           HB3      TYR  14  -0.377 -11.375  -4.656
  105    HB3  TYR  14           HB2      TYR  14  -0.063  -9.861  -5.502
  106    HD1  TYR  14           HD2      TYR  14   2.262  -8.947  -5.610
  107    HD2  TYR  14           HD1      TYR  14   1.409 -12.836  -4.001
  108    HE1  TYR  14           HE2      TYR  14   4.656  -9.560  -5.825
  109    HE2  TYR  14           HE1      TYR  14   3.802 -13.450  -4.216
  110    HH   TYR  14           HH       TYR  14   5.964 -11.791  -6.076
  111    H    GLU  15           H        GLU  15   2.400  -9.435  -2.561
  112    HA   GLU  15           HA       GLU  15   2.180 -10.612   0.046
  113    HB2  GLU  15           HB3      GLU  15   1.930 -12.665  -1.437
  114    HB3  GLU  15           HB2      GLU  15   3.582 -12.370  -1.982
  115    HG2  GLU  15           HG3      GLU  15   3.698 -13.954  -0.167
  116    HG3  GLU  15           HG2      GLU  15   4.301 -12.409   0.437
  117    H    CYS  16           H        CYS  16   3.513  -8.910   0.714
  118    HA   CYS  16           HA       CYS  16   5.902  -8.134  -0.686
  119    HB2  CYS  16           HB3      CYS  16   6.475  -7.053   1.572
  120    HB3  CYS  16           HB2      CYS  16   4.978  -6.527   0.802
  121    H    PHE  17           H        PHE  17   7.413  -9.697  -1.034
  122    HA   PHE  17           HA       PHE  17   7.913 -11.972   0.526
  123    HB2  PHE  17           HB3      PHE  17   9.777 -12.319  -0.815
  124    HB3  PHE  17           HB2      PHE  17   8.840 -11.213  -1.816
  125    HD1  PHE  17           HD1      PHE  17   9.364  -8.731  -1.739
  126    HD2  PHE  17           HD2      PHE  17  11.912 -11.703   0.031
  127    HE1  PHE  17           HE1      PHE  17  11.235  -7.104  -1.700
  128    HE2  PHE  17           HE2      PHE  17  13.783 -10.074   0.071
  129    HZ   PHE  17           HZ       PHE  17  13.444  -7.774  -0.795
  130    H    ASP  18           H        ASP  18   9.437  -8.758   0.798
  131    HA   ASP  18           HA       ASP  18  10.130  -9.443   3.587
  132    HB2  ASP  18           HB3      ASP  18  12.097 -10.069   2.119
  133    HB3  ASP  18           HB2      ASP  18  12.231  -8.361   1.698
  134    H    ALA  19           H        ALA  19   8.383  -7.806   3.825
  135    HA   ALA  19           HA       ALA  19   8.729  -5.103   2.906
  136    HB1  ALA  19           HB1      ALA  19   7.127  -6.271   5.192
  137    HB2  ALA  19           HB2      ALA  19   6.536  -5.837   3.587
  138    HB3  ALA  19           HB3      ALA  19   7.044  -4.576   4.710
  139    H    PHE  20           H        PHE  20   9.855  -6.876   5.716
  140    HA   PHE  20           HA       PHE  20  10.593  -4.729   7.396
  141    HB2  PHE  20           HB3      PHE  20  10.726  -7.155   8.008
  142    HB3  PHE  20           HB2      PHE  20  12.147  -7.300   6.974
  143    HD1  PHE  20           HD2      PHE  20  10.789  -5.710  10.033
  144    HD2  PHE  20           HD1      PHE  20  14.287  -6.423   7.645
  145    HE1  PHE  20           HE2      PHE  20  12.219  -4.875  11.879
  146    HE2  PHE  20           HE1      PHE  20  15.717  -5.587   9.491
  147    HZ   PHE  20           HZ       PHE  20  14.683  -4.813  11.607
  148    H    SER  21           H        SER  21  12.335  -6.184   4.652
  149    HA   SER  21           HA       SER  21  14.760  -4.744   4.928
  150    HB2  SER  21           HB3      SER  21  14.309  -6.617   3.291
  151    HB3  SER  21           HB2      SER  21  13.421  -5.457   2.306
  152    HG   SER  21           HG       SER  21  15.832  -4.486   3.074
  153    H    SER  22           H        SER  22  11.875  -3.903   2.990
  154    HA   SER  22           HA       SER  22  11.516  -1.276   3.597
  155    HB2  SER  22           HB3      SER  22  14.040  -1.593   2.037
  156    HB3  SER  22           HB2      SER  22  13.000  -0.235   1.625
  157    HG   SER  22           HG       SER  22  13.092  -0.353   4.249
  158    H    TYR  23           H        TYR  23  10.883  -3.813   1.721
  159    HA   TYR  23           HA       TYR  23  10.269  -2.757  -0.847
  160    HB2  TYR  23           HB3      TYR  23  10.222  -5.183  -0.285
  161    HB3  TYR  23           HB2      TYR  23   8.750  -4.909   0.646
  162    HD1  TYR  23           HD1      TYR  23   6.642  -4.348  -0.444
  163    HD2  TYR  23           HD2      TYR  23  10.217  -5.019  -2.728
  164    HE1  TYR  23           HE1      TYR  23   5.288  -4.513  -2.515
  165    HE2  TYR  23           HE2      TYR  23   8.864  -5.184  -4.800
  166    HH   TYR  23           HH       TYR  23   5.329  -5.143  -4.691
  167    H    CYS  24           H        CYS  24   7.907  -3.366   1.780
  168    HA   CYS  24           HA       CYS  24   5.870  -1.753   0.560
  169    HB2  CYS  24           HB3      CYS  24   5.602  -3.537   2.408
  170    HB3  CYS  24           HB2      CYS  24   6.079  -2.262   3.530
  171    H    ASN  25           H        ASN  25   8.053  -1.096   3.302
  172    HA   ASN  25           HA       ASN  25   7.277   1.615   3.681
  173    HB2  ASN  25           HB3      ASN  25   9.978   0.317   4.164
  174    HB3  ASN  25           HB2      ASN  25   9.456   1.866   4.829
  175   HD21  ASN  25          HD22      ASN  25   6.796  -0.231   4.618
  176   HD22  ASN  25          HD21      ASN  25   6.797  -0.792   6.220
  177    H    GLY  26           H        GLY  26   9.607   0.117   1.488
  178    HA2  GLY  26           HA3      GLY  26  10.920   2.460   0.580
  179    HA3  GLY  26           HA2      GLY  26  10.704   1.004  -0.392
  180    H    VAL  27           H        VAL  27   7.896   0.925  -0.548
  181    HA   VAL  27           HA       VAL  27   7.413   2.785  -2.671
  182    HB   VAL  27           HB       VAL  27   5.436   1.218  -0.984
  183   HG11  VAL  27          HG11      VAL  27   4.132   2.858  -2.042
  184   HG12  VAL  27          HG12      VAL  27   4.089   1.532  -3.205
  185   HG13  VAL  27          HG13      VAL  27   5.170   2.900  -3.467
  186   HG21  VAL  27          HG21      VAL  27   7.130  -0.140  -2.224
  187   HG22  VAL  27          HG22      VAL  27   6.619   0.641  -3.721
  188   HG23  VAL  27          HG23      VAL  27   5.493  -0.384  -2.832
  189    H    CYS  28           H        CYS  28   6.445   2.767   0.752
  190    HA   CYS  28           HA       CYS  28   4.935   5.205   0.650
  191    HB2  CYS  28           HB3      CYS  28   6.379   3.782   2.897
  192    HB3  CYS  28           HB2      CYS  28   5.479   5.275   3.155
  193    H    THR  29           H        THR  29   8.368   4.514   0.976
  194    HA   THR  29           HA       THR  29   9.266   7.047   1.892
  195    HB   THR  29           HB       THR  29  10.663   5.223  -0.090
  196    HG1  THR  29           HG1      THR  29  11.639   4.516   1.991
  197   HG21  THR  29          HG21      THR  29  11.610   7.371   1.821
  198   HG22  THR  29          HG22      THR  29  11.805   7.324   0.068
  199   HG23  THR  29          HG23      THR  29  12.697   6.193   1.086
  200    H    LYS  30           H        LYS  30   8.838   5.862  -1.442
  201    HA   LYS  30           HA       LYS  30   9.571   8.323  -2.709
  202    HB2  LYS  30           HB3      LYS  30   7.797   6.046  -3.636
  203    HB3  LYS  30           HB2      LYS  30   8.343   7.362  -4.678
  204    HG2  LYS  30           HG3      LYS  30  10.396   6.449  -4.910
  205    HG3  LYS  30           HG2      LYS  30  10.544   6.175  -3.173
  206    HD2  LYS  30           HD3      LYS  30  10.588   4.034  -4.363
  207    HD3  LYS  30           HD2      LYS  30   9.123   4.154  -3.388
  208    HE2  LYS  30           HE3      LYS  30   7.747   4.392  -5.234
  209    HE3  LYS  30           HE2      LYS  30   9.015   5.131  -6.213
  210    HZ1  LYS  30           HZ1      LYS  30   9.388   2.361  -5.357
  211    HZ2  LYS  30           HZ2      LYS  30   9.873   3.125  -6.791
  212    HZ3  LYS  30           HZ3      LYS  30   8.251   2.658  -6.584
  213    H    ASN  31           H        ASN  31   6.454   7.004  -1.659
  214    HA   ASN  31           HA       ASN  31   4.819   9.121  -2.664
  215    HB2  ASN  31           HB3      ASN  31   4.061   6.861  -1.723
  216    HB3  ASN  31           HB2      ASN  31   4.277   7.572  -0.123
  217   HD21  ASN  31          HD22      ASN  31   1.804   7.175  -0.057
  218   HD22  ASN  31          HD21      ASN  31   0.807   8.397  -0.683
  219    H    GLY  32           H        GLY  32   6.792   8.795   0.217
  220    HA2  GLY  32           HA3      GLY  32   7.674  10.748   1.367
  221    HA3  GLY  32           HA2      GLY  32   6.261  11.659   0.828
  222    H    ALA  33           H        ALA  33   5.193   8.669   1.739
  223    HA   ALA  33           HA       ALA  33   3.837   9.655   4.071
  224    HB1  ALA  33           HB1      ALA  33   3.606   6.991   4.374
  225    HB2  ALA  33           HB2      ALA  33   4.099   7.037   2.681
  226    HB3  ALA  33           HB3      ALA  33   2.648   7.895   3.202
  227    H    LYS  34           H        LYS  34   4.175   9.023   6.288
  228    HA   LYS  34           HA       LYS  34   6.857   9.122   7.194
  229    HB2  LYS  34           HB3      LYS  34   4.787   9.637   8.546
  230    HB3  LYS  34           HB2      LYS  34   4.517   7.900   8.681
  231    HG2  LYS  34           HG3      LYS  34   7.065   7.941   9.482
  232    HG3  LYS  34           HG2      LYS  34   6.637   9.592   9.930
  233    HD2  LYS  34           HD3      LYS  34   5.079   7.123  10.752
  234    HD3  LYS  34           HD2      LYS  34   6.233   7.972  11.782
  235    HE2  LYS  34           HE3      LYS  34   4.638  10.038  10.945
  236    HE3  LYS  34           HE2      LYS  34   3.475   8.716  11.041
  237    HZ1  LYS  34           HZ1      LYS  34   4.377   8.255  13.299
  238    HZ2  LYS  34           HZ2      LYS  34   3.577   9.744  13.161
  239    HZ3  LYS  34           HZ3      LYS  34   5.275   9.692  13.188
  240    H    SER  35           H        SER  35   4.721   6.300   7.730
  241    HA   SER  35           HA       SER  35   6.910   4.528   6.807
  242    HB2  SER  35           HB3      SER  35   6.921   3.233   8.847
  243    HB3  SER  35           HB2      SER  35   7.181   4.920   9.281
  244    HG   SER  35           HG       SER  35   5.134   5.050  10.018
  245    H    GLY  36           H        GLY  36   6.121   2.189   6.819
  246    HA2  GLY  36           HA3      GLY  36   3.179   1.950   6.538
  247    HA3  GLY  36           HA2      GLY  36   4.180   1.501   5.157
  248    H    TYR  37           H        TYR  37   2.444  -0.247   6.810
  249    HA   TYR  37           HA       TYR  37   4.556  -2.124   7.814
  250    HB2  TYR  37           HB3      TYR  37   1.713  -1.849   8.830
  251    HB3  TYR  37           HB2      TYR  37   2.953  -2.927   9.469
  252    HD1  TYR  37           HD1      TYR  37   1.889   0.595   9.130
  253    HD2  TYR  37           HD2      TYR  37   4.768  -2.097  10.837
  254    HE1  TYR  37           HE1      TYR  37   2.713   2.411  10.604
  255    HE2  TYR  37           HE2      TYR  37   5.595  -0.280  12.309
  256    HH   TYR  37           HH       TYR  37   4.018   2.332  13.065
  257    H    CYS  38           H        CYS  38   4.492  -4.175   6.977
  258    HA   CYS  38           HA       CYS  38   2.221  -4.816   5.136
  259    HB2  CYS  38           HB3      CYS  38   4.715  -4.656   4.309
  260    HB3  CYS  38           HB2      CYS  38   4.860  -6.245   5.061
  261    H    GLN  39           H        GLN  39   0.847  -6.228   6.056
  262    HA   GLN  39           HA       GLN  39   1.994  -8.482   7.638
  263    HB2  GLN  39           HB3      GLN  39  -0.474  -6.854   8.322
  264    HB3  GLN  39           HB2      GLN  39   0.056  -8.303   9.180
  265    HG2  GLN  39           HG3      GLN  39   2.223  -7.191   9.677
  266    HG3  GLN  39           HG2      GLN  39   1.635  -5.730   8.886
  267   HE21  GLN  39          HE22      GLN  39  -1.106  -6.896  10.231
  268   HE22  GLN  39          HE21      GLN  39  -1.041  -6.147  11.753
  269    H    ILE  40           H        ILE  40   0.359 -10.347   7.743
  270    HA   ILE  40           HA       ILE  40  -0.975 -10.506   5.086
  271    HB   ILE  40           HB       ILE  40  -0.874 -12.940   5.381
  272   HG12  ILE  40          HG13      ILE  40   0.585 -12.287   7.964
  273   HG13  ILE  40          HG12      ILE  40  -1.053 -12.933   7.868
  274   HG21  ILE  40          HG21      ILE  40   1.780 -11.579   5.953
  275   HG22  ILE  40          HG22      ILE  40   1.035 -11.705   4.359
  276   HG23  ILE  40          HG23      ILE  40   1.565 -13.161   5.204
  277   HD11  ILE  40          HD11      ILE  40   0.197 -14.882   8.150
  278   HD12  ILE  40          HD12      ILE  40   1.548 -14.272   7.194
  279   HD13  ILE  40          HD13      ILE  40   0.067 -14.797   6.394
  280    H    LEU  41           H        LEU  41  -3.076 -11.190   4.871
  281    HA   LEU  41           HA       LEU  41  -4.697 -11.182   7.357
  282    HB2  LEU  41           HB3      LEU  41  -5.527 -10.602   4.503
  283    HB3  LEU  41           HB2      LEU  41  -6.536 -10.463   5.931
  284    HG   LEU  41           HG       LEU  41  -4.043  -8.850   5.349
  285   HD11  LEU  41          HD11      LEU  41  -5.631  -7.731   4.125
  286   HD12  LEU  41          HD12      LEU  41  -6.018  -7.051   5.705
  287   HD13  LEU  41          HD13      LEU  41  -6.970  -8.390   5.066
  288   HD21  LEU  41          HD21      LEU  41  -5.076  -7.601   7.452
  289   HD22  LEU  41          HD22      LEU  41  -4.002  -8.982   7.669
  290   HD23  LEU  41          HD23      LEU  41  -5.749  -9.196   7.791
  291    H    GLY  42           H        GLY  42  -6.121 -12.914   7.697
  292    HA2  GLY  42           HA3      GLY  42  -5.492 -15.444   6.619
  293    HA3  GLY  42           HA2      GLY  42  -7.019 -15.064   7.415
  294    H    THR  43           H        THR  43  -7.676 -12.957   5.417
  295    HA   THR  43           HA       THR  43  -8.756 -14.790   3.372
  296    HB   THR  43           HB       THR  43  -9.310 -11.869   3.947
  297    HG1  THR  43           HG1      THR  43 -10.041 -13.941   5.233
  298   HG21  THR  43          HG21      THR  43  -9.904 -12.005   1.718
  299   HG22  THR  43          HG22      THR  43 -11.388 -12.603   2.460
  300   HG23  THR  43          HG23      THR  43 -10.213 -13.740   1.798
  301    H    TYR  44           H        TYR  44  -7.622 -11.428   3.016
  302    HA   TYR  44           HA       TYR  44  -6.842 -11.768   0.300
  303    HB2  TYR  44           HB3      TYR  44  -5.903  -9.743   2.350
  304    HB3  TYR  44           HB2      TYR  44  -5.604  -9.626   0.615
  305    HD1  TYR  44           HD2      TYR  44  -7.496  -9.342  -0.972
  306    HD2  TYR  44           HD1      TYR  44  -8.079  -9.288   3.284
  307    HE1  TYR  44           HE2      TYR  44  -9.735  -8.326  -1.291
  308    HE2  TYR  44           HE1      TYR  44 -10.318  -8.271   2.965
  309    HH   TYR  44           HH       TYR  44 -11.928  -8.247   0.069
  310    H    GLY  45           H        GLY  45  -4.925 -11.998   3.295
  311    HA2  GLY  45           HA3      GLY  45  -3.038 -13.500   3.492
  312    HA3  GLY  45           HA2      GLY  45  -2.888 -13.494   1.736
  313    H    ASN  46           H        ASN  46  -3.090 -10.534   1.570
  314    HA   ASN  46           HA       ASN  46  -0.620  -9.704   2.986
  315    HB2  ASN  46           HB3      ASN  46   0.009 -10.532   0.713
  316    HB3  ASN  46           HB2      ASN  46  -1.040  -9.295   0.017
  317   HD21  ASN  46          HD22      ASN  46   1.715  -9.588   2.333
  318   HD22  ASN  46          HD21      ASN  46   2.409  -8.095   1.920
  319    H    GLY  47           H        GLY  47  -0.949  -7.745   3.908
  320    HA2  GLY  47           HA3      GLY  47  -2.722  -5.796   2.524
  321    HA3  GLY  47           HA2      GLY  47  -3.059  -6.193   4.211
  322    H    CYS  48           H        CYS  48  -1.357  -4.088   2.207
  323    HA   CYS  48           HA       CYS  48   0.574  -3.419   4.386
  324    HB2  CYS  48           HB3      CYS  48   0.889  -3.652   1.551
  325    HB3  CYS  48           HB2      CYS  48   1.147  -1.965   1.997
  326    H    TRP  49           H        TRP  49  -0.081  -1.697   5.606
  327    HA   TRP  49           HA       TRP  49  -1.804   0.346   4.280
  328    HB2  TRP  49           HB3      TRP  49  -1.909   0.948   6.959
  329    HB3  TRP  49           HB2      TRP  49  -3.103  -0.018   6.100
  330    HD1  TRP  49           HD1      TRP  49   0.065  -0.409   8.222
  331    HE1  TRP  49           HE1      TRP  49   0.030  -2.738   9.327
  332    HE3  TRP  49           HE3      TRP  49  -4.115  -2.361   6.035
  333    HZ2  TRP  49           HZ2      TRP  49  -1.567  -5.105   9.289
  334    HZ3  TRP  49           HZ3      TRP  49  -4.870  -4.651   6.591
  335    HH2  TRP  49           HH2      TRP  49  -3.602  -6.027   8.216
  336    H    CYS  50           H        CYS  50  -1.031   2.363   4.014
  337    HA   CYS  50           HA       CYS  50   1.641   2.979   5.198
  338    HB2  CYS  50           HB3      CYS  50   1.194   3.029   2.632
  339    HB3  CYS  50           HB2      CYS  50   0.326   4.528   2.964
  340    H    ILE  51           H        ILE  51   1.610   4.407   6.872
  341    HA   ILE  51           HA       ILE  51  -0.783   6.165   7.150
  342    HB   ILE  51           HB       ILE  51   1.123   5.196   9.292
  343   HG12  ILE  51          HG13      ILE  51  -1.699   4.301   8.623
  344   HG13  ILE  51          HG12      ILE  51  -0.241   3.387   8.237
  345   HG21  ILE  51          HG21      ILE  51  -1.434   5.973  10.268
  346   HG22  ILE  51          HG22      ILE  51  -0.861   7.269   9.218
  347   HG23  ILE  51          HG23      ILE  51   0.122   6.741  10.584
  348   HD11  ILE  51          HD11      ILE  51  -0.871   2.428  10.266
  349   HD12  ILE  51          HD12      ILE  51  -1.459   3.958  10.920
  350   HD13  ILE  51          HD13      ILE  51   0.275   3.661  10.795
  351    H    ALA  52           H        ALA  52  -0.500   8.332   7.165
  352    HA   ALA  52           HA       ALA  52   1.858   9.675   8.086
  353    HB1  ALA  52           HB1      ALA  52   2.556   8.568   5.825
  354    HB2  ALA  52           HB2      ALA  52   2.966  10.261   6.103
  355    HB3  ALA  52           HB3      ALA  52   1.581   9.843   5.096
  356    H    LEU  53           H        LEU  53  -0.556  10.020   5.472
  357    HA   LEU  53           HA       LEU  53  -1.463  12.546   6.789
  358    HB2  LEU  53           HB3      LEU  53  -0.064  12.676   4.557
  359    HB3  LEU  53           HB2      LEU  53  -1.598  12.224   3.812
  360    HG   LEU  53           HG       LEU  53  -2.455  14.158   5.505
  361   HD11  LEU  53          HD11      LEU  53  -0.843  16.020   5.427
  362   HD12  LEU  53          HD12      LEU  53   0.329  14.979   4.619
  363   HD13  LEU  53          HD13      LEU  53  -0.155  14.638   6.280
  364   HD21  LEU  53          HD21      LEU  53  -2.010  15.706   3.411
  365   HD22  LEU  53          HD22      LEU  53  -3.118  14.341   3.278
  366   HD23  LEU  53          HD23      LEU  53  -1.469  14.201   2.670
  367    HA   PRO  54           HA       PRO  54  -5.056   9.705   6.170
  368    HB2  PRO  54           HB2      PRO  54  -6.250  10.243   8.578
  369    HB3  PRO  54           HB3      PRO  54  -5.029   8.982   8.341
  370    HG2  PRO  54           HG3      PRO  54  -4.776  11.643   9.588
  371    HG3  PRO  54           HG2      PRO  54  -3.891  10.146   9.916
  372    HD2  PRO  54           HD3      PRO  54  -2.921  12.316   8.447
  373    HD3  PRO  54           HD2      PRO  54  -2.240  10.675   8.426
  374    H    ASP  55           H        ASP  55  -4.736  13.074   6.720
  375    HA   ASP  55           HA       ASP  55  -7.435  13.924   6.834
  376    HB2  ASP  55           HB3      ASP  55  -5.388  15.382   7.090
  377    HB3  ASP  55           HB2      ASP  55  -5.209  15.331   5.336
  378    H    ASN  56           H        ASN  56  -5.441  13.013   4.038
  379    HA   ASN  56           HA       ASN  56  -7.330  13.852   2.044
  380    HB2  ASN  56           HB3      ASN  56  -5.159  11.742   1.949
  381    HB3  ASN  56           HB2      ASN  56  -6.053  12.315   0.540
  382   HD21  ASN  56          HD22      ASN  56  -3.219  12.679   0.739
  383   HD22  ASN  56          HD21      ASN  56  -2.903  14.340   0.896
  384    H    VAL  57           H        VAL  57  -6.834  10.755   3.712
  385    HA   VAL  57           HA       VAL  57  -8.034   8.717   3.456
  386    HB   VAL  57           HB       VAL  57 -10.600   9.386   3.943
  387   HG11  VAL  57          HG11      VAL  57  -9.533   8.148   5.591
  388   HG12  VAL  57          HG12      VAL  57  -9.705   9.698   6.413
  389   HG13  VAL  57          HG13      VAL  57  -8.163   9.255   5.681
  390   HG21  VAL  57          HG21      VAL  57 -10.195  11.798   3.573
  391   HG22  VAL  57          HG22      VAL  57  -8.960  11.779   4.831
  392   HG23  VAL  57          HG23      VAL  57 -10.645  11.481   5.246
  393    HA   PRO  58           HA       PRO  58  -9.616   9.634  -0.827
  394    HB2  PRO  58           HB2      PRO  58  -7.800   8.175  -2.216
  395    HB3  PRO  58           HB3      PRO  58  -7.490   9.846  -1.708
  396    HG2  PRO  58           HG3      PRO  58  -6.515   7.297  -0.534
  397    HG3  PRO  58           HG2      PRO  58  -5.687   8.853  -0.709
  398    HD2  PRO  58           HD3      PRO  58  -6.848   7.948   1.650
  399    HD3  PRO  58           HD2      PRO  58  -6.510   9.653   1.281
  400    H    ILE  59           H        ILE  59  -8.044   6.444  -0.335
  401    HA   ILE  59           HA       ILE  59  -8.893   4.305  -0.898
  402    HB   ILE  59           HB       ILE  59 -11.133   5.456   0.796
  403   HG12  ILE  59          HG13      ILE  59  -8.749   3.758   1.596
  404   HG13  ILE  59          HG12      ILE  59  -8.812   5.511   1.783
  405   HG21  ILE  59          HG21      ILE  59 -12.121   3.504   0.117
  406   HG22  ILE  59          HG22      ILE  59 -11.067   2.800   1.343
  407   HG23  ILE  59          HG23      ILE  59 -10.587   2.774  -0.354
  408   HD11  ILE  59          HD11      ILE  59 -11.161   4.088   2.858
  409   HD12  ILE  59          HD12      ILE  59 -10.212   5.393   3.570
  410   HD13  ILE  59          HD13      ILE  59  -9.648   3.727   3.687
  411    H    ARG  60           H        ARG  60  -9.204   5.631  -3.146
  412    HA   ARG  60           HA       ARG  60 -11.775   6.314  -4.064
  413    HB2  ARG  60           HB3      ARG  60 -10.919   5.994  -6.305
  414    HB3  ARG  60           HB2      ARG  60  -9.620   6.657  -5.313
  415    HG2  ARG  60           HG3      ARG  60  -8.811   4.300  -4.933
  416    HG3  ARG  60           HG2      ARG  60 -10.006   3.760  -6.115
  417    HD2  ARG  60           HD3      ARG  60  -7.756   5.728  -6.622
  418    HD3  ARG  60           HD2      ARG  60  -7.840   4.069  -7.216
  419    HE   ARG  60           HE       ARG  60 -10.155   5.610  -8.031
  420   HH11  ARG  60          HH22      ARG  60  -6.825   4.939  -8.622
  421   HH12  ARG  60          HH21      ARG  60  -6.902   5.355 -10.302
  422   HH21  ARG  60          HH11      ARG  60 -10.275   6.155 -10.221
  423   HH22  ARG  60          HH12      ARG  60  -8.855   6.044 -11.207
  424    H    ILE  61           H        ILE  61 -10.244   3.126  -3.851
  425    HA   ILE  61           HA       ILE  61 -12.686   1.890  -4.989
  426    HB   ILE  61           HB       ILE  61 -11.157  -0.241  -4.470
  427   HG12  ILE  61          HG13      ILE  61  -8.776   0.324  -4.732
  428   HG13  ILE  61          HG12      ILE  61  -9.173   2.042  -4.754
  429   HG21  ILE  61          HG21      ILE  61 -10.948   1.759  -6.720
  430   HG22  ILE  61          HG22      ILE  61 -11.809   0.220  -6.699
  431   HG23  ILE  61          HG23      ILE  61 -10.046   0.244  -6.749
  432   HD11  ILE  61          HD11      ILE  61  -9.709   2.084  -2.487
  433   HD12  ILE  61          HD12      ILE  61  -8.413   0.889  -2.503
  434   HD13  ILE  61          HD13      ILE  61 -10.095   0.364  -2.443
  435    HA   PRO  62           HA       PRO  62 -14.421   0.792  -1.087
  436    HB2  PRO  62           HB2      PRO  62 -15.292  -1.788  -1.618
  437    HB3  PRO  62           HB3      PRO  62 -16.158  -0.313  -2.083
  438    HG2  PRO  62           HG3      PRO  62 -14.424  -2.086  -3.715
  439    HG3  PRO  62           HG2      PRO  62 -15.891  -1.203  -4.171
  440    HD2  PRO  62           HD3      PRO  62 -13.401  -0.353  -4.873
  441    HD3  PRO  62           HD2      PRO  62 -14.744   0.772  -4.567
  442    H    GLY  63           H        GLY  63 -11.935  -1.199  -2.476
  443    HA2  GLY  63           HA3      GLY  63 -10.274  -1.608  -0.409
  444    HA3  GLY  63           HA2      GLY  63 -11.559  -2.740   0.013
  445    H    LYS  64           H        LYS  64 -11.138  -2.260  -3.346
  446    HA   LYS  64           HA       LYS  64 -10.051  -4.995  -3.592
  447    HB2  LYS  64           HB3      LYS  64 -11.157  -3.068  -5.657
  448    HB3  LYS  64           HB2      LYS  64 -10.601  -4.704  -6.011
  449    HG2  LYS  64           HG3      LYS  64 -12.274  -5.617  -4.443
  450    HG3  LYS  64           HG2      LYS  64 -12.833  -3.982  -4.089
  451    HD2  LYS  64           HD3      LYS  64 -14.318  -4.944  -5.747
  452    HD3  LYS  64           HD2      LYS  64 -13.350  -3.696  -6.531
  453    HE2  LYS  64           HE3      LYS  64 -12.054  -5.241  -7.697
  454    HE3  LYS  64           HE2      LYS  64 -12.359  -6.530  -6.531
  455    HZ1  LYS  64           HZ1      LYS  64 -14.563  -6.775  -7.324
  456    HZ2  LYS  64           HZ2      LYS  64 -13.555  -6.765  -8.686
  457    HZ3  LYS  64           HZ3      LYS  64 -14.454  -5.380  -8.288
  458    H    CYS  65           H        CYS  65  -8.199  -5.404  -4.994
  459    HA   CYS  65           HA       CYS  65  -5.966  -3.749  -4.511
  460    HB2  CYS  65           HB3      CYS  65  -6.023  -6.174  -5.357
  461    HB3  CYS  65           HB2      CYS  65  -6.244  -5.487  -6.965
  462    H    HIS  66           H        HIS  66  -8.261  -3.742  -7.208
  463    HA   HIS  66           HA       HIS  66  -7.390  -1.014  -7.893
  464    HB2  HIS  66           HB3      HIS  66  -5.890  -2.524  -9.217
  465    HB3  HIS  66           HB2      HIS  66  -7.322  -3.218  -9.975
  466    HD1  HIS  66           HD1      HIS  66  -5.880   0.282  -9.419
  467    HD2  HIS  66           HD2      HIS  66  -8.003  -1.878 -12.288
  468    HE1  HIS  66           HE1      HIS  66  -6.198   1.835 -11.397
  469    HE2  HIS  66           HE2      HIS  66  -7.488   0.529 -13.148
  Start of MODEL    8
    1    H1   ALA   1           H1       ALA   1  -3.149  12.165   2.909
    2    H2   ALA   1           H2       ALA   1  -2.206  11.772   1.552
    3    H3   ALA   1           H3       ALA   1  -1.789  11.168   3.084
    4    HA   ALA   1           HA       ALA   1  -4.463  10.470   2.397
    5    HB1  ALA   1           HB1      ALA   1  -2.233   9.488   0.589
    6    HB2  ALA   1           HB2      ALA   1  -3.532  10.575   0.098
    7    HB3  ALA   1           HB3      ALA   1  -3.901   8.917   0.577
    8    H    ARG   2           H        ARG   2  -4.698   8.109   2.863
    9    HA   ARG   2           HA       ARG   2  -2.451   7.065   4.541
   10    HB2  ARG   2           HB3      ARG   2  -4.305   7.960   5.948
   11    HB3  ARG   2           HB2      ARG   2  -5.413   6.838   5.158
   12    HG2  ARG   2           HG3      ARG   2  -4.062   4.936   5.952
   13    HG3  ARG   2           HG2      ARG   2  -2.945   6.054   6.735
   14    HD2  ARG   2           HD3      ARG   2  -4.486   5.261   8.419
   15    HD3  ARG   2           HD2      ARG   2  -4.890   6.942   8.069
   16    HE   ARG   2           HE       ARG   2  -6.943   6.206   7.150
   17   HH11  ARG   2          HH22      ARG   2  -4.691   3.633   7.591
   18   HH12  ARG   2          HH21      ARG   2  -5.840   2.388   7.230
   19   HH21  ARG   2          HH11      ARG   2  -8.457   4.596   6.677
   20   HH22  ARG   2          HH12      ARG   2  -7.972   2.933   6.712
   21    H    ASP   3           H        ASP   3  -1.945   4.933   4.149
   22    HA   ASP   3           HA       ASP   3  -3.540   3.544   2.067
   23    HB2  ASP   3           HB3      ASP   3  -0.795   2.978   3.220
   24    HB3  ASP   3           HB2      ASP   3  -1.574   1.995   1.983
   25    H    ALA   4           H        ALA   4  -4.395   1.452   2.432
   26    HA   ALA   4           HA       ALA   4  -4.539   0.654   5.307
   27    HB1  ALA   4           HB1      ALA   4  -6.526   0.518   3.052
   28    HB2  ALA   4           HB2      ALA   4  -6.747   1.149   4.684
   29    HB3  ALA   4           HB3      ALA   4  -6.657  -0.591   4.417
   30    H    TYR   5           H        TYR   5  -5.674  -1.381   2.708
   31    HA   TYR   5           HA       TYR   5  -3.573  -3.355   3.448
   32    HB2  TYR   5           HB3      TYR   5  -6.105  -3.716   1.812
   33    HB3  TYR   5           HB2      TYR   5  -5.023  -5.003   2.339
   34    HD1  TYR   5           HD2      TYR   5  -4.762  -5.496   4.783
   35    HD2  TYR   5           HD1      TYR   5  -7.709  -2.743   3.302
   36    HE1  TYR   5           HE2      TYR   5  -5.971  -5.627   6.944
   37    HE2  TYR   5           HE1      TYR   5  -8.918  -2.874   5.463
   38    HH   TYR   5           HH       TYR   5  -8.183  -3.459   7.946
   39    H    ILE   6           H        ILE   6  -3.778  -0.925   1.364
   40    HA   ILE   6           HA       ILE   6  -2.504  -2.431  -0.876
   41    HB   ILE   6           HB       ILE   6  -3.247  -0.596  -2.340
   42   HG12  ILE   6          HG13      ILE   6  -4.619   0.472   0.146
   43   HG13  ILE   6          HG12      ILE   6  -3.196   1.191  -0.607
   44   HG21  ILE   6          HG21      ILE   6  -5.246  -1.616  -2.624
   45   HG22  ILE   6          HG22      ILE   6  -5.808  -1.119  -1.027
   46   HG23  ILE   6          HG23      ILE   6  -4.829  -2.575  -1.204
   47   HD11  ILE   6          HD11      ILE   6  -4.969   2.433  -1.528
   48   HD12  ILE   6          HD12      ILE   6  -6.002   1.013  -1.685
   49   HD13  ILE   6          HD13      ILE   6  -4.631   1.230  -2.772
   50    H    ALA   7           H        ALA   7  -0.686  -1.367  -1.913
   51    HA   ALA   7           HA       ALA   7   0.713   0.543  -0.089
   52    HB1  ALA   7           HB1      ALA   7   1.681  -1.836  -0.656
   53    HB2  ALA   7           HB2      ALA   7   2.755  -0.439  -0.664
   54    HB3  ALA   7           HB3      ALA   7   2.130  -1.078  -2.184
   55    H    LYS   8           H        LYS   8  -1.083   0.546  -2.765
   56    HA   LYS   8           HA       LYS   8   0.535   2.679  -4.083
   57    HB2  LYS   8           HB3      LYS   8  -1.495   1.554  -5.814
   58    HB3  LYS   8           HB2      LYS   8   0.239   1.685  -6.088
   59    HG2  LYS   8           HG3      LYS   8  -0.973  -0.494  -4.360
   60    HG3  LYS   8           HG2      LYS   8  -0.704  -0.682  -6.088
   61    HD2  LYS   8           HD3      LYS   8   1.576   0.318  -4.440
   62    HD3  LYS   8           HD2      LYS   8   1.167  -1.396  -4.337
   63    HE2  LYS   8           HE3      LYS   8   1.344  -1.606  -6.773
   64    HE3  LYS   8           HE2      LYS   8   1.684   0.118  -6.914
   65    HZ1  LYS   8           HZ1      LYS   8   3.810  -0.286  -6.516
   66    HZ2  LYS   8           HZ2      LYS   8   3.491  -1.950  -6.448
   67    HZ3  LYS   8           HZ3      LYS   8   3.434  -1.016  -5.029
   68    HA   PRO   9           HA       PRO   9  -2.967   5.296  -3.484
   69    HB2  PRO   9           HB2      PRO   9  -2.981   6.849  -5.720
   70    HB3  PRO   9           HB3      PRO   9  -1.738   6.985  -4.461
   71    HG2  PRO   9           HG3      PRO   9  -1.605   5.670  -7.118
   72    HG3  PRO   9           HG2      PRO   9  -0.360   6.565  -6.234
   73    HD2  PRO   9           HD3      PRO   9  -0.500   3.800  -6.368
   74    HD3  PRO   9           HD2      PRO   9   0.341   4.703  -5.091
   75    H    HIS  10           H        HIS  10  -3.033   4.462  -6.973
   76    HA   HIS  10           HA       HIS  10  -5.964   4.001  -6.701
   77    HB2  HIS  10           HB3      HIS  10  -4.278   4.482  -9.175
   78    HB3  HIS  10           HB2      HIS  10  -6.028   4.266  -9.160
   79    HD1  HIS  10           HD1      HIS  10  -3.336   6.729  -8.318
   80    HD2  HIS  10           HD2      HIS  10  -7.494   6.479  -8.074
   81    HE1  HIS  10           HE1      HIS  10  -4.167   9.068  -7.809
   82    HE2  HIS  10           HE2      HIS  10  -6.696   8.927  -7.658
   83    H    ASN  11           H        ASN  11  -3.066   2.320  -6.862
   84    HA   ASN  11           HA       ASN  11  -4.395  -0.053  -8.113
   85    HB2  ASN  11           HB3      ASN  11  -1.434   0.554  -7.846
   86    HB3  ASN  11           HB2      ASN  11  -2.131  -0.863  -8.630
   87   HD21  ASN  11          HD22      ASN  11  -1.474   2.565  -8.999
   88   HD22  ASN  11          HD21      ASN  11  -2.021   2.693 -10.600
   89    H    CYS  12           H        CYS  12  -3.691  -2.171  -7.151
   90    HA   CYS  12           HA       CYS  12  -3.361  -1.901  -4.194
   91    HB2  CYS  12           HB3      CYS  12  -4.514  -4.288  -5.643
   92    HB3  CYS  12           HB2      CYS  12  -4.662  -3.881  -3.934
   93    H    VAL  13           H        VAL  13  -2.431  -4.124  -3.295
   94    HA   VAL  13           HA       VAL  13   0.056  -4.639  -4.856
   95    HB   VAL  13           HB       VAL  13  -0.566  -5.313  -1.964
   96   HG11  VAL  13          HG11      VAL  13   1.910  -5.545  -1.825
   97   HG12  VAL  13          HG12      VAL  13   2.011  -5.269  -3.564
   98   HG13  VAL  13          HG13      VAL  13   1.195  -6.704  -2.945
   99   HG21  VAL  13          HG21      VAL  13   1.414  -3.233  -2.451
  100   HG22  VAL  13          HG22      VAL  13   0.002  -3.203  -1.394
  101   HG23  VAL  13          HG23      VAL  13  -0.164  -2.786  -3.100
  102    H    TYR  14           H        TYR  14   0.373  -6.623  -5.760
  103    HA   TYR  14           HA       TYR  14  -1.755  -8.602  -5.662
  104    HB2  TYR  14           HB3      TYR  14  -0.440  -9.837  -7.241
  105    HB3  TYR  14           HB2      TYR  14  -0.238  -8.136  -7.653
  106    HD1  TYR  14           HD2      TYR  14   1.832  -6.915  -6.939
  107    HD2  TYR  14           HD1      TYR  14   1.405 -11.164  -6.481
  108    HE1  TYR  14           HE2      TYR  14   4.285  -7.129  -6.644
  109    HE2  TYR  14           HE1      TYR  14   3.858 -11.379  -6.187
  110    HH   TYR  14           HH       TYR  14   5.770  -9.533  -5.302
  111    H    GLU  15           H        GLU  15   1.443  -8.256  -4.224
  112    HA   GLU  15           HA       GLU  15   0.815  -9.962  -2.010
  113    HB2  GLU  15           HB3      GLU  15   1.064 -11.701  -3.817
  114    HB3  GLU  15           HB2      GLU  15   2.732 -11.169  -4.028
  115    HG2  GLU  15           HG3      GLU  15   3.159 -11.660  -1.622
  116    HG3  GLU  15           HG2      GLU  15   1.517 -12.291  -1.488
  117    H    CYS  16           H        CYS  16   1.804  -8.383  -0.744
  118    HA   CYS  16           HA       CYS  16   4.287  -7.120  -1.415
  119    HB2  CYS  16           HB3      CYS  16   3.381  -5.836   0.222
  120    HB3  CYS  16           HB2      CYS  16   2.462  -7.186   0.889
  121    H    PHE  17           H        PHE  17   6.115  -8.303  -1.676
  122    HA   PHE  17           HA       PHE  17   6.634 -10.832  -0.462
  123    HB2  PHE  17           HB3      PHE  17   8.079 -10.585  -2.213
  124    HB3  PHE  17           HB2      PHE  17   8.156  -8.833  -2.028
  125    HD1  PHE  17           HD1      PHE  17   9.380 -12.051  -0.597
  126    HD2  PHE  17           HD2      PHE  17   9.935  -7.799  -0.848
  127    HE1  PHE  17           HE1      PHE  17  11.567 -12.268   0.554
  128    HE2  PHE  17           HE2      PHE  17  12.119  -8.015   0.304
  129    HZ   PHE  17           HZ       PHE  17  12.936 -10.250   1.005
  130    H    ASP  18           H        ASP  18   8.373 -11.254   1.191
  131    HA   ASP  18           HA       ASP  18   7.909 -10.054   3.643
  132    HB2  ASP  18           HB3      ASP  18   9.353 -12.069   3.283
  133    HB3  ASP  18           HB2      ASP  18  10.636 -11.003   2.709
  134    H    ALA  19           H        ALA  19   7.854  -7.873   3.944
  135    HA   ALA  19           HA       ALA  19   9.933  -6.186   2.675
  136    HB1  ALA  19           HB1      ALA  19   7.385  -5.510   4.169
  137    HB2  ALA  19           HB2      ALA  19   7.667  -5.372   2.434
  138    HB3  ALA  19           HB3      ALA  19   8.510  -4.299   3.554
  139    H    PHE  20           H        PHE  20  10.544  -7.982   4.969
  140    HA   PHE  20           HA       PHE  20  10.708  -6.618   7.429
  141    HB2  PHE  20           HB3      PHE  20  11.371  -9.005   7.060
  142    HB3  PHE  20           HB2      PHE  20  12.831  -8.438   6.252
  143    HD1  PHE  20           HD1      PHE  20  11.008  -8.522   9.477
  144    HD2  PHE  20           HD2      PHE  20  14.685  -7.532   7.490
  145    HE1  PHE  20           HE1      PHE  20  12.126  -8.259  11.676
  146    HE2  PHE  20           HE2      PHE  20  15.803  -7.270   9.688
  147    HZ   PHE  20           HZ       PHE  20  14.523  -7.633  11.782
  148    H    SER  21           H        SER  21  12.993  -6.559   4.679
  149    HA   SER  21           HA       SER  21  14.827  -4.724   5.899
  150    HB2  SER  21           HB3      SER  21  14.250  -5.077   2.945
  151    HB3  SER  21           HB2      SER  21  15.710  -4.393   3.652
  152    HG   SER  21           HG       SER  21  15.026  -6.863   4.636
  153    H    SER  22           H        SER  22  12.149  -4.209   3.602
  154    HA   SER  22           HA       SER  22  10.864  -2.045   4.577
  155    HB2  SER  22           HB3      SER  22  13.576  -1.184   3.640
  156    HB3  SER  22           HB2      SER  22  12.214  -0.110   3.344
  157    HG   SER  22           HG       SER  22  13.094   0.350   5.356
  158    H    TYR  23           H        TYR  23  10.981  -4.126   2.370
  159    HA   TYR  23           HA       TYR  23  10.886  -2.883  -0.181
  160    HB2  TYR  23           HB3      TYR  23  10.880  -5.356   0.211
  161    HB3  TYR  23           HB2      TYR  23   9.204  -5.227   0.744
  162    HD1  TYR  23           HD1      TYR  23  11.493  -4.854  -2.140
  163    HD2  TYR  23           HD2      TYR  23   7.406  -4.851  -0.818
  164    HE1  TYR  23           HE1      TYR  23  10.730  -4.938  -4.498
  165    HE2  TYR  23           HE2      TYR  23   6.643  -4.936  -3.177
  166    HH   TYR  23           HH       TYR  23   7.345  -5.398  -5.319
  167    H    CYS  24           H        CYS  24   8.115  -3.716   1.933
  168    HA   CYS  24           HA       CYS  24   6.234  -2.210   0.352
  169    HB2  CYS  24           HB3      CYS  24   5.442  -3.967   1.845
  170    HB3  CYS  24           HB2      CYS  24   6.105  -3.122   3.243
  171    H    ASN  25           H        ASN  25   8.092  -1.488   3.286
  172    HA   ASN  25           HA       ASN  25   7.011   1.094   3.794
  173    HB2  ASN  25           HB3      ASN  25   9.861   0.149   4.244
  174    HB3  ASN  25           HB2      ASN  25   9.076   1.510   5.048
  175   HD21  ASN  25          HD22      ASN  25   6.886  -1.065   4.501
  176   HD22  ASN  25          HD21      ASN  25   6.934  -1.744   6.056
  177    H    GLY  26           H        GLY  26   9.612   0.001   1.663
  178    HA2  GLY  26           HA3      GLY  26  10.535   2.582   0.857
  179    HA3  GLY  26           HA2      GLY  26  10.727   1.100  -0.082
  180    H    VAL  27           H        VAL  27   7.952   0.473  -0.382
  181    HA   VAL  27           HA       VAL  27   7.319   1.989  -2.705
  182    HB   VAL  27           HB       VAL  27   5.564   0.308  -0.896
  183   HG11  VAL  27          HG11      VAL  27   4.136   0.281  -3.086
  184   HG12  VAL  27          HG12      VAL  27   4.983   1.782  -3.457
  185   HG13  VAL  27          HG13      VAL  27   3.997   1.664  -1.999
  186   HG21  VAL  27          HG21      VAL  27   7.575  -0.341  -2.760
  187   HG22  VAL  27          HG22      VAL  27   6.050  -0.653  -3.589
  188   HG23  VAL  27          HG23      VAL  27   6.395  -1.444  -2.051
  189    H    CYS  28           H        CYS  28   6.011   2.220   0.608
  190    HA   CYS  28           HA       CYS  28   4.354   4.510  -0.016
  191    HB2  CYS  28           HB3      CYS  28   5.146   3.037   2.442
  192    HB3  CYS  28           HB2      CYS  28   4.652   4.717   2.659
  193    H    THR  29           H        THR  29   7.669   4.077   1.070
  194    HA   THR  29           HA       THR  29   8.259   6.657   2.022
  195    HB   THR  29           HB       THR  29  10.050   4.958   0.258
  196    HG1  THR  29           HG1      THR  29  10.644   4.617   2.761
  197   HG21  THR  29          HG21      THR  29  11.521   6.623   0.611
  198   HG22  THR  29          HG22      THR  29  11.473   6.230   2.329
  199   HG23  THR  29          HG23      THR  29  10.390   7.458   1.675
  200    H    LYS  30           H        LYS  30   8.385   5.461  -1.330
  201    HA   LYS  30           HA       LYS  30   9.095   7.983  -2.498
  202    HB2  LYS  30           HB3      LYS  30   7.717   5.528  -3.619
  203    HB3  LYS  30           HB2      LYS  30   8.183   6.913  -4.611
  204    HG2  LYS  30           HG3      LYS  30  10.373   6.336  -4.582
  205    HG3  LYS  30           HG2      LYS  30  10.339   5.983  -2.854
  206    HD2  LYS  30           HD3      LYS  30   9.609   3.776  -3.188
  207    HD3  LYS  30           HD2      LYS  30   9.041   4.112  -4.826
  208    HE2  LYS  30           HE3      LYS  30  11.246   4.194  -5.692
  209    HE3  LYS  30           HE2      LYS  30  11.959   4.350  -4.087
  210    HZ1  LYS  30           HZ1      LYS  30  10.711   1.963  -5.309
  211    HZ2  LYS  30           HZ2      LYS  30  10.966   2.085  -3.637
  212    HZ3  LYS  30           HZ3      LYS  30  12.289   2.132  -4.702
  213    H    ASN  31           H        ASN  31   6.006   6.432  -1.769
  214    HA   ASN  31           HA       ASN  31   4.287   8.290  -3.070
  215    HB2  ASN  31           HB3      ASN  31   3.659   6.062  -1.969
  216    HB3  ASN  31           HB2      ASN  31   3.671   6.935  -0.435
  217   HD21  ASN  31          HD22      ASN  31   1.221   5.987  -0.973
  218   HD22  ASN  31          HD21      ASN  31   0.186   7.175  -1.603
  219    H    GLY  32           H        GLY  32   6.080   8.457  -0.075
  220    HA2  GLY  32           HA3      GLY  32   6.667  10.653   0.845
  221    HA3  GLY  32           HA2      GLY  32   5.108  11.256   0.276
  222    H    ALA  33           H        ALA  33   4.514   8.237   1.440
  223    HA   ALA  33           HA       ALA  33   3.101   9.186   3.749
  224    HB1  ALA  33           HB1      ALA  33   3.760   6.379   3.957
  225    HB2  ALA  33           HB2      ALA  33   3.282   6.766   2.305
  226    HB3  ALA  33           HB3      ALA  33   2.193   7.126   3.646
  227    H    LYS  34           H        LYS  34   3.668   9.046   5.961
  228    HA   LYS  34           HA       LYS  34   6.409   9.436   6.620
  229    HB2  LYS  34           HB3      LYS  34   4.454  10.153   8.024
  230    HB3  LYS  34           HB2      LYS  34   4.226   8.466   8.483
  231    HG2  LYS  34           HG3      LYS  34   6.918   8.835   8.953
  232    HG3  LYS  34           HG2      LYS  34   6.241  10.398   9.406
  233    HD2  LYS  34           HD3      LYS  34   5.202   7.726  10.400
  234    HD3  LYS  34           HD2      LYS  34   6.292   8.776  11.308
  235    HE2  LYS  34           HE3      LYS  34   4.239  10.484  10.509
  236    HE3  LYS  34           HE2      LYS  34   3.406   8.992  10.943
  237    HZ1  LYS  34           HZ1      LYS  34   5.001  10.786  12.612
  238    HZ2  LYS  34           HZ2      LYS  34   5.057   9.128  12.966
  239    HZ3  LYS  34           HZ3      LYS  34   3.570   9.948  12.979
  240    H    SER  35           H        SER  35   4.342   6.559   7.222
  241    HA   SER  35           HA       SER  35   6.789   4.897   6.999
  242    HB2  SER  35           HB3      SER  35   4.868   4.755   9.339
  243    HB3  SER  35           HB2      SER  35   6.228   3.671   9.061
  244    HG   SER  35           HG       SER  35   6.745   6.403   9.014
  245    H    GLY  36           H        GLY  36   6.279   2.591   6.733
  246    HA2  GLY  36           HA3      GLY  36   3.481   2.028   5.919
  247    HA3  GLY  36           HA2      GLY  36   4.775   1.705   4.770
  248    H    TYR  37           H        TYR  37   2.839  -0.076   6.377
  249    HA   TYR  37           HA       TYR  37   4.950  -1.948   7.369
  250    HB2  TYR  37           HB3      TYR  37   2.226  -1.475   8.614
  251    HB3  TYR  37           HB2      TYR  37   3.415  -2.658   9.159
  252    HD1  TYR  37           HD2      TYR  37   5.595  -1.902  10.106
  253    HD2  TYR  37           HD1      TYR  37   2.458   0.863   9.122
  254    HE1  TYR  37           HE2      TYR  37   6.704  -0.158  11.477
  255    HE2  TYR  37           HE1      TYR  37   3.567   2.608  10.494
  256    HH   TYR  37           HH       TYR  37   5.714   2.072  12.761
  257    H    CYS  38           H        CYS  38   4.731  -4.034   6.640
  258    HA   CYS  38           HA       CYS  38   2.389  -4.587   4.883
  259    HB2  CYS  38           HB3      CYS  38   4.554  -4.779   3.775
  260    HB3  CYS  38           HB2      CYS  38   5.124  -5.889   5.020
  261    H    GLN  39           H        GLN  39   0.962  -6.129   5.486
  262    HA   GLN  39           HA       GLN  39   1.773  -8.091   7.581
  263    HB2  GLN  39           HB3      GLN  39  -0.462  -7.810   8.641
  264    HB3  GLN  39           HB2      GLN  39   0.500  -6.338   8.724
  265    HG2  GLN  39           HG3      GLN  39  -1.534  -6.873   6.541
  266    HG3  GLN  39           HG2      GLN  39  -1.911  -5.993   8.018
  267   HE21  GLN  39          HE22      GLN  39   1.097  -4.985   7.805
  268   HE22  GLN  39          HE21      GLN  39   0.960  -3.689   6.719
  269    H    ILE  40           H        ILE  40  -0.035  -9.859   7.711
  270    HA   ILE  40           HA       ILE  40  -0.603 -10.656   4.913
  271    HB   ILE  40           HB       ILE  40  -1.037 -12.888   5.873
  272   HG12  ILE  40          HG13      ILE  40  -0.363 -11.550   8.516
  273   HG13  ILE  40          HG12      ILE  40  -1.970 -12.098   8.038
  274   HG21  ILE  40          HG21      ILE  40   1.430 -11.486   5.830
  275   HG22  ILE  40          HG22      ILE  40   1.182 -13.229   5.718
  276   HG23  ILE  40          HG23      ILE  40   1.434 -12.472   7.292
  277   HD11  ILE  40          HD11      ILE  40  -0.900 -14.406   7.684
  278   HD12  ILE  40          HD12      ILE  40  -1.094 -13.872   9.352
  279   HD13  ILE  40          HD13      ILE  40   0.485 -13.774   8.573
  280    H    LEU  41           H        LEU  41  -2.700 -10.990   4.165
  281    HA   LEU  41           HA       LEU  41  -4.826  -9.531   5.341
  282    HB2  LEU  41           HB3      LEU  41  -4.990 -11.886   3.436
  283    HB3  LEU  41           HB2      LEU  41  -6.259 -10.701   3.724
  284    HG   LEU  41           HG       LEU  41  -3.515 -10.126   2.575
  285   HD11  LEU  41          HD11      LEU  41  -4.533  -9.944   0.495
  286   HD12  LEU  41          HD12      LEU  41  -6.118  -9.597   1.186
  287   HD13  LEU  41          HD13      LEU  41  -5.488 -11.245   1.207
  288   HD21  LEU  41          HD21      LEU  41  -4.838  -7.860   2.149
  289   HD22  LEU  41          HD22      LEU  41  -4.009  -8.143   3.680
  290   HD23  LEU  41          HD23      LEU  41  -5.751  -8.391   3.562
  291    H    GLY  42           H        GLY  42  -3.849 -12.901   5.654
  292    HA2  GLY  42           HA3      GLY  42  -4.539 -13.605   8.116
  293    HA3  GLY  42           HA2      GLY  42  -6.159 -13.459   7.429
  294    H    THR  43           H        THR  43  -6.207 -14.592   5.107
  295    HA   THR  43           HA       THR  43  -5.208 -17.353   5.565
  296    HB   THR  43           HB       THR  43  -7.053 -16.865   3.315
  297    HG1  THR  43           HG1      THR  43  -7.576 -16.010   5.899
  298   HG21  THR  43          HG21      THR  43  -8.014 -18.901   4.065
  299   HG22  THR  43          HG22      THR  43  -7.362 -18.702   5.691
  300   HG23  THR  43          HG23      THR  43  -6.283 -19.087   4.350
  301    H    TYR  44           H        TYR  44  -5.915 -15.447   2.640
  302    HA   TYR  44           HA       TYR  44  -3.175 -16.114   1.649
  303    HB2  TYR  44           HB3      TYR  44  -5.735 -16.134   0.022
  304    HB3  TYR  44           HB2      TYR  44  -4.116 -16.467  -0.593
  305    HD1  TYR  44           HD1      TYR  44  -2.844 -18.463   0.277
  306    HD2  TYR  44           HD2      TYR  44  -6.995 -17.807   1.166
  307    HE1  TYR  44           HE1      TYR  44  -3.075 -20.839   0.950
  308    HE2  TYR  44           HE2      TYR  44  -7.225 -20.184   1.839
  309    HH   TYR  44           HH       TYR  44  -6.048 -22.055   2.402
  310    H    GLY  45           H        GLY  45  -2.254 -14.509   0.246
  311    HA2  GLY  45           HA3      GLY  45  -2.246 -12.396  -0.904
  312    HA3  GLY  45           HA2      GLY  45  -3.796 -12.011  -0.156
  313    H    ASN  46           H        ASN  46  -2.035 -10.016  -0.017
  314    HA   ASN  46           HA       ASN  46  -1.234 -10.015   2.835
  315    HB2  ASN  46           HB3      ASN  46   0.549  -9.866   0.517
  316    HB3  ASN  46           HB2      ASN  46   0.744  -8.507   1.621
  317   HD21  ASN  46          HD22      ASN  46  -0.320 -11.716   2.709
  318   HD22  ASN  46          HD21      ASN  46   1.084 -12.071   3.595
  319    H    GLY  47           H        GLY  47  -0.777  -7.695   3.564
  320    HA2  GLY  47           HA3      GLY  47  -2.207  -5.686   1.899
  321    HA3  GLY  47           HA2      GLY  47  -2.744  -5.943   3.559
  322    H    CYS  48           H        CYS  48  -1.564  -3.519   2.341
  323    HA   CYS  48           HA       CYS  48   0.681  -3.184   4.270
  324    HB2  CYS  48           HB3      CYS  48   0.695  -2.806   1.339
  325    HB3  CYS  48           HB2      CYS  48   1.359  -1.452   2.253
  326    H    TRP  49           H        TRP  49   0.253  -1.470   5.618
  327    HA   TRP  49           HA       TRP  49  -1.601   0.646   4.609
  328    HB2  TRP  49           HB3      TRP  49  -2.614   0.826   6.732
  329    HB3  TRP  49           HB2      TRP  49  -2.435  -0.913   6.516
  330    HD1  TRP  49           HD1      TRP  49  -0.558   2.034   8.172
  331    HE1  TRP  49           HE1      TRP  49   0.687   1.124  10.239
  332    HE3  TRP  49           HE3      TRP  49  -1.645  -2.929   7.735
  333    HZ2  TRP  49           HZ2      TRP  49   1.159  -1.385  11.535
  334    HZ3  TRP  49           HZ3      TRP  49  -0.789  -4.559   9.394
  335    HH2  TRP  49           HH2      TRP  49   0.609  -3.794  11.294
  336    H    CYS  50           H        CYS  50  -0.963   2.769   4.958
  337    HA   CYS  50           HA       CYS  50   1.607   3.166   6.429
  338    HB2  CYS  50           HB3      CYS  50   0.801   4.495   3.823
  339    HB3  CYS  50           HB2      CYS  50   2.286   4.804   4.723
  340    H    ILE  51           H        ILE  51   1.729   5.080   7.621
  341    HA   ILE  51           HA       ILE  51  -0.830   6.604   7.820
  342    HB   ILE  51           HB       ILE  51   1.313   6.298   9.940
  343   HG12  ILE  51          HG13      ILE  51   0.367   4.106   9.555
  344   HG13  ILE  51          HG12      ILE  51  -0.377   4.754  11.016
  345   HG21  ILE  51          HG21      ILE  51  -0.799   8.105   9.676
  346   HG22  ILE  51          HG22      ILE  51   0.071   7.731  11.164
  347   HG23  ILE  51          HG23      ILE  51  -1.420   6.874  10.775
  348   HD11  ILE  51          HD11      ILE  51  -1.571   4.429   8.276
  349   HD12  ILE  51          HD12      ILE  51  -2.207   5.655   9.373
  350   HD13  ILE  51          HD13      ILE  51  -2.233   3.954   9.839
  351    H    ALA  52           H        ALA  52  -0.727   8.833   7.602
  352    HA   ALA  52           HA       ALA  52   1.720  10.326   7.935
  353    HB1  ALA  52           HB1      ALA  52   0.822  10.301   5.077
  354    HB2  ALA  52           HB2      ALA  52   1.873   9.010   5.654
  355    HB3  ALA  52           HB3      ALA  52   2.408  10.688   5.747
  356    H    LEU  53           H        LEU  53  -0.842  10.787   5.499
  357    HA   LEU  53           HA       LEU  53  -1.880  13.040   7.169
  358    HB2  LEU  53           HB3      LEU  53  -2.173  13.416   4.265
  359    HB3  LEU  53           HB2      LEU  53  -1.622  14.549   5.494
  360    HG   LEU  53           HG       LEU  53   0.056  12.312   4.329
  361   HD11  LEU  53          HD11      LEU  53   1.281  14.566   3.534
  362   HD12  LEU  53          HD12      LEU  53  -0.379  15.160   3.572
  363   HD13  LEU  53          HD13      LEU  53   0.041  13.778   2.559
  364   HD21  LEU  53          HD21      LEU  53   0.308  13.794   6.718
  365   HD22  LEU  53          HD22      LEU  53   1.459  14.512   5.593
  366   HD23  LEU  53          HD23      LEU  53   1.546  12.790   5.962
  367    HA   PRO  54           HA       PRO  54  -5.255  10.016   6.139
  368    HB2  PRO  54           HB2      PRO  54  -6.256  10.981   8.750
  369    HB3  PRO  54           HB3      PRO  54  -6.012   9.319   8.184
  370    HG2  PRO  54           HG3      PRO  54  -4.419  10.475  10.014
  371    HG3  PRO  54           HG2      PRO  54  -3.835   9.265   8.860
  372    HD2  PRO  54           HD3      PRO  54  -3.427  12.227   8.849
  373    HD3  PRO  54           HD2      PRO  54  -2.344  10.935   8.289
  374    H    ASP  55           H        ASP  55  -5.173  13.360   7.125
  375    HA   ASP  55           HA       ASP  55  -7.915  14.043   6.801
  376    HB2  ASP  55           HB3      ASP  55  -5.409  15.678   6.317
  377    HB3  ASP  55           HB2      ASP  55  -7.038  16.354   6.345
  378    H    ASN  56           H        ASN  56  -5.298  13.715   4.437
  379    HA   ASN  56           HA       ASN  56  -6.765  14.819   2.222
  380    HB2  ASN  56           HB3      ASN  56  -4.246  14.426   2.361
  381    HB3  ASN  56           HB2      ASN  56  -4.590  12.728   2.031
  382   HD21  ASN  56          HD22      ASN  56  -3.084  13.951   0.105
  383   HD22  ASN  56          HD21      ASN  56  -4.012  14.301  -1.274
  384    H    VAL  57           H        VAL  57  -8.358  13.917   1.027
  385    HA   VAL  57           HA       VAL  57  -9.886  11.735   1.621
  386    HB   VAL  57           HB       VAL  57  -9.062  12.496  -1.194
  387   HG11  VAL  57          HG11      VAL  57 -11.628  11.738  -1.391
  388   HG12  VAL  57          HG12      VAL  57 -11.163  10.736  -0.015
  389   HG13  VAL  57          HG13      VAL  57 -10.301  10.586  -1.547
  390   HG21  VAL  57          HG21      VAL  57 -11.626  13.490  -0.276
  391   HG22  VAL  57          HG22      VAL  57 -10.257  14.391  -0.930
  392   HG23  VAL  57          HG23      VAL  57 -10.336  14.036   0.796
  393    HA   PRO  58           HA       PRO  58  -6.674   8.580   0.838
  394    HB2  PRO  58           HB2      PRO  58  -7.183   6.985   2.928
  395    HB3  PRO  58           HB3      PRO  58  -6.383   8.554   3.154
  396    HG2  PRO  58           HG3      PRO  58  -9.183   7.764   3.723
  397    HG3  PRO  58           HG2      PRO  58  -8.132   8.906   4.574
  398    HD2  PRO  58           HD3      PRO  58 -10.117   9.555   2.654
  399    HD3  PRO  58           HD2      PRO  58  -8.890  10.653   3.323
  400    H    ILE  59           H        ILE  59  -6.839   6.370   0.065
  401    HA   ILE  59           HA       ILE  59  -7.965   4.805  -1.296
  402    HB   ILE  59           HB       ILE  59  -9.696   4.807   1.193
  403   HG12  ILE  59          HG13      ILE  59  -7.324   3.066   0.447
  404   HG13  ILE  59          HG12      ILE  59  -7.239   4.437   1.555
  405   HG21  ILE  59          HG21      ILE  59  -9.542   2.237   0.076
  406   HG22  ILE  59          HG22      ILE  59  -9.817   3.311  -1.296
  407   HG23  ILE  59          HG23      ILE  59 -10.944   3.308   0.061
  408   HD11  ILE  59          HD11      ILE  59  -9.214   3.230   2.782
  409   HD12  ILE  59          HD12      ILE  59  -7.567   2.647   3.025
  410   HD13  ILE  59          HD13      ILE  59  -8.646   1.804   1.913
  411    H    ARG  60           H        ARG  60  -8.644   7.162  -2.329
  412    HA   ARG  60           HA       ARG  60 -11.360   7.979  -2.196
  413    HB2  ARG  60           HB3      ARG  60 -10.962   9.106  -4.303
  414    HB3  ARG  60           HB2      ARG  60  -9.491   9.229  -3.337
  415    HG2  ARG  60           HG3      ARG  60  -8.633   7.179  -4.538
  416    HG3  ARG  60           HG2      ARG  60 -10.030   7.298  -5.608
  417    HD2  ARG  60           HD3      ARG  60  -7.904   9.421  -5.207
  418    HD3  ARG  60           HD2      ARG  60  -8.109   8.409  -6.637
  419    HE   ARG  60           HE       ARG  60  -9.764  10.724  -5.911
  420   HH11  ARG  60          HH22      ARG  60  -9.396   7.803  -7.706
  421   HH12  ARG  60          HH21      ARG  60 -10.562   8.240  -8.910
  422   HH21  ARG  60          HH11      ARG  60 -11.289  11.311  -7.474
  423   HH22  ARG  60          HH12      ARG  60 -11.634  10.226  -8.779
  424    H    ILE  61           H        ILE  61  -9.789   5.444  -4.086
  425    HA   ILE  61           HA       ILE  61 -11.948   4.843  -5.833
  426    HB   ILE  61           HB       ILE  61 -10.859   2.678  -6.139
  427   HG12  ILE  61          HG13      ILE  61  -9.435   3.418  -3.568
  428   HG13  ILE  61          HG12      ILE  61 -10.487   2.030  -3.842
  429   HG21  ILE  61          HG21      ILE  61  -8.990   3.555  -7.108
  430   HG22  ILE  61          HG22      ILE  61  -8.461   4.332  -5.617
  431   HG23  ILE  61          HG23      ILE  61  -9.698   5.093  -6.616
  432   HD11  ILE  61          HD11      ILE  61  -8.538   0.923  -4.238
  433   HD12  ILE  61          HD12      ILE  61  -7.648   2.411  -4.563
  434   HD13  ILE  61          HD13      ILE  61  -8.641   1.683  -5.826
  435    HA   PRO  62           HA       PRO  62 -15.031   3.128  -3.154
  436    HB2  PRO  62           HB2      PRO  62 -15.949   1.053  -4.774
  437    HB3  PRO  62           HB3      PRO  62 -16.486   2.740  -4.867
  438    HG2  PRO  62           HG3      PRO  62 -14.536   1.279  -6.555
  439    HG3  PRO  62           HG2      PRO  62 -15.682   2.557  -6.992
  440    HD2  PRO  62           HD3      PRO  62 -13.024   3.033  -6.700
  441    HD3  PRO  62           HD2      PRO  62 -14.254   4.257  -6.319
  442    H    GLY  63           H        GLY  63 -12.200   1.566  -3.865
  443    HA2  GLY  63           HA3      GLY  63 -11.189   0.022  -2.286
  444    HA3  GLY  63           HA2      GLY  63 -12.802  -0.569  -1.889
  445    H    LYS  64           H        LYS  64 -12.594  -0.152  -5.196
  446    HA   LYS  64           HA       LYS  64 -12.110  -3.060  -5.570
  447    HB2  LYS  64           HB3      LYS  64 -13.497  -1.013  -7.326
  448    HB3  LYS  64           HB2      LYS  64 -13.243  -2.700  -7.777
  449    HG2  LYS  64           HG3      LYS  64 -14.527  -3.424  -5.795
  450    HG3  LYS  64           HG2      LYS  64 -14.786  -1.737  -5.349
  451    HD2  LYS  64           HD3      LYS  64 -16.756  -2.529  -6.529
  452    HD3  LYS  64           HD2      LYS  64 -15.907  -1.381  -7.564
  453    HE2  LYS  64           HE3      LYS  64 -15.193  -3.020  -9.034
  454    HE3  LYS  64           HE2      LYS  64 -15.193  -4.278  -7.799
  455    HZ1  LYS  64           HZ1      LYS  64 -17.008  -4.661  -9.276
  456    HZ2  LYS  64           HZ2      LYS  64 -17.562  -3.066  -9.112
  457    HZ3  LYS  64           HZ3      LYS  64 -17.648  -4.133  -7.792
  458    H    CYS  65           H        CYS  65 -10.183  -3.612  -6.424
  459    HA   CYS  65           HA       CYS  65  -8.241  -1.687  -7.259
  460    HB2  CYS  65           HB3      CYS  65  -8.380  -4.660  -7.810
  461    HB3  CYS  65           HB2      CYS  65  -6.945  -3.654  -7.997
  462    H    HIS  66           H        HIS  66 -10.801  -3.305  -8.974
  463    HA   HIS  66           HA       HIS  66 -11.430  -3.241 -11.236
  464    HB2  HIS  66           HB3      HIS  66  -9.964  -0.628 -10.866
  465    HB3  HIS  66           HB2      HIS  66 -10.659  -1.073 -12.423
  466    HD1  HIS  66           HD1      HIS  66 -11.551   0.215  -9.078
  467    HD2  HIS  66           HD2      HIS  66 -13.564  -1.443 -12.336
  468    HE1  HIS  66           HE1      HIS  66 -14.012   0.724  -8.738
  469    HE2  HIS  66           HE2      HIS  66 -15.244  -0.280 -10.714
  Start of MODEL    9
    1    H1   ALA   1           H1       ALA   1  -0.781  10.323   2.127
    2    H2   ALA   1           H2       ALA   1  -1.053  11.583   3.234
    3    H3   ALA   1           H3       ALA   1  -1.622  11.712   1.637
    4    HA   ALA   1           HA       ALA   1  -3.284  11.099   3.477
    5    HB1  ALA   1           HB1      ALA   1  -4.476   9.602   1.881
    6    HB2  ALA   1           HB2      ALA   1  -3.000   9.487   0.921
    7    HB3  ALA   1           HB3      ALA   1  -3.825  11.037   1.089
    8    H    ARG   2           H        ARG   2  -4.268   8.421   3.222
    9    HA   ARG   2           HA       ARG   2  -2.152   6.860   4.649
   10    HB2  ARG   2           HB3      ARG   2  -3.828   7.795   6.244
   11    HB3  ARG   2           HB2      ARG   2  -5.099   6.948   5.362
   12    HG2  ARG   2           HG3      ARG   2  -3.916   4.794   5.800
   13    HG3  ARG   2           HG2      ARG   2  -2.738   5.674   6.773
   14    HD2  ARG   2           HD3      ARG   2  -4.613   6.487   8.219
   15    HD3  ARG   2           HD2      ARG   2  -5.713   5.460   7.299
   16    HE   ARG   2           HE       ARG   2  -3.486   3.924   8.301
   17   HH11  ARG   2          HH22      ARG   2  -6.445   5.477   9.153
   18   HH12  ARG   2          HH21      ARG   2  -6.779   4.409  10.474
   19   HH21  ARG   2          HH11      ARG   2  -3.905   2.521  10.020
   20   HH22  ARG   2          HH12      ARG   2  -5.340   2.736  10.966
   21    H    ASP   3           H        ASP   3  -1.965   4.758   3.975
   22    HA   ASP   3           HA       ASP   3  -3.874   3.850   1.880
   23    HB2  ASP   3           HB3      ASP   3  -1.072   2.928   2.563
   24    HB3  ASP   3           HB2      ASP   3  -2.080   2.196   1.319
   25    H    ALA   4           H        ALA   4  -4.629   1.604   1.999
   26    HA   ALA   4           HA       ALA   4  -4.757   0.640   4.820
   27    HB1  ALA   4           HB1      ALA   4  -6.689   0.499   2.516
   28    HB2  ALA   4           HB2      ALA   4  -6.960   1.109   4.148
   29    HB3  ALA   4           HB3      ALA   4  -6.816  -0.626   3.869
   30    H    TYR   5           H        TYR   5  -5.761  -1.323   2.107
   31    HA   TYR   5           HA       TYR   5  -3.678  -3.301   2.880
   32    HB2  TYR   5           HB3      TYR   5  -5.943  -3.746   0.931
   33    HB3  TYR   5           HB2      TYR   5  -5.065  -4.946   1.881
   34    HD1  TYR   5           HD2      TYR   5  -5.469  -5.180   4.305
   35    HD2  TYR   5           HD1      TYR   5  -7.704  -2.409   1.902
   36    HE1  TYR   5           HE2      TYR   5  -7.142  -4.956   6.123
   37    HE2  TYR   5           HE1      TYR   5  -9.380  -2.186   3.719
   38    HH   TYR   5           HH       TYR   5  -9.429  -2.495   6.220
   39    H    ILE   6           H        ILE   6  -4.278  -0.961   0.502
   40    HA   ILE   6           HA       ILE   6  -2.507  -2.362  -1.448
   41    HB   ILE   6           HB       ILE   6  -4.379  -0.023  -1.900
   42   HG12  ILE   6          HG13      ILE   6  -4.661  -2.953  -2.640
   43   HG13  ILE   6          HG12      ILE   6  -5.568  -2.133  -1.367
   44   HG21  ILE   6          HG21      ILE   6  -3.622  -1.576  -4.221
   45   HG22  ILE   6          HG22      ILE   6  -2.188  -0.960  -3.398
   46   HG23  ILE   6          HG23      ILE   6  -3.444   0.154  -3.936
   47   HD11  ILE   6          HD11      ILE   6  -6.503  -0.576  -3.038
   48   HD12  ILE   6          HD12      ILE   6  -6.892  -2.248  -3.440
   49   HD13  ILE   6          HD13      ILE   6  -5.607  -1.407  -4.309
   50    H    ALA   7           H        ALA   7  -0.505  -1.513  -1.783
   51    HA   ALA   7           HA       ALA   7   0.147   1.031  -0.400
   52    HB1  ALA   7           HB1      ALA   7   1.474  -1.450  -0.669
   53    HB2  ALA   7           HB2      ALA   7   2.073   0.003   0.131
   54    HB3  ALA   7           HB3      ALA   7   2.428  -0.275  -1.575
   55    H    LYS   8           H        LYS   8  -0.476  -0.163  -3.526
   56    HA   LYS   8           HA       LYS   8   1.097   2.025  -4.785
   57    HB2  LYS   8           HB3      LYS   8  -0.339   0.165  -6.559
   58    HB3  LYS   8           HB2      LYS   8   1.344   0.684  -6.605
   59    HG2  LYS   8           HG3      LYS   8   0.218  -1.373  -4.674
   60    HG3  LYS   8           HG2      LYS   8   1.143  -1.744  -6.125
   61    HD2  LYS   8           HD3      LYS   8   2.485   0.229  -4.434
   62    HD3  LYS   8           HD2      LYS   8   2.216  -1.305  -3.606
   63    HE2  LYS   8           HE3      LYS   8   3.372  -2.530  -5.305
   64    HE3  LYS   8           HE2      LYS   8   3.390  -1.138  -6.388
   65    HZ1  LYS   8           HZ1      LYS   8   4.590  -0.192  -4.159
   66    HZ2  LYS   8           HZ2      LYS   8   5.401  -0.758  -5.537
   67    HZ3  LYS   8           HZ3      LYS   8   5.152  -1.795  -4.213
   68    HA   PRO   9           HA       PRO   9  -2.509   4.449  -5.487
   69    HB2  PRO   9           HB2      PRO   9  -2.023   5.398  -8.044
   70    HB3  PRO   9           HB3      PRO   9  -1.310   6.064  -6.563
   71    HG2  PRO   9           HG3      PRO   9  -0.135   4.214  -8.565
   72    HG3  PRO   9           HG2      PRO   9   0.631   5.514  -7.635
   73    HD2  PRO   9           HD3      PRO   9   0.939   2.883  -7.001
   74    HD3  PRO   9           HD2      PRO   9   0.970   4.171  -5.777
   75    H    HIS  10           H        HIS  10  -1.681   2.229  -8.146
   76    HA   HIS  10           HA       HIS  10  -4.610   1.827  -8.561
   77    HB2  HIS  10           HB3      HIS  10  -2.517   1.858 -10.752
   78    HB3  HIS  10           HB2      HIS  10  -4.258   1.667 -10.960
   79    HD1  HIS  10           HD1      HIS  10  -5.752   3.790 -10.226
   80    HD2  HIS  10           HD2      HIS  10  -1.662   4.510 -10.626
   81    HE1  HIS  10           HE1      HIS  10  -5.475   6.306 -10.358
   82    HE2  HIS  10           HE2      HIS  10  -2.990   6.754 -10.601
   83    H    ASN  11           H        ASN  11  -1.763   0.420  -7.637
   84    HA   ASN  11           HA       ASN  11  -2.701  -2.273  -8.552
   85    HB2  ASN  11           HB3      ASN  11   0.171  -1.390  -8.141
   86    HB3  ASN  11           HB2      ASN  11  -0.365  -2.977  -8.696
   87   HD21  ASN  11          HD22      ASN  11   0.060   0.395  -9.653
   88   HD22  ASN  11          HD21      ASN  11  -0.265   0.157 -11.302
   89    H    CYS  12           H        CYS  12  -1.964  -4.045  -7.061
   90    HA   CYS  12           HA       CYS  12  -1.905  -3.070  -4.231
   91    HB2  CYS  12           HB3      CYS  12  -2.984  -5.708  -5.266
   92    HB3  CYS  12           HB2      CYS  12  -3.099  -5.097  -3.616
   93    H    VAL  13           H        VAL  13  -0.699  -4.492  -2.722
   94    HA   VAL  13           HA       VAL  13   1.879  -5.220  -3.799
   95    HB   VAL  13           HB       VAL  13   0.665  -5.894  -1.101
   96   HG11  VAL  13          HG11      VAL  13   3.384  -6.161  -2.318
   97   HG12  VAL  13          HG12      VAL  13   2.558  -7.222  -1.177
   98   HG13  VAL  13          HG13      VAL  13   3.277  -5.713  -0.616
   99   HG21  VAL  13          HG21      VAL  13   0.681  -3.605  -0.961
  100   HG22  VAL  13          HG22      VAL  13   1.851  -3.432  -2.270
  101   HG23  VAL  13          HG23      VAL  13   2.399  -3.860  -0.649
  102    H    TYR  14           H        TYR  14   2.554  -7.184  -4.563
  103    HA   TYR  14           HA       TYR  14   0.601  -9.315  -4.887
  104    HB2  TYR  14           HB3      TYR  14   2.281 -10.440  -6.154
  105    HB3  TYR  14           HB2      TYR  14   2.485  -8.726  -6.513
  106    HD1  TYR  14           HD1      TYR  14   4.308  -7.421  -5.407
  107    HD2  TYR  14           HD2      TYR  14   3.968 -11.682  -4.983
  108    HE1  TYR  14           HE1      TYR  14   6.651  -7.528  -4.601
  109    HE2  TYR  14           HE2      TYR  14   6.311 -11.788  -4.176
  110    HH   TYR  14           HH       TYR  14   8.372  -8.906  -4.133
  111    H    GLU  15           H        GLU  15   3.547  -8.875  -2.935
  112    HA   GLU  15           HA       GLU  15   2.554 -10.457  -0.767
  113    HB2  GLU  15           HB3      GLU  15   2.963 -12.298  -2.433
  114    HB3  GLU  15           HB2      GLU  15   4.664 -11.840  -2.450
  115    HG2  GLU  15           HG3      GLU  15   4.759 -12.222   0.011
  116    HG3  GLU  15           HG2      GLU  15   3.087 -12.780  -0.040
  117    H    CYS  16           H        CYS  16   3.436  -8.895   0.587
  118    HA   CYS  16           HA       CYS  16   6.083  -7.804   0.244
  119    HB2  CYS  16           HB3      CYS  16   4.750  -6.411   1.540
  120    HB3  CYS  16           HB2      CYS  16   4.006  -7.756   2.403
  121    H    PHE  17           H        PHE  17   7.564  -9.533   0.088
  122    HA   PHE  17           HA       PHE  17   7.647 -11.762   1.870
  123    HB2  PHE  17           HB3      PHE  17   9.769 -12.259   0.908
  124    HB3  PHE  17           HB2      PHE  17   8.835 -11.501  -0.382
  125    HD1  PHE  17           HD2      PHE  17   9.134  -8.992  -0.786
  126    HD2  PHE  17           HD1      PHE  17  11.801 -11.311   1.654
  127    HE1  PHE  17           HE2      PHE  17  10.861  -7.225  -0.995
  128    HE2  PHE  17           HE1      PHE  17  13.528  -9.545   1.446
  129    HZ   PHE  17           HZ       PHE  17  13.057  -7.502   0.123
  130    H    ASP  18           H        ASP  18   9.344  -8.625   1.964
  131    HA   ASP  18           HA       ASP  18   9.610  -8.926   4.876
  132    HB2  ASP  18           HB3      ASP  18  11.649 -10.027   3.813
  133    HB3  ASP  18           HB2      ASP  18  12.095  -8.422   3.233
  134    H    ALA  19           H        ALA  19   8.263  -7.044   4.926
  135    HA   ALA  19           HA       ALA  19   8.851  -4.634   3.485
  136    HB1  ALA  19           HB1      ALA  19   7.570  -3.733   5.718
  137    HB2  ALA  19           HB2      ALA  19   7.092  -5.431   5.727
  138    HB3  ALA  19           HB3      ALA  19   6.742  -4.422   4.323
  139    H    PHE  20           H        PHE  20  10.063  -5.995   6.473
  140    HA   PHE  20           HA       PHE  20  11.150  -3.708   7.706
  141    HB2  PHE  20           HB3      PHE  20  11.153  -6.015   8.677
  142    HB3  PHE  20           HB2      PHE  20  12.443  -6.448   7.554
  143    HD1  PHE  20           HD1      PHE  20  11.543  -4.272  10.421
  144    HD2  PHE  20           HD2      PHE  20  14.707  -5.720   7.901
  145    HE1  PHE  20           HE1      PHE  20  13.220  -3.318  11.979
  146    HE2  PHE  20           HE2      PHE  20  16.384  -4.765   9.459
  147    HZ   PHE  20           HZ       PHE  20  15.641  -3.564  11.498
  148    H    SER  21           H        SER  21  12.479  -5.697   5.066
  149    HA   SER  21           HA       SER  21  15.028  -4.460   4.916
  150    HB2  SER  21           HB3      SER  21  13.374  -5.496   2.598
  151    HB3  SER  21           HB2      SER  21  15.122  -5.292   2.628
  152    HG   SER  21           HG       SER  21  15.230  -7.176   3.530
  153    H    SER  22           H        SER  22  12.005  -3.631   3.203
  154    HA   SER  22           HA       SER  22  11.942  -0.928   3.369
  155    HB2  SER  22           HB3      SER  22  14.219  -1.726   1.607
  156    HB3  SER  22           HB2      SER  22  13.251  -0.340   1.119
  157    HG   SER  22           HG       SER  22  13.588   0.120   3.580
  158    H    TYR  23           H        TYR  23  11.073  -3.712   1.878
  159    HA   TYR  23           HA       TYR  23  10.168  -2.962  -0.691
  160    HB2  TYR  23           HB3      TYR  23  10.122  -5.291   0.211
  161    HB3  TYR  23           HB2      TYR  23   8.743  -4.835   1.214
  162    HD1  TYR  23           HD1      TYR  23   9.917  -5.411  -2.235
  163    HD2  TYR  23           HD2      TYR  23   6.565  -4.364   0.237
  164    HE1  TYR  23           HE1      TYR  23   8.390  -5.765  -4.156
  165    HE2  TYR  23           HE2      TYR  23   5.038  -4.718  -1.682
  166    HH   TYR  23           HH       TYR  23   6.292  -5.743  -4.864
  167    H    CYS  24           H        CYS  24   7.778  -3.465   1.887
  168    HA   CYS  24           HA       CYS  24   5.863  -1.720   0.735
  169    HB2  CYS  24           HB3      CYS  24   5.564  -3.493   2.597
  170    HB3  CYS  24           HB2      CYS  24   6.040  -2.207   3.706
  171    H    ASN  25           H        ASN  25   8.165  -1.110   3.394
  172    HA   ASN  25           HA       ASN  25   7.435   1.597   3.850
  173    HB2  ASN  25           HB3      ASN  25  10.151   0.272   4.106
  174    HB3  ASN  25           HB2      ASN  25   9.736   1.851   4.774
  175   HD21  ASN  25          HD22      ASN  25   6.957  -0.008   4.931
  176   HD22  ASN  25          HD21      ASN  25   7.117  -0.599   6.514
  177    H    GLY  26           H        GLY  26   9.584   0.120   1.467
  178    HA2  GLY  26           HA3      GLY  26  10.765   2.503   0.451
  179    HA3  GLY  26           HA2      GLY  26  10.543   1.019  -0.479
  180    H    VAL  27           H        VAL  27   7.711   0.862  -0.374
  181    HA   VAL  27           HA       VAL  27   6.998   2.580  -2.543
  182    HB   VAL  27           HB       VAL  27   5.266   1.046  -0.584
  183   HG11  VAL  27          HG11      VAL  27   4.620   2.753  -2.963
  184   HG12  VAL  27          HG12      VAL  27   3.732   2.561  -1.451
  185   HG13  VAL  27          HG13      VAL  27   3.663   1.299  -2.681
  186   HG21  VAL  27          HG21      VAL  27   6.114   0.467  -3.442
  187   HG22  VAL  27          HG22      VAL  27   5.096  -0.564  -2.436
  188   HG23  VAL  27          HG23      VAL  27   6.787  -0.309  -2.008
  189    H    CYS  28           H        CYS  28   6.313   2.773   0.945
  190    HA   CYS  28           HA       CYS  28   4.766   5.187   0.801
  191    HB2  CYS  28           HB3      CYS  28   6.380   3.922   3.027
  192    HB3  CYS  28           HB2      CYS  28   5.468   5.414   3.253
  193    H    THR  29           H        THR  29   8.222   4.552   0.902
  194    HA   THR  29           HA       THR  29   9.139   7.135   1.630
  195    HB   THR  29           HB       THR  29  10.439   5.252  -0.357
  196    HG1  THR  29           HG1      THR  29   9.954   4.197   1.581
  197   HG21  THR  29          HG21      THR  29  12.157   6.699  -0.332
  198   HG22  THR  29          HG22      THR  29  12.210   6.652   1.430
  199   HG23  THR  29          HG23      THR  29  11.164   7.810   0.610
  200    H    LYS  30           H        LYS  30   8.347   5.815  -1.587
  201    HA   LYS  30           HA       LYS  30   9.048   8.173  -3.050
  202    HB2  LYS  30           HB3      LYS  30   6.883   6.164  -3.739
  203    HB3  LYS  30           HB2      LYS  30   7.722   7.235  -4.861
  204    HG2  LYS  30           HG3      LYS  30   9.045   5.056  -3.215
  205    HG3  LYS  30           HG2      LYS  30   8.638   4.928  -4.926
  206    HD2  LYS  30           HD3      LYS  30  10.052   7.071  -5.226
  207    HD3  LYS  30           HD2      LYS  30  10.682   6.718  -3.615
  208    HE2  LYS  30           HE3      LYS  30  10.871   4.265  -4.818
  209    HE3  LYS  30           HE2      LYS  30  11.201   5.348  -6.171
  210    HZ1  LYS  30           HZ1      LYS  30  13.020   4.582  -4.351
  211    HZ2  LYS  30           HZ2      LYS  30  12.518   6.069  -3.705
  212    HZ3  LYS  30           HZ3      LYS  30  13.133   5.996  -5.288
  213    H    ASN  31           H        ASN  31   5.978   7.081  -1.639
  214    HA   ASN  31           HA       ASN  31   4.430   9.342  -2.489
  215    HB2  ASN  31           HB3      ASN  31   4.077   7.492  -0.109
  216    HB3  ASN  31           HB2      ASN  31   2.865   8.644  -0.672
  217   HD21  ASN  31          HD22      ASN  31   2.311   5.842  -0.661
  218   HD22  ASN  31          HD21      ASN  31   2.196   5.307  -2.268
  219    H    GLY  32           H        GLY  32   6.589   8.784   0.217
  220    HA2  GLY  32           HA3      GLY  32   7.686  10.608   1.375
  221    HA3  GLY  32           HA2      GLY  32   6.340  11.660   0.928
  222    H    ALA  33           H        ALA  33   5.084   8.731   1.861
  223    HA   ALA  33           HA       ALA  33   3.880   9.779   4.238
  224    HB1  ALA  33           HB1      ALA  33   3.547   7.138   4.590
  225    HB2  ALA  33           HB2      ALA  33   3.999   7.127   2.885
  226    HB3  ALA  33           HB3      ALA  33   2.597   8.054   3.420
  227    H    LYS  34           H        LYS  34   4.251   9.090   6.451
  228    HA   LYS  34           HA       LYS  34   6.945   9.172   7.294
  229    HB2  LYS  34           HB3      LYS  34   4.908   9.603   8.721
  230    HB3  LYS  34           HB2      LYS  34   4.665   7.857   8.795
  231    HG2  LYS  34           HG3      LYS  34   7.227   7.893   9.535
  232    HG3  LYS  34           HG2      LYS  34   6.810   9.529  10.041
  233    HD2  LYS  34           HD3      LYS  34   5.254   7.050  10.834
  234    HD3  LYS  34           HD2      LYS  34   6.474   7.825  11.846
  235    HE2  LYS  34           HE3      LYS  34   4.791   9.917  11.039
  236    HE3  LYS  34           HE2      LYS  34   3.701   8.583  11.421
  237    HZ1  LYS  34           HZ1      LYS  34   4.003   9.532  13.468
  238    HZ2  LYS  34           HZ2      LYS  34   5.608   9.983  13.161
  239    HZ3  LYS  34           HZ3      LYS  34   5.232   8.358  13.489
  240    H    SER  35           H        SER  35   4.879   6.292   7.792
  241    HA   SER  35           HA       SER  35   7.074   4.595   6.753
  242    HB2  SER  35           HB3      SER  35   7.398   4.889   9.232
  243    HB3  SER  35           HB2      SER  35   5.824   4.138   9.474
  244    HG   SER  35           HG       SER  35   7.007   2.520   7.881
  245    H    GLY  36           H        GLY  36   6.323   2.246   6.675
  246    HA2  GLY  36           HA3      GLY  36   3.373   2.023   6.389
  247    HA3  GLY  36           HA2      GLY  36   4.403   1.540   5.042
  248    H    TYR  37           H        TYR  37   2.610  -0.197   6.542
  249    HA   TYR  37           HA       TYR  37   4.638  -2.116   7.617
  250    HB2  TYR  37           HB3      TYR  37   1.833  -1.704   8.684
  251    HB3  TYR  37           HB2      TYR  37   3.041  -2.819   9.320
  252    HD1  TYR  37           HD1      TYR  37   5.033  -1.985  10.502
  253    HD2  TYR  37           HD2      TYR  37   1.991   0.688   9.067
  254    HE1  TYR  37           HE1      TYR  37   5.961  -0.170  11.915
  255    HE2  TYR  37           HE2      TYR  37   2.918   2.502  10.482
  256    HH   TYR  37           HH       TYR  37   4.708   3.130  11.724
  257    H    CYS  38           H        CYS  38   4.319  -4.272   7.021
  258    HA   CYS  38           HA       CYS  38   1.992  -4.801   5.217
  259    HB2  CYS  38           HB3      CYS  38   3.333  -5.777   3.618
  260    HB3  CYS  38           HB2      CYS  38   4.479  -4.601   4.255
  261    H    GLN  39           H        GLN  39   0.797  -6.514   5.843
  262    HA   GLN  39           HA       GLN  39   2.091  -8.654   7.449
  263    HB2  GLN  39           HB3      GLN  39  -0.467  -7.221   8.229
  264    HB3  GLN  39           HB2      GLN  39   0.182  -8.650   9.033
  265    HG2  GLN  39           HG3      GLN  39   2.286  -7.375   9.497
  266    HG3  GLN  39           HG2      GLN  39   1.515  -5.937   8.826
  267   HE21  GLN  39          HE22      GLN  39   0.550  -4.643  10.389
  268   HE22  GLN  39          HE21      GLN  39  -0.074  -5.195  11.868
  269    H    ILE  40           H        ILE  40  -0.855  -9.523   7.921
  270    HA   ILE  40           HA       ILE  40  -1.023 -11.028   5.381
  271    HB   ILE  40           HB       ILE  40  -2.541 -12.503   6.560
  272   HG12  ILE  40          HG13      ILE  40  -2.425 -10.456   8.805
  273   HG13  ILE  40          HG12      ILE  40  -3.826 -10.777   7.783
  274   HG21  ILE  40          HG21      ILE  40  -1.084 -13.260   8.347
  275   HG22  ILE  40          HG22      ILE  40  -0.329 -11.670   8.460
  276   HG23  ILE  40          HG23      ILE  40  -0.079 -12.666   7.026
  277   HD11  ILE  40          HD11      ILE  40  -2.981 -13.288   8.769
  278   HD12  ILE  40          HD12      ILE  40  -4.443 -12.403   9.203
  279   HD13  ILE  40          HD13      ILE  40  -2.968 -12.184  10.145
  280    H    LEU  41           H        LEU  41  -3.004 -11.136   4.176
  281    HA   LEU  41           HA       LEU  41  -4.481  -8.594   4.198
  282    HB2  LEU  41           HB3      LEU  41  -3.661  -9.699   2.077
  283    HB3  LEU  41           HB2      LEU  41  -4.841 -10.978   2.362
  284    HG   LEU  41           HG       LEU  41  -6.642  -9.258   2.391
  285   HD11  LEU  41          HD11      LEU  41  -5.873  -7.161   2.843
  286   HD12  LEU  41          HD12      LEU  41  -5.599  -7.081   1.103
  287   HD13  LEU  41          HD13      LEU  41  -4.273  -7.504   2.186
  288   HD21  LEU  41          HD21      LEU  41  -6.187  -8.577  -0.145
  289   HD22  LEU  41          HD22      LEU  41  -6.552 -10.245   0.298
  290   HD23  LEU  41          HD23      LEU  41  -4.882  -9.751   0.024
  291    H    GLY  42           H        GLY  42  -6.622  -8.382   4.828
  292    HA2  GLY  42           HA3      GLY  42  -7.772 -10.046   6.731
  293    HA3  GLY  42           HA2      GLY  42  -8.732  -9.010   5.674
  294    H    THR  43           H        THR  43  -7.985 -10.347   3.208
  295    HA   THR  43           HA       THR  43  -9.643 -12.790   3.548
  296    HB   THR  43           HB       THR  43  -9.821 -12.653   1.027
  297    HG1  THR  43           HG1      THR  43  -8.580 -10.147   1.493
  298   HG21  THR  43          HG21      THR  43 -11.517 -11.010   1.094
  299   HG22  THR  43          HG22      THR  43 -10.668 -10.060   2.312
  300   HG23  THR  43          HG23      THR  43 -11.423 -11.591   2.756
  301    H    TYR  44           H        TYR  44  -7.629 -12.472   0.760
  302    HA   TYR  44           HA       TYR  44  -5.794 -14.574   1.849
  303    HB2  TYR  44           HB3      TYR  44  -6.853 -14.294  -0.981
  304    HB3  TYR  44           HB2      TYR  44  -5.699 -15.512  -0.436
  305    HD1  TYR  44           HD2      TYR  44  -6.394 -17.180   1.326
  306    HD2  TYR  44           HD1      TYR  44  -9.194 -14.550  -0.598
  307    HE1  TYR  44           HE2      TYR  44  -8.265 -18.624   2.075
  308    HE2  TYR  44           HE1      TYR  44 -11.065 -15.995   0.151
  309    HH   TYR  44           HH       TYR  44 -11.648 -17.809   1.279
  310    H    GLY  45           H        GLY  45  -3.593 -14.384   1.227
  311    HA2  GLY  45           HA3      GLY  45  -1.754 -13.361   0.061
  312    HA3  GLY  45           HA2      GLY  45  -2.842 -12.084  -0.483
  313    H    ASN  46           H        ASN  46  -1.078 -10.638   0.289
  314    HA   ASN  46           HA       ASN  46  -1.116 -10.272   3.241
  315    HB2  ASN  46           HB3      ASN  46   0.976  -9.519   1.185
  316    HB3  ASN  46           HB2      ASN  46   1.057  -9.101   2.891
  317   HD21  ASN  46          HD22      ASN  46   0.217 -11.447   4.144
  318   HD22  ASN  46          HD21      ASN  46   1.270 -12.721   3.761
  319    H    GLY  47           H        GLY  47  -0.849  -7.916   3.897
  320    HA2  GLY  47           HA3      GLY  47  -2.115  -6.077   1.901
  321    HA3  GLY  47           HA2      GLY  47  -2.740  -6.170   3.548
  322    H    CYS  48           H        CYS  48  -1.618  -3.803   2.280
  323    HA   CYS  48           HA       CYS  48   0.592  -3.316   4.212
  324    HB2  CYS  48           HB3      CYS  48   0.791  -3.326   1.321
  325    HB3  CYS  48           HB2      CYS  48   1.174  -1.731   1.967
  326    H    TRP  49           H        TRP  49   0.030  -1.605   5.470
  327    HA   TRP  49           HA       TRP  49  -1.793   0.445   4.295
  328    HB2  TRP  49           HB3      TRP  49  -1.901   0.935   6.970
  329    HB3  TRP  49           HB2      TRP  49  -3.037  -0.109   6.120
  330    HD1  TRP  49           HD1      TRP  49  -0.006  -0.205   8.416
  331    HE1  TRP  49           HE1      TRP  49   0.225  -2.578   9.397
  332    HE3  TRP  49           HE3      TRP  49  -3.579  -2.636   5.697
  333    HZ2  TRP  49           HZ2      TRP  49  -0.953  -5.162   9.073
  334    HZ3  TRP  49           HZ3      TRP  49  -4.004  -5.050   6.054
  335    HH2  TRP  49           HH2      TRP  49  -2.697  -6.315   7.737
  336    H    CYS  50           H        CYS  50  -1.096   2.540   4.240
  337    HA   CYS  50           HA       CYS  50   1.632   3.066   5.353
  338    HB2  CYS  50           HB3      CYS  50   1.160   3.206   2.802
  339    HB3  CYS  50           HB2      CYS  50   0.311   4.703   3.191
  340    H    ILE  51           H        ILE  51   1.729   4.524   6.994
  341    HA   ILE  51           HA       ILE  51  -0.637   6.296   7.411
  342    HB   ILE  51           HB       ILE  51   1.315   5.232   9.469
  343   HG12  ILE  51          HG13      ILE  51  -1.584   4.482   8.979
  344   HG13  ILE  51          HG12      ILE  51  -0.213   3.520   8.427
  345   HG21  ILE  51          HG21      ILE  51   0.444   6.805  10.822
  346   HG22  ILE  51          HG22      ILE  51  -1.164   6.130  10.554
  347   HG23  ILE  51          HG23      ILE  51  -0.555   7.405   9.498
  348   HD11  ILE  51          HD11      ILE  51  -0.926   2.588  10.527
  349   HD12  ILE  51          HD12      ILE  51  -0.959   4.180  11.286
  350   HD13  ILE  51          HD13      ILE  51   0.581   3.452  10.830
  351    H    ALA  52           H        ALA  52  -0.294   8.462   7.543
  352    HA   ALA  52           HA       ALA  52   2.200   9.665   8.331
  353    HB1  ALA  52           HB1      ALA  52   1.579  10.084   5.416
  354    HB2  ALA  52           HB2      ALA  52   2.605   8.742   5.925
  355    HB3  ALA  52           HB3      ALA  52   3.083  10.402   6.282
  356    H    LEU  53           H        LEU  53  -0.527  10.253   6.099
  357    HA   LEU  53           HA       LEU  53  -1.229  12.639   7.758
  358    HB2  LEU  53           HB3      LEU  53  -0.104  13.312   5.616
  359    HB3  LEU  53           HB2      LEU  53  -1.397  12.500   4.732
  360    HG   LEU  53           HG       LEU  53  -2.660  14.152   6.654
  361   HD11  LEU  53          HD11      LEU  53  -0.471  15.351   6.787
  362   HD12  LEU  53          HD12      LEU  53  -1.762  16.361   6.137
  363   HD13  LEU  53          HD13      LEU  53  -0.566  15.653   5.052
  364   HD21  LEU  53          HD21      LEU  53  -2.268  14.323   3.654
  365   HD22  LEU  53          HD22      LEU  53  -3.359  15.389   4.540
  366   HD23  LEU  53          HD23      LEU  53  -3.648  13.650   4.521
  367    HA   PRO  54           HA       PRO  54  -4.730   9.566   7.371
  368    HB2  PRO  54           HB2      PRO  54  -5.345  10.793   9.993
  369    HB3  PRO  54           HB3      PRO  54  -5.269   9.083   9.534
  370    HG2  PRO  54           HG3      PRO  54  -3.376  10.249  11.031
  371    HG3  PRO  54           HG2      PRO  54  -3.016   8.949   9.884
  372    HD2  PRO  54           HD3      PRO  54  -2.470  11.874   9.643
  373    HD3  PRO  54           HD2      PRO  54  -1.560  10.495   8.987
  374    H    ASP  55           H        ASP  55  -4.548  13.003   7.968
  375    HA   ASP  55           HA       ASP  55  -7.237  13.754   8.108
  376    HB2  ASP  55           HB3      ASP  55  -4.981  15.049   6.545
  377    HB3  ASP  55           HB2      ASP  55  -6.544  15.815   6.830
  378    H    ASN  56           H        ASN  56  -5.376  12.649   5.335
  379    HA   ASN  56           HA       ASN  56  -7.842  12.767   3.663
  380    HB2  ASN  56           HB3      ASN  56  -4.912  12.602   2.925
  381    HB3  ASN  56           HB2      ASN  56  -6.228  12.496   1.753
  382   HD21  ASN  56          HD22      ASN  56  -7.285  14.544   4.182
  383   HD22  ASN  56          HD21      ASN  56  -6.835  16.031   3.498
  384    H    VAL  57           H        VAL  57  -8.817  10.822   3.255
  385    HA   VAL  57           HA       VAL  57  -7.121   8.380   3.231
  386    HB   VAL  57           HB       VAL  57  -9.774   8.591   4.683
  387   HG11  VAL  57          HG11      VAL  57  -8.701   6.323   5.578
  388   HG12  VAL  57          HG12      VAL  57  -7.885   6.370   4.015
  389   HG13  VAL  57          HG13      VAL  57  -9.647   6.357   4.090
  390   HG21  VAL  57          HG21      VAL  57  -7.996   7.966   6.603
  391   HG22  VAL  57          HG22      VAL  57  -8.393   9.637   6.200
  392   HG23  VAL  57          HG23      VAL  57  -6.935   8.894   5.543
  393    HA   PRO  58           HA       PRO  58 -10.251   8.349  -0.191
  394    HB2  PRO  58           HB2      PRO  58  -8.810   9.194  -2.260
  395    HB3  PRO  58           HB3      PRO  58  -9.362  10.360  -1.038
  396    HG2  PRO  58           HG3      PRO  58  -6.669   9.166  -1.433
  397    HG3  PRO  58           HG2      PRO  58  -7.114  10.804  -0.924
  398    HD2  PRO  58           HD3      PRO  58  -6.378   8.655   0.779
  399    HD3  PRO  58           HD2      PRO  58  -7.087  10.206   1.283
  400    H    ILE  59           H        ILE  59 -10.434   6.677  -1.814
  401    HA   ILE  59           HA       ILE  59  -8.056   4.913  -2.106
  402    HB   ILE  59           HB       ILE  59 -10.931   4.005  -1.774
  403   HG12  ILE  59          HG13      ILE  59  -8.618   3.604   0.130
  404   HG13  ILE  59          HG12      ILE  59  -9.708   4.983   0.270
  405   HG21  ILE  59          HG21      ILE  59  -8.405   2.349  -1.687
  406   HG22  ILE  59          HG22      ILE  59  -9.270   2.637  -3.193
  407   HG23  ILE  59          HG23      ILE  59 -10.067   1.791  -1.866
  408   HD11  ILE  59          HD11      ILE  59 -10.461   2.054   0.402
  409   HD12  ILE  59          HD12      ILE  59 -11.629   3.375   0.356
  410   HD13  ILE  59          HD13      ILE  59 -10.522   3.225   1.720
  411    H    ARG  60           H        ARG  60  -7.519   4.782  -4.199
  412    HA   ARG  60           HA       ARG  60  -8.949   5.985  -6.292
  413    HB2  ARG  60           HB3      ARG  60  -6.602   5.426  -6.535
  414    HB3  ARG  60           HB2      ARG  60  -6.961   3.704  -6.403
  415    HG2  ARG  60           HG3      ARG  60  -6.634   4.463  -8.768
  416    HG3  ARG  60           HG2      ARG  60  -8.222   3.755  -8.483
  417    HD2  ARG  60           HD3      ARG  60  -9.297   5.843  -8.512
  418    HD3  ARG  60           HD2      ARG  60  -7.800   6.725  -8.212
  419    HE   ARG  60           HE       ARG  60  -7.351   6.643 -10.538
  420   HH11  ARG  60          HH22      ARG  60  -9.848   4.462  -9.591
  421   HH12  ARG  60          HH21      ARG  60 -10.285   4.048 -11.215
  422   HH21  ARG  60          HH11      ARG  60  -7.907   6.114 -12.664
  423   HH22  ARG  60          HH12      ARG  60  -9.187   4.985 -12.955
  424    H    ILE  61           H        ILE  61  -9.153   2.652  -5.111
  425    HA   ILE  61           HA       ILE  61 -11.540   2.315  -6.875
  426    HB   ILE  61           HB       ILE  61 -10.734  -0.190  -6.896
  427   HG12  ILE  61          HG13      ILE  61  -8.230  -0.310  -6.982
  428   HG13  ILE  61          HG12      ILE  61  -8.161   1.339  -6.366
  429   HG21  ILE  61          HG21      ILE  61  -9.056   0.663  -8.833
  430   HG22  ILE  61          HG22      ILE  61  -9.958   2.151  -8.545
  431   HG23  ILE  61          HG23      ILE  61 -10.811   0.678  -9.010
  432   HD11  ILE  61          HD11      ILE  61  -9.841  -0.575  -4.831
  433   HD12  ILE  61          HD12      ILE  61  -8.790   0.716  -4.252
  434   HD13  ILE  61          HD13      ILE  61  -8.099  -0.822  -4.757
  435    HA   PRO  62           HA       PRO  62 -13.767   1.052  -3.291
  436    HB2  PRO  62           HB2      PRO  62 -15.046  -1.234  -4.299
  437    HB3  PRO  62           HB3      PRO  62 -15.644   0.430  -4.418
  438    HG2  PRO  62           HG3      PRO  62 -14.239  -1.224  -6.433
  439    HG3  PRO  62           HG2      PRO  62 -15.478   0.023  -6.652
  440    HD2  PRO  62           HD3      PRO  62 -12.865   0.482  -7.212
  441    HD3  PRO  62           HD2      PRO  62 -13.936   1.761  -6.595
  442    H    GLY  63           H        GLY  63 -11.612  -1.170  -4.863
  443    HA2  GLY  63           HA3      GLY  63 -10.182  -2.202  -2.872
  444    HA3  GLY  63           HA2      GLY  63 -11.698  -3.053  -2.580
  445    H    LYS  64           H        LYS  64 -10.728  -2.246  -5.832
  446    HA   LYS  64           HA       LYS  64 -10.393  -5.151  -6.375
  447    HB2  LYS  64           HB3      LYS  64 -11.023  -2.832  -8.224
  448    HB3  LYS  64           HB2      LYS  64 -10.804  -4.501  -8.754
  449    HG2  LYS  64           HG3      LYS  64 -12.668  -5.210  -7.297
  450    HG3  LYS  64           HG2      LYS  64 -12.893  -3.539  -6.775
  451    HD2  LYS  64           HD3      LYS  64 -14.494  -4.030  -8.542
  452    HD3  LYS  64           HD2      LYS  64 -13.293  -2.897  -9.160
  453    HE2  LYS  64           HE3      LYS  64 -12.284  -4.488 -10.513
  454    HE3  LYS  64           HE2      LYS  64 -12.794  -5.832  -9.492
  455    HZ1  LYS  64           HZ1      LYS  64 -14.507  -6.120 -10.840
  456    HZ2  LYS  64           HZ2      LYS  64 -14.072  -4.764 -11.761
  457    HZ3  LYS  64           HZ3      LYS  64 -15.096  -4.584 -10.417
  458    H    CYS  65           H        CYS  65  -8.569  -5.870  -7.562
  459    HA   CYS  65           HA       CYS  65  -6.331  -3.892  -7.734
  460    HB2  CYS  65           HB3      CYS  65  -6.231  -6.874  -7.192
  461    HB3  CYS  65           HB2      CYS  65  -4.820  -5.832  -7.373
  462    H    HIS  66           H        HIS  66  -4.788  -4.327  -9.512
  463    HA   HIS  66           HA       HIS  66  -4.472  -4.552 -11.833
  464    HB2  HIS  66           HB3      HIS  66  -5.743  -7.246 -11.269
  465    HB3  HIS  66           HB2      HIS  66  -4.700  -6.849 -12.634
  466    HD1  HIS  66           HD1      HIS  66  -2.221  -5.859 -11.816
  467    HD2  HIS  66           HD2      HIS  66  -4.321  -8.263  -9.130
  468    HE1  HIS  66           HE1      HIS  66  -0.530  -6.683 -10.116
  469    HE2  HIS  66           HE2      HIS  66  -1.798  -8.146  -8.478
  Start of MODEL   10
    1    H1   ALA   1           H1       ALA   1  -2.767  11.947   5.112
    2    H2   ALA   1           H2       ALA   1  -2.189  10.743   4.062
    3    H3   ALA   1           H3       ALA   1  -1.687  10.772   5.685
    4    HA   ALA   1           HA       ALA   1  -4.187  10.534   6.213
    5    HB1  ALA   1           HB1      ALA   1  -4.111   9.156   3.531
    6    HB2  ALA   1           HB2      ALA   1  -4.646  10.830   3.677
    7    HB3  ALA   1           HB3      ALA   1  -5.513   9.550   4.526
    8    H    ARG   2           H        ARG   2  -4.932   7.935   5.888
    9    HA   ARG   2           HA       ARG   2  -2.461   6.360   6.502
   10    HB2  ARG   2           HB3      ARG   2  -3.742   6.920   8.566
   11    HB3  ARG   2           HB2      ARG   2  -5.154   6.118   7.877
   12    HG2  ARG   2           HG3      ARG   2  -3.817   4.016   7.688
   13    HG3  ARG   2           HG2      ARG   2  -2.482   4.831   8.503
   14    HD2  ARG   2           HD3      ARG   2  -5.260   4.422   9.650
   15    HD3  ARG   2           HD2      ARG   2  -3.819   3.513  10.106
   16    HE   ARG   2           HE       ARG   2  -3.014   6.064  10.601
   17   HH11  ARG   2          HH22      ARG   2  -5.910   4.323  11.290
   18   HH12  ARG   2          HH21      ARG   2  -6.255   5.207  12.740
   19   HH21  ARG   2          HH11      ARG   2  -3.449   7.228  12.490
   20   HH22  ARG   2          HH12      ARG   2  -4.862   6.851  13.418
   21    H    ASP   3           H        ASP   3  -2.300   4.510   5.319
   22    HA   ASP   3           HA       ASP   3  -4.715   3.631   3.805
   23    HB2  ASP   3           HB3      ASP   3  -2.303   4.310   2.776
   24    HB3  ASP   3           HB2      ASP   3  -2.046   2.585   3.048
   25    H    ALA   4           H        ALA   4  -5.119   1.319   3.686
   26    HA   ALA   4           HA       ALA   4  -4.122  -0.088   6.100
   27    HB1  ALA   4           HB1      ALA   4  -6.401  -0.323   6.205
   28    HB2  ALA   4           HB2      ALA   4  -6.050  -1.723   5.191
   29    HB3  ALA   4           HB3      ALA   4  -6.596  -0.215   4.455
   30    H    TYR   5           H        TYR   5  -5.286  -1.548   3.088
   31    HA   TYR   5           HA       TYR   5  -2.844  -3.250   3.087
   32    HB2  TYR   5           HB3      TYR   5  -5.255  -3.585   1.303
   33    HB3  TYR   5           HB2      TYR   5  -4.097  -4.810   1.821
   34    HD1  TYR   5           HD2      TYR   5  -4.155  -5.717   4.113
   35    HD2  TYR   5           HD1      TYR   5  -7.048  -2.853   2.746
   36    HE1  TYR   5           HE2      TYR   5  -5.598  -6.249   6.059
   37    HE2  TYR   5           HE1      TYR   5  -8.495  -3.386   4.692
   38    HH   TYR   5           HH       TYR   5  -8.718  -5.612   6.260
   39    H    ILE   6           H        ILE   6  -3.949  -0.456   1.625
   40    HA   ILE   6           HA       ILE   6  -2.526  -1.030  -0.925
   41    HB   ILE   6           HB       ILE   6  -4.387   1.259  -0.235
   42   HG12  ILE   6          HG13      ILE   6  -4.899  -1.240  -1.880
   43   HG13  ILE   6          HG12      ILE   6  -5.488  -0.987  -0.237
   44   HG21  ILE   6          HG21      ILE   6  -2.544   0.844  -2.368
   45   HG22  ILE   6          HG22      ILE   6  -3.723   2.144  -2.191
   46   HG23  ILE   6          HG23      ILE   6  -4.169   0.655  -3.025
   47   HD11  ILE   6          HD11      ILE   6  -6.308   0.385  -2.774
   48   HD12  ILE   6          HD12      ILE   6  -6.442   1.254  -1.246
   49   HD13  ILE   6          HD13      ILE   6  -7.317  -0.259  -1.479
   50    H    ALA   7           H        ALA   7  -0.807   0.280  -1.575
   51    HA   ALA   7           HA       ALA   7   0.013   2.476   0.251
   52    HB1  ALA   7           HB1      ALA   7   1.559   0.003  -0.443
   53    HB2  ALA   7           HB2      ALA   7   1.445   0.852   1.099
   54    HB3  ALA   7           HB3      ALA   7   2.433   1.516  -0.202
   55    H    LYS   8           H        LYS   8  -0.455   1.260  -2.857
   56    HA   LYS   8           HA       LYS   8   1.330   3.304  -4.079
   57    HB2  LYS   8           HB3      LYS   8  -0.123   1.468  -5.872
   58    HB3  LYS   8           HB2      LYS   8   1.592   1.880  -5.840
   59    HG2  LYS   8           HG3      LYS   8   1.680   0.448  -3.675
   60    HG3  LYS   8           HG2      LYS   8   0.135  -0.205  -4.224
   61    HD2  LYS   8           HD3      LYS   8   2.734  -0.219  -5.787
   62    HD3  LYS   8           HD2      LYS   8   1.973  -1.616  -5.025
   63    HE2  LYS   8           HE3      LYS   8  -0.108  -0.837  -6.490
   64    HE3  LYS   8           HE2      LYS   8   1.162  -0.120  -7.483
   65    HZ1  LYS   8           HZ1      LYS   8   1.316  -2.925  -6.571
   66    HZ2  LYS   8           HZ2      LYS   8   2.140  -2.182  -7.855
   67    HZ3  LYS   8           HZ3      LYS   8   0.475  -2.501  -7.986
   68    HA   PRO   9           HA       PRO   9  -1.690   6.251  -5.305
   69    HB2  PRO   9           HB2      PRO   9  -1.248   5.157  -8.077
   70    HB3  PRO   9           HB3      PRO   9  -1.396   6.847  -7.552
   71    HG2  PRO   9           HG3      PRO   9   0.980   5.736  -8.002
   72    HG3  PRO   9           HG2      PRO   9   0.734   6.903  -6.692
   73    HD2  PRO   9           HD3      PRO   9   1.246   4.001  -6.517
   74    HD3  PRO   9           HD2      PRO   9   1.440   5.252  -5.271
   75    H    HIS  10           H        HIS  10  -2.863   4.785  -8.114
   76    HA   HIS  10           HA       HIS  10  -5.364   4.075  -6.735
   77    HB2  HIS  10           HB3      HIS  10  -4.629   4.098  -9.679
   78    HB3  HIS  10           HB2      HIS  10  -6.243   3.785  -9.043
   79    HD1  HIS  10           HD1      HIS  10  -3.669   6.531  -9.362
   80    HD2  HIS  10           HD2      HIS  10  -7.648   6.082  -8.192
   81    HE1  HIS  10           HE1      HIS  10  -4.608   8.870  -9.097
   82    HE2  HIS  10           HE2      HIS  10  -7.028   8.608  -8.385
   83    H    ASN  11           H        ASN  11  -2.535   2.504  -7.377
   84    HA   ASN  11           HA       ASN  11  -3.857  -0.111  -7.934
   85    HB2  ASN  11           HB3      ASN  11  -0.922   0.644  -8.031
   86    HB3  ASN  11           HB2      ASN  11  -1.615  -0.901  -8.531
   87   HD21  ASN  11          HD22      ASN  11  -0.442   1.860  -9.860
   88   HD22  ASN  11          HD21      ASN  11  -1.415   1.966 -11.247
   89    H    CYS  12           H        CYS  12  -3.266  -1.948  -6.598
   90    HA   CYS  12           HA       CYS  12  -2.451  -1.136  -3.838
   91    HB2  CYS  12           HB3      CYS  12  -3.821  -3.721  -4.587
   92    HB3  CYS  12           HB2      CYS  12  -3.754  -2.936  -3.010
   93    H    VAL  13           H        VAL  13  -1.118  -2.771  -2.651
   94    HA   VAL  13           HA       VAL  13   1.147  -3.599  -4.216
   95    HB   VAL  13           HB       VAL  13   0.331  -4.482  -1.430
   96   HG11  VAL  13          HG11      VAL  13   2.788  -4.878  -1.186
   97   HG12  VAL  13          HG12      VAL  13   2.982  -4.528  -2.903
   98   HG13  VAL  13          HG13      VAL  13   2.044  -5.930  -2.391
   99   HG21  VAL  13          HG21      VAL  13   1.672  -2.043  -2.536
  100   HG22  VAL  13          HG22      VAL  13   2.233  -2.673  -0.987
  101   HG23  VAL  13          HG23      VAL  13   0.549  -2.184  -1.184
  102    H    TYR  14           H        TYR  14   1.558  -5.534  -5.205
  103    HA   TYR  14           HA       TYR  14  -0.633  -7.446  -5.462
  104    HB2  TYR  14           HB3      TYR  14   0.728  -8.532  -7.100
  105    HB3  TYR  14           HB2      TYR  14   1.006  -6.804  -7.310
  106    HD1  TYR  14           HD2      TYR  14   3.074  -5.747  -6.383
  107    HD2  TYR  14           HD1      TYR  14   2.480 -10.001  -6.374
  108    HE1  TYR  14           HE2      TYR  14   5.498  -6.085  -5.988
  109    HE2  TYR  14           HE1      TYR  14   4.905 -10.338  -5.979
  110    HH   TYR  14           HH       TYR  14   6.897  -9.356  -5.839
  111    H    GLU  15           H        GLU  15   2.468  -7.308  -3.784
  112    HA   GLU  15           HA       GLU  15   1.631  -9.369  -1.924
  113    HB2  GLU  15           HB3      GLU  15   2.362 -10.690  -3.987
  114    HB3  GLU  15           HB2      GLU  15   3.988 -10.066  -3.691
  115    HG2  GLU  15           HG3      GLU  15   3.903 -11.014  -1.392
  116    HG3  GLU  15           HG2      GLU  15   2.329 -11.719  -1.766
  117    H    CYS  16           H        CYS  16   2.259  -7.830  -0.335
  118    HA   CYS  16           HA       CYS  16   4.730  -6.406  -0.390
  119    HB2  CYS  16           HB3      CYS  16   3.438  -5.496   1.265
  120    HB3  CYS  16           HB2      CYS  16   2.685  -7.038   1.668
  121    H    PHE  17           H        PHE  17   6.733  -6.900   0.606
  122    HA   PHE  17           HA       PHE  17   7.127  -9.806   1.196
  123    HB2  PHE  17           HB3      PHE  17   8.360  -9.382  -0.754
  124    HB3  PHE  17           HB2      PHE  17   8.838  -7.775  -0.218
  125    HD1  PHE  17           HD2      PHE  17   9.426 -11.400   0.178
  126    HD2  PHE  17           HD1      PHE  17  10.701  -7.456   1.305
  127    HE1  PHE  17           HE2      PHE  17  11.510 -12.347   1.133
  128    HE2  PHE  17           HE1      PHE  17  12.784  -8.402   2.261
  129    HZ   PHE  17           HZ       PHE  17  13.190 -10.847   2.173
  130    H    ASP  18           H        ASP  18   9.019 -10.185   2.735
  131    HA   ASP  18           HA       ASP  18   8.597  -9.099   5.232
  132    HB2  ASP  18           HB3      ASP  18  11.256  -9.944   4.043
  133    HB3  ASP  18           HB2      ASP  18  10.980  -9.673   5.763
  134    H    ALA  19           H        ALA  19   9.101  -7.219   6.289
  135    HA   ALA  19           HA       ALA  19   9.809  -4.904   4.731
  136    HB1  ALA  19           HB1      ALA  19   8.484  -4.331   6.540
  137    HB2  ALA  19           HB2      ALA  19  10.078  -3.945   7.189
  138    HB3  ALA  19           HB3      ALA  19   9.292  -5.463   7.624
  139    H    PHE  20           H        PHE  20  11.736  -7.346   6.058
  140    HA   PHE  20           HA       PHE  20  13.990  -6.010   7.069
  141    HB2  PHE  20           HB3      PHE  20  13.714  -8.505   6.932
  142    HB3  PHE  20           HB2      PHE  20  14.062  -8.406   5.206
  143    HD1  PHE  20           HD1      PHE  20  15.449  -7.871   8.600
  144    HD2  PHE  20           HD2      PHE  20  16.296  -8.022   4.392
  145    HE1  PHE  20           HE1      PHE  20  17.880  -7.870   9.089
  146    HE2  PHE  20           HE2      PHE  20  18.726  -8.020   4.881
  147    HZ   PHE  20           HZ       PHE  20  19.519  -7.944   7.229
  148    H    SER  21           H        SER  21  13.123  -6.661   3.674
  149    HA   SER  21           HA       SER  21  15.442  -5.116   2.725
  150    HB2  SER  21           HB3      SER  21  13.137  -6.399   1.230
  151    HB3  SER  21           HB2      SER  21  14.517  -5.617   0.467
  152    HG   SER  21           HG       SER  21  14.481  -7.920   2.123
  153    H    SER  22           H        SER  22  12.677  -4.234   4.133
  154    HA   SER  22           HA       SER  22  11.347  -2.302   4.091
  155    HB2  SER  22           HB3      SER  22  13.657  -1.201   2.465
  156    HB3  SER  22           HB2      SER  22  12.453  -0.262   3.343
  157    HG   SER  22           HG       SER  22  14.647  -1.688   4.260
  158    H    TYR  23           H        TYR  23  11.371  -4.300   1.735
  159    HA   TYR  23           HA       TYR  23  10.860  -2.918  -0.690
  160    HB2  TYR  23           HB3      TYR  23  11.120  -5.376  -0.542
  161    HB3  TYR  23           HB2      TYR  23   9.573  -5.477   0.301
  162    HD1  TYR  23           HD1      TYR  23   7.464  -4.965  -0.853
  163    HD2  TYR  23           HD2      TYR  23  11.229  -4.896  -2.921
  164    HE1  TYR  23           HE1      TYR  23   6.271  -4.984  -3.029
  165    HE2  TYR  23           HE2      TYR  23  10.037  -4.912  -5.095
  166    HH   TYR  23           HH       TYR  23   7.411  -5.858  -5.742
  167    H    CYS  24           H        CYS  24   8.557  -3.973   1.832
  168    HA   CYS  24           HA       CYS  24   6.264  -2.788   0.574
  169    HB2  CYS  24           HB3      CYS  24   5.953  -4.462   2.303
  170    HB3  CYS  24           HB2      CYS  24   6.810  -3.465   3.478
  171    H    ASN  25           H        ASN  25   8.409  -1.634   3.170
  172    HA   ASN  25           HA       ASN  25   7.144   0.885   3.552
  173    HB2  ASN  25           HB3      ASN  25  10.082   0.186   3.845
  174    HB3  ASN  25           HB2      ASN  25   9.282   1.590   4.554
  175   HD21  ASN  25          HD22      ASN  25   7.200  -1.118   4.479
  176   HD22  ASN  25          HD21      ASN  25   7.405  -1.617   6.089
  177    H    GLY  26           H        GLY  26   9.617  -0.181   1.258
  178    HA2  GLY  26           HA3      GLY  26  10.286   2.375   0.192
  179    HA3  GLY  26           HA2      GLY  26  10.430   0.852  -0.687
  180    H    VAL  27           H        VAL  27   7.719   0.065  -0.693
  181    HA   VAL  27           HA       VAL  27   6.718   1.550  -2.924
  182    HB   VAL  27           HB       VAL  27   5.297  -0.341  -1.026
  183   HG11  VAL  27          HG11      VAL  27   3.570   0.882  -2.084
  184   HG12  VAL  27          HG12      VAL  27   3.756  -0.550  -3.096
  185   HG13  VAL  27          HG13      VAL  27   4.458   0.986  -3.604
  186   HG21  VAL  27          HG21      VAL  27   7.330  -0.880  -2.786
  187   HG22  VAL  27          HG22      VAL  27   5.912  -1.120  -3.809
  188   HG23  VAL  27          HG23      VAL  27   6.090  -2.044  -2.317
  189    H    CYS  28           H        CYS  28   5.859   1.574   0.523
  190    HA   CYS  28           HA       CYS  28   3.761   3.514   0.312
  191    HB2  CYS  28           HB3      CYS  28   4.266   2.017   2.309
  192    HB3  CYS  28           HB2      CYS  28   5.589   3.117   2.695
  193    H    THR  29           H        THR  29   7.260   3.775   0.582
  194    HA   THR  29           HA       THR  29   7.462   6.521   1.270
  195    HB   THR  29           HB       THR  29   9.310   4.965  -0.560
  196    HG1  THR  29           HG1      THR  29  10.174   4.136   1.219
  197   HG21  THR  29          HG21      THR  29   9.826   7.319  -0.579
  198   HG22  THR  29          HG22      THR  29  11.007   6.527   0.464
  199   HG23  THR  29          HG23      THR  29   9.664   7.421   1.173
  200    H    LYS  30           H        LYS  30   7.111   4.970  -1.913
  201    HA   LYS  30           HA       LYS  30   7.423   7.313  -3.493
  202    HB2  LYS  30           HB3      LYS  30   5.902   4.741  -3.903
  203    HB3  LYS  30           HB2      LYS  30   5.818   6.036  -5.096
  204    HG2  LYS  30           HG3      LYS  30   7.597   4.628  -5.817
  205    HG3  LYS  30           HG2      LYS  30   8.383   6.019  -5.073
  206    HD2  LYS  30           HD3      LYS  30   8.750   4.789  -3.019
  207    HD3  LYS  30           HD2      LYS  30   7.798   3.430  -3.616
  208    HE2  LYS  30           HE3      LYS  30   9.436   2.774  -5.137
  209    HE3  LYS  30           HE2      LYS  30  10.164   4.379  -5.197
  210    HZ1  LYS  30           HZ1      LYS  30  10.990   2.256  -3.664
  211    HZ2  LYS  30           HZ2      LYS  30  10.234   3.304  -2.565
  212    HZ3  LYS  30           HZ3      LYS  30  11.513   3.868  -3.531
  213    H    ASN  31           H        ASN  31   4.698   6.123  -1.623
  214    HA   ASN  31           HA       ASN  31   2.602   7.654  -2.711
  215    HB2  ASN  31           HB3      ASN  31   2.412   5.978  -0.829
  216    HB3  ASN  31           HB2      ASN  31   3.068   7.208   0.252
  217   HD21  ASN  31          HD22      ASN  31   0.369   6.698  -2.079
  218   HD22  ASN  31          HD21      ASN  31  -0.717   7.725  -1.275
  219    H    GLY  32           H        GLY  32   5.239   8.620  -0.570
  220    HA2  GLY  32           HA3      GLY  32   5.536  11.228  -1.317
  221    HA3  GLY  32           HA2      GLY  32   4.160  11.324  -0.218
  222    H    ALA  33           H        ALA  33   5.058   9.196   1.540
  223    HA   ALA  33           HA       ALA  33   7.616   9.291   2.572
  224    HB1  ALA  33           HB1      ALA  33   7.853  11.555   2.912
  225    HB2  ALA  33           HB2      ALA  33   7.036  11.152   4.422
  226    HB3  ALA  33           HB3      ALA  33   6.114  11.808   3.069
  227    H    LYS  34           H        LYS  34   4.263   9.026   2.967
  228    HA   LYS  34           HA       LYS  34   3.759   8.584   5.635
  229    HB2  LYS  34           HB3      LYS  34   2.932   6.771   3.355
  230    HB3  LYS  34           HB2      LYS  34   2.227   6.743   4.968
  231    HG2  LYS  34           HG3      LYS  34   1.631   9.177   4.653
  232    HG3  LYS  34           HG2      LYS  34   2.138   9.010   2.971
  233    HD2  LYS  34           HD3      LYS  34   0.534   7.147   2.684
  234    HD3  LYS  34           HD2      LYS  34  -0.001   7.367   4.349
  235    HE2  LYS  34           HE3      LYS  34  -1.357   9.068   3.758
  236    HE3  LYS  34           HE2      LYS  34  -0.037   9.895   2.931
  237    HZ1  LYS  34           HZ1      LYS  34  -0.778   9.210   0.969
  238    HZ2  LYS  34           HZ2      LYS  34  -2.194   8.695   1.749
  239    HZ3  LYS  34           HZ3      LYS  34  -0.922   7.599   1.490
  240    H    SER  35           H        SER  35   4.282   7.071   7.161
  241    HA   SER  35           HA       SER  35   6.021   4.806   6.304
  242    HB2  SER  35           HB3      SER  35   7.209   5.061   8.489
  243    HB3  SER  35           HB2      SER  35   7.422   6.454   7.429
  244    HG   SER  35           HG       SER  35   6.858   7.236   9.422
  245    H    GLY  36           H        GLY  36   4.834   2.992   6.637
  246    HA2  GLY  36           HA3      GLY  36   3.346   2.762   9.207
  247    HA3  GLY  36           HA2      GLY  36   2.575   2.283   7.700
  248    H    TYR  37           H        TYR  37   2.431   0.060   8.057
  249    HA   TYR  37           HA       TYR  37   5.029  -1.396   8.153
  250    HB2  TYR  37           HB3      TYR  37   2.663  -2.349   9.753
  251    HB3  TYR  37           HB2      TYR  37   4.356  -2.813   9.911
  252    HD1  TYR  37           HD2      TYR  37   6.032  -0.997  10.660
  253    HD2  TYR  37           HD1      TYR  37   1.769  -0.606  11.042
  254    HE1  TYR  37           HE2      TYR  37   6.350   0.760  12.380
  255    HE2  TYR  37           HE1      TYR  37   2.092   1.148  12.773
  256    HH   TYR  37           HH       TYR  37   5.072   1.730  14.273
  257    H    CYS  38           H        CYS  38   4.598  -3.821   7.665
  258    HA   CYS  38           HA       CYS  38   2.655  -3.925   5.428
  259    HB2  CYS  38           HB3      CYS  38   4.862  -4.581   4.753
  260    HB3  CYS  38           HB2      CYS  38   5.029  -5.655   6.144
  261    H    GLN  39           H        GLN  39   0.799  -5.014   5.691
  262    HA   GLN  39           HA       GLN  39   0.631  -7.011   7.915
  263    HB2  GLN  39           HB3      GLN  39  -1.508  -5.160   6.821
  264    HB3  GLN  39           HB2      GLN  39  -1.791  -6.418   8.027
  265    HG2  GLN  39           HG3      GLN  39  -0.099  -5.351   9.503
  266    HG3  GLN  39           HG2      GLN  39   0.094  -4.062   8.316
  267   HE21  GLN  39          HE22      GLN  39  -3.105  -4.903   8.101
  268   HE22  GLN  39          HE21      GLN  39  -3.764  -3.807   9.218
  269    H    ILE  40           H        ILE  40  -1.547  -8.408   7.377
  270    HA   ILE  40           HA       ILE  40  -1.055  -9.474   4.634
  271    HB   ILE  40           HB       ILE  40  -1.856 -11.618   5.474
  272   HG12  ILE  40          HG13      ILE  40  -2.254 -10.155   8.108
  273   HG13  ILE  40          HG12      ILE  40  -3.552 -10.719   7.055
  274   HG21  ILE  40          HG21      ILE  40   0.170 -12.069   6.364
  275   HG22  ILE  40          HG22      ILE  40  -0.122 -11.013   7.746
  276   HG23  ILE  40          HG23      ILE  40   0.497 -10.341   6.236
  277   HD11  ILE  40          HD11      ILE  40  -3.197 -12.356   8.824
  278   HD12  ILE  40          HD12      ILE  40  -1.479 -12.448   8.433
  279   HD13  ILE  40          HD13      ILE  40  -2.678 -13.044   7.286
  280    H    LEU  41           H        LEU  41  -2.929 -10.272   3.439
  281    HA   LEU  41           HA       LEU  41  -5.194  -8.460   3.674
  282    HB2  LEU  41           HB3      LEU  41  -4.817 -10.853   1.852
  283    HB3  LEU  41           HB2      LEU  41  -5.990  -9.555   1.648
  284    HG   LEU  41           HG       LEU  41  -2.975  -9.273   1.565
  285   HD11  LEU  41          HD11      LEU  41  -4.637 -10.145  -0.415
  286   HD12  LEU  41          HD12      LEU  41  -3.144  -9.255  -0.709
  287   HD13  LEU  41          HD13      LEU  41  -4.688  -8.403  -0.685
  288   HD21  LEU  41          HD21      LEU  41  -3.626  -7.223   2.449
  289   HD22  LEU  41          HD22      LEU  41  -5.223  -7.295   1.706
  290   HD23  LEU  41          HD23      LEU  41  -3.812  -6.899   0.725
  291    H    GLY  42           H        GLY  42  -7.317  -9.031   4.287
  292    HA2  GLY  42           HA3      GLY  42  -7.674 -10.984   6.291
  293    HA3  GLY  42           HA2      GLY  42  -8.995 -10.289   5.349
  294    H    THR  43           H        THR  43  -8.010 -11.231   2.786
  295    HA   THR  43           HA       THR  43  -8.883 -14.049   3.023
  296    HB   THR  43           HB       THR  43  -9.082 -13.922   0.541
  297    HG1  THR  43           HG1      THR  43  -8.594 -11.169   0.752
  298   HG21  THR  43          HG21      THR  43 -11.127 -12.941   0.710
  299   HG22  THR  43          HG22      THR  43 -10.462 -11.447   1.371
  300   HG23  THR  43          HG23      THR  43 -10.734 -12.834   2.426
  301    H    TYR  44           H        TYR  44  -7.217 -13.807   0.199
  302    HA   TYR  44           HA       TYR  44  -4.746 -14.955   1.439
  303    HB2  TYR  44           HB3      TYR  44  -5.907 -15.426  -1.326
  304    HB3  TYR  44           HB2      TYR  44  -4.454 -16.186  -0.675
  305    HD1  TYR  44           HD2      TYR  44  -4.632 -17.695   1.332
  306    HD2  TYR  44           HD1      TYR  44  -8.084 -16.226  -0.760
  307    HE1  TYR  44           HE2      TYR  44  -6.023 -19.454   2.393
  308    HE2  TYR  44           HE1      TYR  44  -9.475 -17.985   0.301
  309    HH   TYR  44           HH       TYR  44  -9.518 -19.691   1.710
  310    H    GLY  45           H        GLY  45  -2.796 -14.013   0.920
  311    HA2  GLY  45           HA3      GLY  45  -1.520 -12.826  -0.949
  312    HA3  GLY  45           HA2      GLY  45  -2.887 -11.713  -0.995
  313    H    ASN  46           H        ASN  46  -1.079 -10.121  -0.535
  314    HA   ASN  46           HA       ASN  46  -0.857  -9.770   2.397
  315    HB2  ASN  46           HB3      ASN  46   1.276 -10.768   1.099
  316    HB3  ASN  46           HB2      ASN  46   1.543  -9.054   0.782
  317   HD21  ASN  46          HD22      ASN  46   3.217  -8.584   2.284
  318   HD22  ASN  46          HD21      ASN  46   3.068  -8.816   3.958
  319    H    GLY  47           H        GLY  47  -0.429  -7.484   2.974
  320    HA2  GLY  47           HA3      GLY  47  -0.865  -5.570   0.732
  321    HA3  GLY  47           HA2      GLY  47  -1.950  -5.517   2.120
  322    H    CYS  48           H        CYS  48  -0.396  -3.295   1.427
  323    HA   CYS  48           HA       CYS  48   1.763  -3.291   3.477
  324    HB2  CYS  48           HB3      CYS  48   1.339  -1.811   0.925
  325    HB3  CYS  48           HB2      CYS  48   2.200  -0.983   2.221
  326    H    TRP  49           H        TRP  49   1.663  -1.831   5.182
  327    HA   TRP  49           HA       TRP  49  -0.874  -0.292   5.421
  328    HB2  TRP  49           HB3      TRP  49   0.124  -2.108   7.156
  329    HB3  TRP  49           HB2      TRP  49   0.884  -0.649   7.781
  330    HD1  TRP  49           HD1      TRP  49  -0.612   1.089   8.999
  331    HE1  TRP  49           HE1      TRP  49  -3.093   1.135   9.693
  332    HE3  TRP  49           HE3      TRP  49  -2.327  -2.949   6.391
  333    HZ2  TRP  49           HZ2      TRP  49  -5.490  -0.349   9.208
  334    HZ3  TRP  49           HZ3      TRP  49  -4.710  -3.610   6.526
  335    HH2  TRP  49           HH2      TRP  49  -6.293  -2.318   7.929
  336    H    CYS  50           H        CYS  50  -0.743   1.906   5.370
  337    HA   CYS  50           HA       CYS  50   1.972   3.140   5.678
  338    HB2  CYS  50           HB3      CYS  50  -0.382   3.884   3.932
  339    HB3  CYS  50           HB2      CYS  50   0.921   5.019   4.276
  340    H    ILE  51           H        ILE  51   2.166   4.553   7.376
  341    HA   ILE  51           HA       ILE  51  -0.354   5.649   8.546
  342    HB   ILE  51           HB       ILE  51   2.103   4.725  10.052
  343   HG12  ILE  51          HG13      ILE  51  -0.667   3.497   9.903
  344   HG13  ILE  51          HG12      ILE  51   0.712   2.925   8.965
  345   HG21  ILE  51          HG21      ILE  51  -0.532   5.967  10.841
  346   HG22  ILE  51          HG22      ILE  51   1.095   6.413  11.359
  347   HG23  ILE  51          HG23      ILE  51   0.350   4.935  11.968
  348   HD11  ILE  51          HD11      ILE  51   1.705   3.070  11.558
  349   HD12  ILE  51          HD12      ILE  51   1.191   1.604  10.725
  350   HD13  ILE  51          HD13      ILE  51   0.064   2.464  11.773
  351    H    ALA  52           H        ALA  52  -0.328   7.810   9.056
  352    HA   ALA  52           HA       ALA  52   2.108   9.312   9.454
  353    HB1  ALA  52           HB1      ALA  52   0.663  10.122   6.953
  354    HB2  ALA  52           HB2      ALA  52   1.870   8.839   6.878
  355    HB3  ALA  52           HB3      ALA  52   2.329  10.448   7.432
  356    H    LEU  53           H        LEU  53  -1.313   9.421   8.510
  357    HA   LEU  53           HA       LEU  53  -1.649  11.699  10.415
  358    HB2  LEU  53           HB3      LEU  53  -2.430  11.467   7.576
  359    HB3  LEU  53           HB2      LEU  53  -3.701  12.062   8.644
  360    HG   LEU  53           HG       LEU  53  -2.116  13.762   9.537
  361   HD11  LEU  53          HD11      LEU  53  -0.125  13.952   7.657
  362   HD12  LEU  53          HD12      LEU  53  -0.276  12.205   7.838
  363   HD13  LEU  53          HD13      LEU  53   0.071  13.210   9.245
  364   HD21  LEU  53          HD21      LEU  53  -3.624  13.988   7.383
  365   HD22  LEU  53          HD22      LEU  53  -2.072  14.037   6.545
  366   HD23  LEU  53          HD23      LEU  53  -2.452  15.249   7.769
  367    HA   PRO  54           HA       PRO  54  -4.801   9.567  12.622
  368    HB2  PRO  54           HB2      PRO  54  -6.760  11.588  11.618
  369    HB3  PRO  54           HB3      PRO  54  -6.449  11.048  13.277
  370    HG2  PRO  54           HG3      PRO  54  -5.548  13.394  12.303
  371    HG3  PRO  54           HG2      PRO  54  -4.704  12.475  13.558
  372    HD2  PRO  54           HD3      PRO  54  -3.920  12.928  10.755
  373    HD3  PRO  54           HD2      PRO  54  -2.937  12.375  12.127
  374    H    ASP  55           H        ASP  55  -6.731  10.919   9.953
  375    HA   ASP  55           HA       ASP  55  -6.885   8.502   8.417
  376    HB2  ASP  55           HB3      ASP  55  -9.166   7.790   9.003
  377    HB3  ASP  55           HB2      ASP  55  -8.114   7.692  10.416
  378    H    ASN  56           H        ASN  56  -6.529  11.145   7.689
  379    HA   ASN  56           HA       ASN  56  -9.170  12.049   6.670
  380    HB2  ASN  56           HB3      ASN  56  -7.658  13.669   7.876
  381    HB3  ASN  56           HB2      ASN  56  -6.518  13.503   6.540
  382   HD21  ASN  56          HD22      ASN  56 -10.004  14.249   7.090
  383   HD22  ASN  56          HD21      ASN  56 -10.113  15.377   5.826
  384    H    VAL  57           H        VAL  57  -9.690  11.523   4.610
  385    HA   VAL  57           HA       VAL  57  -9.450  10.844   2.376
  386    HB   VAL  57           HB       VAL  57  -6.824  12.347   2.557
  387   HG11  VAL  57          HG11      VAL  57  -8.156  10.935   0.459
  388   HG12  VAL  57          HG12      VAL  57  -6.670  11.880   0.363
  389   HG13  VAL  57          HG13      VAL  57  -8.229  12.657   0.088
  390   HG21  VAL  57          HG21      VAL  57  -8.049  14.206   2.913
  391   HG22  VAL  57          HG22      VAL  57  -9.542  13.269   2.866
  392   HG23  VAL  57          HG23      VAL  57  -8.863  13.922   1.375
  393    HA   PRO  58           HA       PRO  58  -6.388   7.569   3.729
  394    HB2  PRO  58           HB2      PRO  58  -8.159   5.488   3.808
  395    HB3  PRO  58           HB3      PRO  58  -7.834   6.543   5.197
  396    HG2  PRO  58           HG3      PRO  58 -10.131   6.540   3.319
  397    HG3  PRO  58           HG2      PRO  58 -10.087   6.886   5.055
  398    HD2  PRO  58           HD3      PRO  58 -10.223   8.830   3.092
  399    HD3  PRO  58           HD2      PRO  58  -9.586   9.107   4.727
  400    H    ILE  59           H        ILE  59  -9.176   6.549   1.718
  401    HA   ILE  59           HA       ILE  59  -7.223   5.819  -0.422
  402    HB   ILE  59           HB       ILE  59  -9.872   4.485   0.219
  403   HG12  ILE  59          HG13      ILE  59  -7.046   3.445   0.582
  404   HG13  ILE  59          HG12      ILE  59  -8.034   4.092   1.894
  405   HG21  ILE  59          HG21      ILE  59  -9.233   2.864  -1.467
  406   HG22  ILE  59          HG22      ILE  59  -7.671   3.650  -1.691
  407   HG23  ILE  59          HG23      ILE  59  -9.151   4.468  -2.194
  408   HD11  ILE  59          HD11      ILE  59  -8.856   1.771   0.123
  409   HD12  ILE  59          HD12      ILE  59  -9.715   2.368   1.543
  410   HD13  ILE  59          HD13      ILE  59  -8.141   1.595   1.726
  411    H    ARG  60           H        ARG  60  -7.435   7.270  -2.051
  412    HA   ARG  60           HA       ARG  60  -9.762   8.926  -2.426
  413    HB2  ARG  60           HB3      ARG  60  -7.537   8.262  -4.380
  414    HB3  ARG  60           HB2      ARG  60  -8.650   9.627  -4.500
  415    HG2  ARG  60           HG3      ARG  60  -7.425  10.851  -3.060
  416    HG3  ARG  60           HG2      ARG  60  -7.387   9.534  -1.886
  417    HD2  ARG  60           HD3      ARG  60  -5.538   8.476  -3.083
  418    HD3  ARG  60           HD2      ARG  60  -5.599   9.726  -4.325
  419    HE   ARG  60           HE       ARG  60  -5.248  11.054  -1.858
  420   HH11  ARG  60          HH22      ARG  60  -3.657   8.751  -3.870
  421   HH12  ARG  60          HH21      ARG  60  -2.065   9.218  -3.373
  422   HH21  ARG  60          HH11      ARG  60  -3.179  11.677  -1.197
  423   HH22  ARG  60          HH12      ARG  60  -1.795  10.875  -1.860
  424    H    ILE  61           H        ILE  61  -8.642   5.903  -3.830
  425    HA   ILE  61           HA       ILE  61 -10.659   5.777  -5.891
  426    HB   ILE  61           HB       ILE  61  -9.240   3.402  -4.695
  427   HG12  ILE  61          HG13      ILE  61  -7.653   4.275  -6.787
  428   HG13  ILE  61          HG12      ILE  61  -8.081   5.776  -5.968
  429   HG21  ILE  61          HG21      ILE  61 -10.839   2.872  -6.427
  430   HG22  ILE  61          HG22      ILE  61  -9.228   2.733  -7.128
  431   HG23  ILE  61          HG23      ILE  61 -10.214   4.156  -7.463
  432   HD11  ILE  61          HD11      ILE  61  -6.651   3.370  -4.850
  433   HD12  ILE  61          HD12      ILE  61  -7.463   4.520  -3.788
  434   HD13  ILE  61          HD13      ILE  61  -6.146   5.061  -4.827
  435    HA   PRO  62           HA       PRO  62 -14.221   4.652  -3.399
  436    HB2  PRO  62           HB2      PRO  62 -14.754   2.679  -5.571
  437    HB3  PRO  62           HB3      PRO  62 -15.828   3.902  -4.870
  438    HG2  PRO  62           HG3      PRO  62 -14.657   4.184  -7.279
  439    HG3  PRO  62           HG2      PRO  62 -15.062   5.550  -6.229
  440    HD2  PRO  62           HD3      PRO  62 -12.408   4.456  -6.912
  441    HD3  PRO  62           HD2      PRO  62 -12.843   6.052  -6.264
  442    H    GLY  63           H        GLY  63 -11.635   2.626  -4.194
  443    HA2  GLY  63           HA3      GLY  63 -10.854   0.971  -2.577
  444    HA3  GLY  63           HA2      GLY  63 -12.537   0.633  -2.178
  445    H    LYS  64           H        LYS  64 -12.291   1.005  -5.491
  446    HA   LYS  64           HA       LYS  64 -12.947  -1.693  -6.084
  447    HB2  LYS  64           HB3      LYS  64 -11.636   0.372  -7.879
  448    HB3  LYS  64           HB2      LYS  64 -12.425  -1.106  -8.430
  449    HG2  LYS  64           HG3      LYS  64 -14.536  -0.315  -7.318
  450    HG3  LYS  64           HG2      LYS  64 -13.725   1.216  -6.987
  451    HD2  LYS  64           HD3      LYS  64 -14.133   0.009  -9.738
  452    HD3  LYS  64           HD2      LYS  64 -15.055   1.354  -9.063
  453    HE2  LYS  64           HE3      LYS  64 -12.602   2.340  -8.669
  454    HE3  LYS  64           HE2      LYS  64 -12.231   1.286 -10.032
  455    HZ1  LYS  64           HZ1      LYS  64 -12.980   2.958 -11.277
  456    HZ2  LYS  64           HZ2      LYS  64 -13.727   3.737  -9.969
  457    HZ3  LYS  64           HZ3      LYS  64 -14.537   2.487 -10.787
  458    H    CYS  65           H        CYS  65  -9.827  -0.032  -5.962
  459    HA   CYS  65           HA       CYS  65  -7.636  -0.876  -6.104
  460    HB2  CYS  65           HB3      CYS  65  -8.383  -1.992  -4.036
  461    HB3  CYS  65           HB2      CYS  65  -9.045  -3.320  -4.989
  462    H    HIS  66           H        HIS  66  -9.137  -4.031  -6.649
  463    HA   HIS  66           HA       HIS  66  -7.554  -4.471  -9.023
  464    HB2  HIS  66           HB3      HIS  66  -9.112  -6.495  -9.265
  465    HB3  HIS  66           HB2      HIS  66  -8.159  -6.412  -7.783
  466    HD1  HIS  66           HD1      HIS  66  -9.530  -5.000  -5.771
  467    HD2  HIS  66           HD2      HIS  66 -11.783  -6.911  -8.714
  468    HE1  HIS  66           HE1      HIS  66 -11.868  -5.247  -4.835
  469    HE2  HIS  66           HE2      HIS  66 -13.249  -6.413  -6.615
  Start of MODEL   11
    1    H1   ALA   1           H1       ALA   1  -1.838  10.853   3.993
    2    H2   ALA   1           H2       ALA   1  -3.108  11.975   4.100
    3    H3   ALA   1           H3       ALA   1  -2.346  11.689   2.609
    4    HA   ALA   1           HA       ALA   1  -4.616  10.464   3.563
    5    HB1  ALA   1           HB1      ALA   1  -3.094  10.673   1.190
    6    HB2  ALA   1           HB2      ALA   1  -4.724  10.020   1.358
    7    HB3  ALA   1           HB3      ALA   1  -3.329   8.946   1.469
    8    H    ARG   2           H        ARG   2  -5.050   8.518   4.541
    9    HA   ARG   2           HA       ARG   2  -2.695   6.837   5.286
   10    HB2  ARG   2           HB3      ARG   2  -3.935   7.781   7.198
   11    HB3  ARG   2           HB2      ARG   2  -5.423   7.045   6.599
   12    HG2  ARG   2           HG3      ARG   2  -4.374   4.802   6.806
   13    HG3  ARG   2           HG2      ARG   2  -2.925   5.561   7.461
   14    HD2  ARG   2           HD3      ARG   2  -5.690   5.786   8.681
   15    HD3  ARG   2           HD2      ARG   2  -4.427   4.692   9.244
   16    HE   ARG   2           HE       ARG   2  -3.678   7.539   9.136
   17   HH11  ARG   2          HH22      ARG   2  -4.870   4.843  10.932
   18   HH12  ARG   2          HH21      ARG   2  -4.419   5.500  12.468
   19   HH21  ARG   2          HH11      ARG   2  -3.084   8.408  11.134
   20   HH22  ARG   2          HH12      ARG   2  -3.409   7.517  12.583
   21    H    ASP   3           H        ASP   3  -2.813   4.581   4.934
   22    HA   ASP   3           HA       ASP   3  -5.236   3.582   3.527
   23    HB2  ASP   3           HB3      ASP   3  -3.142   4.258   2.033
   24    HB3  ASP   3           HB2      ASP   3  -2.555   2.679   2.557
   25    H    ALA   4           H        ALA   4  -5.493   1.251   3.708
   26    HA   ALA   4           HA       ALA   4  -4.152   0.204   6.134
   27    HB1  ALA   4           HB1      ALA   4  -6.719  -0.433   4.711
   28    HB2  ALA   4           HB2      ALA   4  -6.468   0.014   6.398
   29    HB3  ALA   4           HB3      ALA   4  -6.016  -1.595   5.837
   30    H    TYR   5           H        TYR   5  -5.477  -1.615   3.376
   31    HA   TYR   5           HA       TYR   5  -2.980  -3.237   3.406
   32    HB2  TYR   5           HB3      TYR   5  -5.474  -3.840   1.817
   33    HB3  TYR   5           HB2      TYR   5  -4.241  -4.962   2.391
   34    HD1  TYR   5           HD1      TYR   5  -4.123  -5.603   4.772
   35    HD2  TYR   5           HD2      TYR   5  -7.215  -3.024   3.278
   36    HE1  TYR   5           HE1      TYR   5  -5.423  -5.962   6.853
   37    HE2  TYR   5           HE2      TYR   5  -8.519  -3.385   5.359
   38    HH   TYR   5           HH       TYR   5  -8.050  -5.818   7.424
   39    H    ILE   6           H        ILE   6  -4.378  -0.710   1.657
   40    HA   ILE   6           HA       ILE   6  -3.002  -1.498  -0.858
   41    HB   ILE   6           HB       ILE   6  -4.985   0.734  -0.345
   42   HG12  ILE   6          HG13      ILE   6  -5.370  -1.963  -1.683
   43   HG13  ILE   6          HG12      ILE   6  -5.929  -1.558  -0.059
   44   HG21  ILE   6          HG21      ILE   6  -3.224   0.117  -2.540
   45   HG22  ILE   6          HG22      ILE   6  -4.352   1.462  -2.375
   46   HG23  ILE   6          HG23      ILE   6  -4.900  -0.070  -3.054
   47   HD11  ILE   6          HD11      ILE   6  -7.805  -0.702  -0.958
   48   HD12  ILE   6          HD12      ILE   6  -7.191  -0.992  -2.585
   49   HD13  ILE   6          HD13      ILE   6  -6.823   0.523  -1.761
   50    H    ALA   7           H        ALA   7  -1.385  -0.194  -1.740
   51    HA   ALA   7           HA       ALA   7  -0.455   2.063  -0.016
   52    HB1  ALA   7           HB1      ALA   7   1.669   1.272  -0.101
   53    HB2  ALA   7           HB2      ALA   7   1.533   0.846  -1.805
   54    HB3  ALA   7           HB3      ALA   7   0.920  -0.253  -0.570
   55    H    LYS   8           H        LYS   8  -2.161   1.686  -2.646
   56    HA   LYS   8           HA       LYS   8  -0.741   3.841  -4.148
   57    HB2  LYS   8           HB3      LYS   8  -2.608   2.259  -5.750
   58    HB3  LYS   8           HB2      LYS   8  -0.943   2.712  -6.103
   59    HG2  LYS   8           HG3      LYS   8  -1.738   0.458  -4.233
   60    HG3  LYS   8           HG2      LYS   8  -1.252   0.242  -5.911
   61    HD2  LYS   8           HD3      LYS   8   0.635   1.899  -4.418
   62    HD3  LYS   8           HD2      LYS   8   0.463   0.281  -3.735
   63    HE2  LYS   8           HE3      LYS   8   0.968  -0.740  -5.876
   64    HE3  LYS   8           HE2      LYS   8   0.966   0.835  -6.670
   65    HZ1  LYS   8           HZ1      LYS   8   3.141  -0.400  -5.627
   66    HZ2  LYS   8           HZ2      LYS   8   2.729   0.705  -4.409
   67    HZ3  LYS   8           HZ3      LYS   8   3.028   1.256  -5.987
   68    HA   PRO   9           HA       PRO   9  -4.408   6.231  -3.650
   69    HB2  PRO   9           HB2      PRO   9  -4.577   7.487  -6.108
   70    HB3  PRO   9           HB3      PRO   9  -3.492   7.984  -4.797
   71    HG2  PRO   9           HG3      PRO   9  -2.908   6.407  -7.243
   72    HG3  PRO   9           HG2      PRO   9  -1.909   7.601  -6.398
   73    HD2  PRO   9           HD3      PRO   9  -1.492   4.911  -6.186
   74    HD3  PRO   9           HD2      PRO   9  -1.099   6.052  -4.881
   75    H    HIS  10           H        HIS  10  -4.258   4.465  -6.745
   76    HA   HIS  10           HA       HIS  10  -7.150   3.834  -6.400
   77    HB2  HIS  10           HB3      HIS  10  -5.803   4.637  -8.996
   78    HB3  HIS  10           HB2      HIS  10  -7.476   4.102  -8.836
   79    HD1  HIS  10           HD1      HIS  10  -5.213   7.010  -8.151
   80    HD2  HIS  10           HD2      HIS  10  -9.224   6.002  -7.597
   81    HE1  HIS  10           HE1      HIS  10  -6.412   9.153  -7.521
   82    HE2  HIS  10           HE2      HIS  10  -8.852   8.550  -7.182
   83    H    ASN  11           H        ASN  11  -4.071   2.677  -6.662
   84    HA   ASN  11           HA       ASN  11  -4.988   0.136  -7.954
   85    HB2  ASN  11           HB3      ASN  11  -2.172   1.246  -7.735
   86    HB3  ASN  11           HB2      ASN  11  -2.629  -0.260  -8.531
   87   HD21  ASN  11          HD22      ASN  11  -2.498   3.213  -8.892
   88   HD22  ASN  11          HD21      ASN  11  -3.132   3.272 -10.466
   89    H    CYS  12           H        CYS  12  -3.707  -1.809  -7.070
   90    HA   CYS  12           HA       CYS  12  -3.488  -1.534  -4.100
   91    HB2  CYS  12           HB3      CYS  12  -4.200  -3.996  -5.722
   92    HB3  CYS  12           HB2      CYS  12  -4.173  -3.880  -3.962
   93    H    VAL  13           H        VAL  13  -2.080  -3.511  -3.240
   94    HA   VAL  13           HA       VAL  13   0.485  -3.349  -4.738
   95    HB   VAL  13           HB       VAL  13  -0.027  -4.357  -1.925
   96   HG11  VAL  13          HG11      VAL  13   2.500  -3.536  -3.389
   97   HG12  VAL  13          HG12      VAL  13   2.052  -5.182  -2.938
   98   HG13  VAL  13          HG13      VAL  13   2.415  -3.992  -1.687
   99   HG21  VAL  13          HG21      VAL  13  -0.050  -2.222  -1.205
  100   HG22  VAL  13          HG22      VAL  13  -0.228  -1.729  -2.889
  101   HG23  VAL  13          HG23      VAL  13   1.376  -1.825  -2.163
  102    H    TYR  14           H        TYR  14   1.407  -5.161  -5.626
  103    HA   TYR  14           HA       TYR  14  -0.194  -7.554  -5.903
  104    HB2  TYR  14           HB3      TYR  14   2.356  -8.269  -6.692
  105    HB3  TYR  14           HB2      TYR  14   1.147  -7.521  -7.735
  106    HD1  TYR  14           HD2      TYR  14   3.290  -6.234  -4.930
  107    HD2  TYR  14           HD1      TYR  14   2.108  -5.849  -9.043
  108    HE1  TYR  14           HE2      TYR  14   4.716  -4.218  -5.152
  109    HE2  TYR  14           HE1      TYR  14   3.535  -3.832  -9.263
  110    HH   TYR  14           HH       TYR  14   5.462  -2.635  -6.508
  111    H    GLU  15           H        GLU  15  -0.442  -7.954  -3.533
  112    HA   GLU  15           HA       GLU  15   0.106  -9.132  -1.584
  113    HB2  GLU  15           HB3      GLU  15   0.452 -10.935  -3.315
  114    HB3  GLU  15           HB2      GLU  15   2.158 -10.484  -3.357
  115    HG2  GLU  15           HG3      GLU  15   2.304 -10.918  -0.910
  116    HG3  GLU  15           HG2      GLU  15   0.627 -11.463  -0.931
  117    H    CYS  16           H        CYS  16   1.035  -7.514  -0.307
  118    HA   CYS  16           HA       CYS  16   3.666  -6.452  -0.737
  119    HB2  CYS  16           HB3      CYS  16   2.237  -5.160   0.661
  120    HB3  CYS  16           HB2      CYS  16   1.863  -6.543   1.690
  121    H    PHE  17           H        PHE  17   5.470  -7.694  -0.665
  122    HA   PHE  17           HA       PHE  17   5.577 -10.226   0.719
  123    HB2  PHE  17           HB3      PHE  17   7.038 -10.142  -1.093
  124    HB3  PHE  17           HB2      PHE  17   7.549  -8.494  -0.736
  125    HD1  PHE  17           HD1      PHE  17   7.704 -11.992   0.576
  126    HD2  PHE  17           HD2      PHE  17   9.499  -8.090   0.518
  127    HE1  PHE  17           HE1      PHE  17   9.644 -12.865   1.851
  128    HE2  PHE  17           HE2      PHE  17  11.438  -8.962   1.792
  129    HZ   PHE  17           HZ       PHE  17  11.507 -11.349   2.461
  130    H    ASP  18           H        ASP  18   6.429 -10.702   2.735
  131    HA   ASP  18           HA       ASP  18   6.557  -8.574   4.673
  132    HB2  ASP  18           HB3      ASP  18   7.363 -11.489   4.845
  133    HB3  ASP  18           HB2      ASP  18   7.306 -10.393   6.227
  134    H    ALA  19           H        ALA  19   8.286  -7.412   5.358
  135    HA   ALA  19           HA       ALA  19  11.021  -8.446   4.976
  136    HB1  ALA  19           HB1      ALA  19  11.783  -6.788   3.520
  137    HB2  ALA  19           HB2      ALA  19  10.456  -5.694   3.911
  138    HB3  ALA  19           HB3      ALA  19  10.167  -7.095   2.881
  139    H    PHE  20           H        PHE  20  12.578  -7.211   6.257
  140    HA   PHE  20           HA       PHE  20  11.595  -6.328   8.763
  141    HB2  PHE  20           HB3      PHE  20  14.210  -5.694   7.364
  142    HB3  PHE  20           HB2      PHE  20  13.880  -5.320   9.054
  143    HD1  PHE  20           HD1      PHE  20  13.509  -7.137  10.701
  144    HD2  PHE  20           HD2      PHE  20  14.617  -7.961   6.634
  145    HE1  PHE  20           HE1      PHE  20  14.122  -9.453  11.338
  146    HE2  PHE  20           HE2      PHE  20  15.230 -10.279   7.270
  147    HZ   PHE  20           HZ       PHE  20  14.983 -11.024   9.623
  148    H    SER  21           H        SER  21  12.466  -4.475   5.857
  149    HA   SER  21           HA       SER  21  10.566  -2.451   6.156
  150    HB2  SER  21           HB3      SER  21  11.357  -1.578   8.149
  151    HB3  SER  21           HB2      SER  21  13.016  -2.068   7.822
  152    HG   SER  21           HG       SER  21  13.324  -0.294   6.669
  153    H    SER  22           H        SER  22  10.810  -2.787   3.839
  154    HA   SER  22           HA       SER  22  12.584  -0.878   2.595
  155    HB2  SER  22           HB3      SER  22  14.377  -2.357   2.750
  156    HB3  SER  22           HB2      SER  22  13.346  -3.779   2.621
  157    HG   SER  22           HG       SER  22  14.708  -2.856   0.715
  158    H    TYR  23           H        TYR  23  11.225  -4.061   1.629
  159    HA   TYR  23           HA       TYR  23  10.321  -3.176  -0.914
  160    HB2  TYR  23           HB3      TYR  23  10.509  -5.565  -0.245
  161    HB3  TYR  23           HB2      TYR  23   9.121  -5.353   0.822
  162    HD1  TYR  23           HD2      TYR  23  10.247  -5.523  -2.683
  163    HD2  TYR  23           HD1      TYR  23   6.876  -5.042  -0.064
  164    HE1  TYR  23           HE2      TYR  23   8.710  -5.925  -4.588
  165    HE2  TYR  23           HE1      TYR  23   5.339  -5.447  -1.969
  166    HH   TYR  23           HH       TYR  23   6.557  -6.415  -5.138
  167    H    CYS  24           H        CYS  24   8.370  -3.694   2.038
  168    HA   CYS  24           HA       CYS  24   6.055  -2.375   0.921
  169    HB2  CYS  24           HB3      CYS  24   6.018  -4.065   2.800
  170    HB3  CYS  24           HB2      CYS  24   6.669  -2.809   3.852
  171    H    ASN  25           H        ASN  25   8.402  -1.376   3.418
  172    HA   ASN  25           HA       ASN  25   7.403   1.246   3.787
  173    HB2  ASN  25           HB3      ASN  25  10.277   0.289   3.953
  174    HB3  ASN  25           HB2      ASN  25   9.652   1.784   4.654
  175   HD21  ASN  25          HD22      ASN  25   7.286  -0.659   4.793
  176   HD22  ASN  25          HD21      ASN  25   7.541  -1.152   6.398
  177    H    GLY  26           H        GLY  26   9.673  -0.036   1.388
  178    HA2  GLY  26           HA3      GLY  26  10.462   2.467   0.267
  179    HA3  GLY  26           HA2      GLY  26  10.486   0.926  -0.594
  180    H    VAL  27           H        VAL  27   7.805   0.241  -0.609
  181    HA   VAL  27           HA       VAL  27   6.788   1.912  -2.723
  182    HB   VAL  27           HB       VAL  27   5.414  -0.204  -1.040
  183   HG11  VAL  27          HG11      VAL  27   4.578   1.153  -3.621
  184   HG12  VAL  27          HG12      VAL  27   3.760   1.271  -2.062
  185   HG13  VAL  27          HG13      VAL  27   3.784  -0.264  -2.931
  186   HG21  VAL  27          HG21      VAL  27   6.201  -0.571  -3.899
  187   HG22  VAL  27          HG22      VAL  27   6.138  -1.755  -2.593
  188   HG23  VAL  27          HG23      VAL  27   7.483  -0.619  -2.689
  189    H    CYS  28           H        CYS  28   5.943   1.562   0.713
  190    HA   CYS  28           HA       CYS  28   3.756   3.391   0.720
  191    HB2  CYS  28           HB3      CYS  28   4.407   1.812   2.593
  192    HB3  CYS  28           HB2      CYS  28   5.702   2.938   2.999
  193    H    THR  29           H        THR  29   7.244   3.888   1.078
  194    HA   THR  29           HA       THR  29   7.219   6.613   1.841
  195    HB   THR  29           HB       THR  29   9.205   5.299  -0.037
  196    HG1  THR  29           HG1      THR  29  10.307   4.998   2.057
  197   HG21  THR  29          HG21      THR  29  10.760   6.952   0.862
  198   HG22  THR  29          HG22      THR  29   9.511   7.576   1.940
  199   HG23  THR  29          HG23      THR  29   9.349   7.775   0.195
  200    H    LYS  30           H        LYS  30   6.997   5.138  -1.384
  201    HA   LYS  30           HA       LYS  30   7.140   7.536  -2.906
  202    HB2  LYS  30           HB3      LYS  30   5.452   5.093  -3.523
  203    HB3  LYS  30           HB2      LYS  30   6.043   6.283  -4.682
  204    HG2  LYS  30           HG3      LYS  30   7.799   4.490  -2.979
  205    HG3  LYS  30           HG2      LYS  30   7.435   4.230  -4.685
  206    HD2  LYS  30           HD3      LYS  30   8.354   6.625  -5.041
  207    HD3  LYS  30           HD2      LYS  30   9.047   6.448  -3.427
  208    HE2  LYS  30           HE3      LYS  30   9.843   4.106  -4.459
  209    HE3  LYS  30           HE2      LYS  30   9.756   5.038  -5.953
  210    HZ1  LYS  30           HZ1      LYS  30  11.605   5.256  -3.755
  211    HZ2  LYS  30           HZ2      LYS  30  10.976   6.747  -4.264
  212    HZ3  LYS  30           HZ3      LYS  30  11.777   5.742  -5.375
  213    H    ASN  31           H        ASN  31   4.428   5.966  -1.269
  214    HA   ASN  31           HA       ASN  31   2.338   7.618  -2.270
  215    HB2  ASN  31           HB3      ASN  31   2.626   6.324   0.461
  216    HB3  ASN  31           HB2      ASN  31   1.128   6.988  -0.190
  217   HD21  ASN  31          HD22      ASN  31   1.396   4.201   0.492
  218   HD22  ASN  31          HD21      ASN  31   1.294   3.297  -0.941
  219    H    GLY  32           H        GLY  32   4.804   8.166   0.143
  220    HA2  GLY  32           HA3      GLY  32   5.493  10.434   0.718
  221    HA3  GLY  32           HA2      GLY  32   3.839  10.972   0.410
  222    H    ALA  33           H        ALA  33   3.543   8.104   1.970
  223    HA   ALA  33           HA       ALA  33   2.620   9.307   4.415
  224    HB1  ALA  33           HB1      ALA  33   1.556   7.314   4.362
  225    HB2  ALA  33           HB2      ALA  33   3.052   6.612   4.978
  226    HB3  ALA  33           HB3      ALA  33   2.738   6.634   3.243
  227    H    LYS  34           H        LYS  34   3.592   9.246   6.496
  228    HA   LYS  34           HA       LYS  34   6.392   9.672   6.627
  229    HB2  LYS  34           HB3      LYS  34   4.736  10.398   8.352
  230    HB3  LYS  34           HB2      LYS  34   4.569   8.716   8.855
  231    HG2  LYS  34           HG3      LYS  34   7.312   9.081   8.876
  232    HG3  LYS  34           HG2      LYS  34   6.707  10.636   9.446
  233    HD2  LYS  34           HD3      LYS  34   6.050   7.906  10.587
  234    HD3  LYS  34           HD2      LYS  34   6.982   9.185  11.369
  235    HE2  LYS  34           HE3      LYS  34   4.675  10.519  10.753
  236    HE3  LYS  34           HE2      LYS  34   4.056   8.899  11.076
  237    HZ1  LYS  34           HZ1      LYS  34   5.669  10.619  12.871
  238    HZ2  LYS  34           HZ2      LYS  34   5.426   8.966  13.161
  239    HZ3  LYS  34           HZ3      LYS  34   4.098  10.024  13.128
  240    H    SER  35           H        SER  35   4.556   6.806   7.755
  241    HA   SER  35           HA       SER  35   6.864   5.113   6.990
  242    HB2  SER  35           HB3      SER  35   7.159   5.734   9.399
  243    HB3  SER  35           HB2      SER  35   5.593   5.006   9.744
  244    HG   SER  35           HG       SER  35   7.829   3.699   8.570
  245    H    GLY  36           H        GLY  36   6.248   2.803   6.887
  246    HA2  GLY  36           HA3      GLY  36   3.324   2.318   6.953
  247    HA3  GLY  36           HA2      GLY  36   4.182   2.004   5.447
  248    H    TYR  37           H        TYR  37   2.773   0.057   7.082
  249    HA   TYR  37           HA       TYR  37   5.071  -1.736   7.761
  250    HB2  TYR  37           HB3      TYR  37   2.366  -1.723   9.131
  251    HB3  TYR  37           HB2      TYR  37   3.772  -2.693   9.571
  252    HD1  TYR  37           HD2      TYR  37   6.000  -1.255   9.964
  253    HD2  TYR  37           HD1      TYR  37   1.987   0.237  10.316
  254    HE1  TYR  37           HE2      TYR  37   6.814   0.586  11.413
  255    HE2  TYR  37           HE1      TYR  37   2.802   2.080  11.766
  256    HH   TYR  37           HH       TYR  37   4.953   2.343  13.368
  257    H    CYS  38           H        CYS  38   4.694  -3.994   7.257
  258    HA   CYS  38           HA       CYS  38   2.641  -4.350   5.145
  259    HB2  CYS  38           HB3      CYS  38   5.062  -4.903   4.696
  260    HB3  CYS  38           HB2      CYS  38   4.914  -6.210   5.870
  261    H    GLN  39           H        GLN  39   0.793  -5.313   5.735
  262    HA   GLN  39           HA       GLN  39   0.852  -7.200   8.056
  263    HB2  GLN  39           HB3      GLN  39  -1.391  -5.408   7.074
  264    HB3  GLN  39           HB2      GLN  39  -1.518  -6.549   8.416
  265    HG2  GLN  39           HG3      GLN  39   0.338  -5.364   9.571
  266    HG3  GLN  39           HG2      GLN  39   0.385  -4.192   8.255
  267   HE21  GLN  39          HE22      GLN  39  -2.812  -4.943   8.440
  268   HE22  GLN  39          HE21      GLN  39  -3.329  -3.766   9.548
  269    H    ILE  40           H        ILE  40  -1.545  -8.444   7.778
  270    HA   ILE  40           HA       ILE  40  -1.112  -9.990   5.291
  271    HB   ILE  40           HB       ILE  40  -2.522 -11.686   6.319
  272   HG12  ILE  40          HG13      ILE  40  -2.966  -9.649   8.529
  273   HG13  ILE  40          HG12      ILE  40  -4.180 -10.154   7.353
  274   HG21  ILE  40          HG21      ILE  40  -1.159 -12.215   8.240
  275   HG22  ILE  40          HG22      ILE  40  -0.710 -10.522   8.451
  276   HG23  ILE  40          HG23      ILE  40  -0.121 -11.423   7.053
  277   HD11  ILE  40          HD11      ILE  40  -2.875 -11.836   9.499
  278   HD12  ILE  40          HD12      ILE  40  -3.786 -12.540   8.162
  279   HD13  ILE  40          HD13      ILE  40  -4.588 -11.463   9.307
  280    H    LEU  41           H        LEU  41  -2.845 -10.437   3.834
  281    HA   LEU  41           HA       LEU  41  -4.758  -8.210   3.612
  282    HB2  LEU  41           HB3      LEU  41  -3.414  -9.099   1.655
  283    HB3  LEU  41           HB2      LEU  41  -4.371 -10.574   1.752
  284    HG   LEU  41           HG       LEU  41  -6.439  -9.187   1.492
  285   HD11  LEU  41          HD11      LEU  41  -5.993  -7.007   2.107
  286   HD12  LEU  41          HD12      LEU  41  -5.749  -6.860   0.367
  287   HD13  LEU  41          HD13      LEU  41  -4.362  -7.042   1.440
  288   HD21  LEU  41          HD21      LEU  41  -5.559 -10.279  -0.470
  289   HD22  LEU  41          HD22      LEU  41  -4.309  -9.049  -0.657
  290   HD23  LEU  41          HD23      LEU  41  -6.000  -8.637  -0.942
  291    H    GLY  42           H        GLY  42  -6.943  -8.411   4.047
  292    HA2  GLY  42           HA3      GLY  42  -8.018 -10.405   5.656
  293    HA3  GLY  42           HA2      GLY  42  -9.004  -9.474   4.524
  294    H    THR  43           H        THR  43  -7.477 -10.441   2.211
  295    HA   THR  43           HA       THR  43  -8.617 -13.190   2.053
  296    HB   THR  43           HB       THR  43  -8.881 -12.844  -0.310
  297    HG1  THR  43           HG1      THR  43  -6.811 -11.618  -0.357
  298   HG21  THR  43          HG21      THR  43 -10.471 -11.639   1.297
  299   HG22  THR  43          HG22      THR  43 -10.439 -11.049  -0.365
  300   HG23  THR  43          HG23      THR  43  -9.583 -10.167   0.900
  301    H    TYR  44           H        TYR  44  -7.252 -14.433   0.187
  302    HA   TYR  44           HA       TYR  44  -4.728 -15.022   1.255
  303    HB2  TYR  44           HB3      TYR  44  -5.562 -15.180  -1.658
  304    HB3  TYR  44           HB2      TYR  44  -4.205 -16.042  -0.931
  305    HD1  TYR  44           HD2      TYR  44  -4.581 -17.839   0.707
  306    HD2  TYR  44           HD1      TYR  44  -7.849 -15.839  -1.227
  307    HE1  TYR  44           HE2      TYR  44  -6.116 -19.649   1.435
  308    HE2  TYR  44           HE1      TYR  44  -9.388 -17.647  -0.501
  309    HH   TYR  44           HH       TYR  44  -8.653 -19.837   1.875
  310    H    GLY  45           H        GLY  45  -2.554 -14.494   0.372
  311    HA2  GLY  45           HA3      GLY  45  -1.025 -13.032  -0.763
  312    HA3  GLY  45           HA2      GLY  45  -2.375 -11.970  -1.163
  313    H    ASN  46           H        ASN  46  -0.756 -10.313  -0.328
  314    HA   ASN  46           HA       ASN  46  -1.215  -9.910   2.577
  315    HB2  ASN  46           HB3      ASN  46   1.378 -10.178   1.152
  316    HB3  ASN  46           HB2      ASN  46   1.266  -8.876   2.332
  317   HD21  ASN  46          HD22      ASN  46   0.904  -9.467   4.597
  318   HD22  ASN  46          HD21      ASN  46   1.129 -11.061   5.135
  319    H    GLY  47           H        GLY  47  -0.550  -7.532   3.138
  320    HA2  GLY  47           HA3      GLY  47  -0.962  -5.734   0.799
  321    HA3  GLY  47           HA2      GLY  47  -2.052  -5.590   2.178
  322    H    CYS  48           H        CYS  48  -0.461  -3.436   1.372
  323    HA   CYS  48           HA       CYS  48   1.721  -3.344   3.381
  324    HB2  CYS  48           HB3      CYS  48   1.268  -2.074   0.762
  325    HB3  CYS  48           HB2      CYS  48   1.919  -0.995   1.996
  326    H    TRP  49           H        TRP  49   1.801  -1.545   4.860
  327    HA   TRP  49           HA       TRP  49  -0.852  -0.237   5.274
  328    HB2  TRP  49           HB3      TRP  49   0.180  -1.957   6.986
  329    HB3  TRP  49           HB2      TRP  49   1.171  -0.580   7.463
  330    HD1  TRP  49           HD1      TRP  49   0.037   1.360   8.760
  331    HE1  TRP  49           HE1      TRP  49  -2.300   1.679   9.803
  332    HE3  TRP  49           HE3      TRP  49  -2.403  -2.591   6.651
  333    HZ2  TRP  49           HZ2      TRP  49  -4.868   0.414   9.749
  334    HZ3  TRP  49           HZ3      TRP  49  -4.790  -3.015   7.162
  335    HH2  TRP  49           HH2      TRP  49  -6.026  -1.519   8.708
  336    H    CYS  50           H        CYS  50  -0.872   2.007   5.516
  337    HA   CYS  50           HA       CYS  50   1.780   3.376   5.663
  338    HB2  CYS  50           HB3      CYS  50  -0.442   3.866   3.678
  339    HB3  CYS  50           HB2      CYS  50   0.775   5.090   4.037
  340    H    ILE  51           H        ILE  51   1.789   4.806   7.317
  341    HA   ILE  51           HA       ILE  51  -0.809   6.017   8.158
  342    HB   ILE  51           HB       ILE  51   1.507   5.179   9.923
  343   HG12  ILE  51          HG13      ILE  51  -1.213   4.089  10.321
  344   HG13  ILE  51          HG12      ILE  51  -0.415   3.572   8.836
  345   HG21  ILE  51          HG21      ILE  51  -0.813   6.953  10.307
  346   HG22  ILE  51          HG22      ILE  51   0.668   6.817  11.255
  347   HG23  ILE  51          HG23      ILE  51  -0.664   5.696  11.534
  348   HD11  ILE  51          HD11      ILE  51   0.005   2.130  10.918
  349   HD12  ILE  51          HD12      ILE  51   0.975   3.476  11.518
  350   HD13  ILE  51          HD13      ILE  51   1.433   2.655  10.025
  351    H    ALA  52           H        ALA  52  -0.808   8.224   8.273
  352    HA   ALA  52           HA       ALA  52   1.456   9.812   8.987
  353    HB1  ALA  52           HB1      ALA  52   2.412  10.451   7.000
  354    HB2  ALA  52           HB2      ALA  52   0.907  10.264   6.099
  355    HB3  ALA  52           HB3      ALA  52   1.871   8.846   6.509
  356    H    LEU  53           H        LEU  53  -1.045  10.193   6.463
  357    HA   LEU  53           HA       LEU  53  -2.310  12.281   8.179
  358    HB2  LEU  53           HB3      LEU  53  -1.001  13.471   6.531
  359    HB3  LEU  53           HB2      LEU  53  -1.648  12.470   5.231
  360    HG   LEU  53           HG       LEU  53  -3.851  13.401   5.503
  361   HD11  LEU  53          HD11      LEU  53  -2.676  14.532   8.037
  362   HD12  LEU  53          HD12      LEU  53  -4.155  13.591   7.830
  363   HD13  LEU  53          HD13      LEU  53  -4.094  15.270   7.291
  364   HD21  LEU  53          HD21      LEU  53  -3.406  15.807   5.112
  365   HD22  LEU  53          HD22      LEU  53  -2.268  14.789   4.229
  366   HD23  LEU  53          HD23      LEU  53  -1.763  15.592   5.716
  367    HA   PRO  54           HA       PRO  54  -5.510   9.330   6.664
  368    HB2  PRO  54           HB2      PRO  54  -6.995   9.311   8.965
  369    HB3  PRO  54           HB3      PRO  54  -5.613   8.239   8.679
  370    HG2  PRO  54           HG3      PRO  54  -5.814  10.655  10.361
  371    HG3  PRO  54           HG2      PRO  54  -4.794   9.222  10.549
  372    HD2  PRO  54           HD3      PRO  54  -3.945  11.701   9.574
  373    HD3  PRO  54           HD2      PRO  54  -3.070  10.167   9.383
  374    H    ASP  55           H        ASP  55  -5.798  12.477   8.176
  375    HA   ASP  55           HA       ASP  55  -8.564  12.963   7.779
  376    HB2  ASP  55           HB3      ASP  55  -6.922  14.452   9.013
  377    HB3  ASP  55           HB2      ASP  55  -6.360  15.013   7.437
  378    H    ASN  56           H        ASN  56  -5.829  13.170   5.548
  379    HA   ASN  56           HA       ASN  56  -7.356  14.381   3.403
  380    HB2  ASN  56           HB3      ASN  56  -4.813  14.402   3.674
  381    HB3  ASN  56           HB2      ASN  56  -4.839  12.736   3.097
  382   HD21  ASN  56          HD22      ASN  56  -3.476  14.439   1.458
  383   HD22  ASN  56          HD21      ASN  56  -4.384  14.833   0.080
  384    H    VAL  57           H        VAL  57  -8.313  13.372   1.625
  385    HA   VAL  57           HA       VAL  57  -9.812  11.127   1.778
  386    HB   VAL  57           HB       VAL  57  -8.161  11.894  -0.643
  387   HG11  VAL  57          HG11      VAL  57 -10.423   9.972  -0.197
  388   HG12  VAL  57          HG12      VAL  57  -8.990   9.790  -1.208
  389   HG13  VAL  57          HG13      VAL  57 -10.313  10.830  -1.734
  390   HG21  VAL  57          HG21      VAL  57  -9.506  13.758   0.089
  391   HG22  VAL  57          HG22      VAL  57 -10.902  12.714   0.361
  392   HG23  VAL  57          HG23      VAL  57 -10.339  13.024  -1.282
  393    HA   PRO  58           HA       PRO  58  -6.383   8.150   2.325
  394    HB2  PRO  58           HB2      PRO  58  -7.572   6.571   4.154
  395    HB3  PRO  58           HB3      PRO  58  -6.899   8.156   4.587
  396    HG2  PRO  58           HG3      PRO  58  -9.726   7.348   4.190
  397    HG3  PRO  58           HG2      PRO  58  -9.029   8.516   5.322
  398    HD2  PRO  58           HD3      PRO  58 -10.268   9.139   2.870
  399    HD3  PRO  58           HD2      PRO  58  -9.264  10.236   3.838
  400    H    ILE  59           H        ILE  59  -9.673   6.759   2.556
  401    HA   ILE  59           HA       ILE  59  -8.952   4.915   0.325
  402    HB   ILE  59           HB       ILE  59 -10.864   4.411   2.625
  403   HG12  ILE  59          HG13      ILE  59  -8.128   3.212   2.083
  404   HG13  ILE  59          HG12      ILE  59  -8.439   4.476   3.273
  405   HG21  ILE  59          HG21      ILE  59 -11.483   3.232   0.563
  406   HG22  ILE  59          HG22      ILE  59 -10.842   2.089   1.745
  407   HG23  ILE  59          HG23      ILE  59  -9.836   2.624   0.399
  408   HD11  ILE  59          HD11      ILE  59 -10.368   2.503   3.791
  409   HD12  ILE  59          HD12      ILE  59  -8.928   2.847   4.751
  410   HD13  ILE  59          HD13      ILE  59  -8.875   1.615   3.490
  411    H    ARG  60           H        ARG  60 -10.299   4.996  -1.429
  412    HA   ARG  60           HA       ARG  60 -12.985   6.225  -1.083
  413    HB2  ARG  60           HB3      ARG  60 -12.662   7.649  -3.016
  414    HB3  ARG  60           HB2      ARG  60 -11.324   7.939  -1.901
  415    HG2  ARG  60           HG3      ARG  60 -10.018   6.187  -3.210
  416    HG3  ARG  60           HG2      ARG  60 -11.301   6.261  -4.418
  417    HD2  ARG  60           HD3      ARG  60  -9.565   8.565  -3.494
  418    HD3  ARG  60           HD2      ARG  60  -9.506   7.771  -5.068
  419    HE   ARG  60           HE       ARG  60 -11.476   9.754  -4.223
  420   HH11  ARG  60          HH22      ARG  60 -10.736   7.072  -6.257
  421   HH12  ARG  60          HH21      ARG  60 -11.902   7.496  -7.466
  422   HH21  ARG  60          HH11      ARG  60 -13.003  10.325  -5.788
  423   HH22  ARG  60          HH12      ARG  60 -13.185   9.338  -7.200
  424    H    ILE  61           H        ILE  61 -10.855   4.010  -2.677
  425    HA   ILE  61           HA       ILE  61 -12.968   3.209  -4.597
  426    HB   ILE  61           HB       ILE  61 -10.994   1.504  -5.173
  427   HG12  ILE  61          HG13      ILE  61  -8.803   2.551  -4.781
  428   HG13  ILE  61          HG12      ILE  61  -9.575   3.862  -3.890
  429   HG21  ILE  61          HG21      ILE  61 -11.859   3.134  -6.742
  430   HG22  ILE  61          HG22      ILE  61 -10.100   3.267  -6.726
  431   HG23  ILE  61          HG23      ILE  61 -11.082   4.452  -5.866
  432   HD11  ILE  61          HD11      ILE  61  -8.558   1.797  -2.595
  433   HD12  ILE  61          HD12      ILE  61 -10.082   1.030  -3.039
  434   HD13  ILE  61          HD13      ILE  61 -10.086   2.503  -2.069
  435    HA   PRO  62           HA       PRO  62 -14.322  -0.206  -2.161
  436    HB2  PRO  62           HB2      PRO  62 -14.835  -2.077  -4.117
  437    HB3  PRO  62           HB3      PRO  62 -15.898  -0.706  -3.750
  438    HG2  PRO  62           HG3      PRO  62 -13.924  -1.038  -5.945
  439    HG3  PRO  62           HG2      PRO  62 -15.508  -0.244  -5.956
  440    HD2  PRO  62           HD3      PRO  62 -13.154   1.145  -5.840
  441    HD3  PRO  62           HD2      PRO  62 -14.670   1.746  -5.132
  442    H    GLY  63           H        GLY  63 -11.473  -0.418  -4.023
  443    HA2  GLY  63           HA3      GLY  63  -9.523  -1.659  -3.426
  444    HA3  GLY  63           HA2      GLY  63 -10.514  -2.647  -2.351
  445    H    LYS  64           H        LYS  64 -11.673  -2.075  -5.553
  446    HA   LYS  64           HA       LYS  64 -11.965  -4.808  -6.204
  447    HB2  LYS  64           HB3      LYS  64 -13.118  -2.915  -7.363
  448    HB3  LYS  64           HB2      LYS  64 -11.590  -2.509  -8.147
  449    HG2  LYS  64           HG3      LYS  64 -11.515  -4.790  -9.134
  450    HG3  LYS  64           HG2      LYS  64 -13.082  -5.137  -8.402
  451    HD2  LYS  64           HD3      LYS  64 -14.039  -3.187  -9.648
  452    HD3  LYS  64           HD2      LYS  64 -12.486  -2.996 -10.463
  453    HE2  LYS  64           HE3      LYS  64 -13.237  -4.471 -11.996
  454    HE3  LYS  64           HE2      LYS  64 -13.076  -5.709 -10.752
  455    HZ1  LYS  64           HZ1      LYS  64 -15.305  -5.658 -11.703
  456    HZ2  LYS  64           HZ2      LYS  64 -15.492  -4.045 -11.215
  457    HZ3  LYS  64           HZ3      LYS  64 -15.332  -5.271 -10.050
  458    H    CYS  65           H        CYS  65  -9.261  -2.605  -6.760
  459    HA   CYS  65           HA       CYS  65  -7.077  -3.020  -7.505
  460    HB2  CYS  65           HB3      CYS  65  -7.707  -5.874  -6.692
  461    HB3  CYS  65           HB2      CYS  65  -6.106  -5.163  -6.879
  462    H    HIS  66           H        HIS  66  -8.460  -6.196  -8.329
  463    HA   HIS  66           HA       HIS  66  -8.092  -5.499 -11.218
  464    HB2  HIS  66           HB3      HIS  66  -7.530  -8.179  -9.912
  465    HB3  HIS  66           HB2      HIS  66  -7.313  -7.784 -11.617
  466    HD1  HIS  66           HD1      HIS  66  -5.571  -5.681 -12.039
  467    HD2  HIS  66           HD2      HIS  66  -5.269  -7.687  -8.393
  468    HE1  HIS  66           HE1      HIS  66  -3.296  -5.098 -11.085
  469    HE2  HIS  66           HE2      HIS  66  -3.102  -6.313  -8.867
  Start of MODEL   12
    1    H1   ALA   1           H1       ALA   1  -3.070   9.369   0.491
    2    H2   ALA   1           H2       ALA   1  -4.224  10.608   0.348
    3    H3   ALA   1           H3       ALA   1  -4.688   9.070   0.903
    4    HA   ALA   1           HA       ALA   1  -2.894  10.968   2.311
    5    HB1  ALA   1           HB1      ALA   1  -5.359  11.502   2.296
    6    HB2  ALA   1           HB2      ALA   1  -4.702  11.186   3.901
    7    HB3  ALA   1           HB3      ALA   1  -5.641   9.944   3.071
    8    H    ARG   2           H        ARG   2  -4.862   8.033   2.835
    9    HA   ARG   2           HA       ARG   2  -2.496   6.839   4.217
   10    HB2  ARG   2           HB3      ARG   2  -4.233   7.717   5.835
   11    HB3  ARG   2           HB2      ARG   2  -5.363   6.548   5.152
   12    HG2  ARG   2           HG3      ARG   2  -3.846   4.710   5.755
   13    HG3  ARG   2           HG2      ARG   2  -2.693   5.871   6.413
   14    HD2  ARG   2           HD3      ARG   2  -3.982   4.983   8.259
   15    HD3  ARG   2           HD2      ARG   2  -4.492   6.651   7.993
   16    HE   ARG   2           HE       ARG   2  -6.623   5.831   7.414
   17   HH11  ARG   2          HH22      ARG   2  -4.196   3.392   7.178
   18   HH12  ARG   2          HH21      ARG   2  -5.321   2.119   6.844
   19   HH21  ARG   2          HH11      ARG   2  -8.106   4.181   6.980
   20   HH22  ARG   2          HH12      ARG   2  -7.534   2.564   6.732
   21    H    ASP   3           H        ASP   3  -2.095   4.737   3.597
   22    HA   ASP   3           HA       ASP   3  -3.965   3.546   1.630
   23    HB2  ASP   3           HB3      ASP   3  -1.142   2.780   2.426
   24    HB3  ASP   3           HB2      ASP   3  -2.093   1.955   1.193
   25    H    ALA   4           H        ALA   4  -4.776   1.398   1.919
   26    HA   ALA   4           HA       ALA   4  -4.776   0.507   4.765
   27    HB1  ALA   4           HB1      ALA   4  -6.995   1.087   3.991
   28    HB2  ALA   4           HB2      ALA   4  -6.906  -0.668   4.133
   29    HB3  ALA   4           HB3      ALA   4  -6.796   0.094   2.547
   30    H    TYR   5           H        TYR   5  -5.892  -1.494   2.120
   31    HA   TYR   5           HA       TYR   5  -3.799  -3.480   2.843
   32    HB2  TYR   5           HB3      TYR   5  -6.144  -3.906   0.981
   33    HB3  TYR   5           HB2      TYR   5  -5.224  -5.122   1.868
   34    HD1  TYR   5           HD2      TYR   5  -5.534  -5.425   4.287
   35    HD2  TYR   5           HD1      TYR   5  -7.832  -2.554   2.071
   36    HE1  TYR   5           HE2      TYR   5  -7.116  -5.229   6.188
   37    HE2  TYR   5           HE1      TYR   5  -9.419  -2.358   3.971
   38    HH   TYR   5           HH       TYR   5  -9.899  -2.999   6.036
   39    H    ILE   6           H        ILE   6  -4.638  -1.243   0.377
   40    HA   ILE   6           HA       ILE   6  -2.851  -2.607  -1.576
   41    HB   ILE   6           HB       ILE   6  -4.790  -0.320  -2.016
   42   HG12  ILE   6          HG13      ILE   6  -5.057  -3.263  -2.709
   43   HG13  ILE   6          HG12      ILE   6  -5.900  -2.463  -1.381
   44   HG21  ILE   6          HG21      ILE   6  -2.651  -1.368  -3.579
   45   HG22  ILE   6          HG22      ILE   6  -3.837  -0.148  -4.043
   46   HG23  ILE   6          HG23      ILE   6  -4.161  -1.855  -4.348
   47   HD11  ILE   6          HD11      ILE   6  -6.619  -2.544  -4.162
   48   HD12  ILE   6          HD12      ILE   6  -6.313  -0.872  -3.694
   49   HD13  ILE   6          HD13      ILE   6  -7.507  -1.828  -2.816
   50    H    ALA   7           H        ALA   7  -0.962  -1.613  -2.213
   51    HA   ALA   7           HA       ALA   7  -0.348   1.016  -0.932
   52    HB1  ALA   7           HB1      ALA   7   1.495   0.000  -0.146
   53    HB2  ALA   7           HB2      ALA   7   2.035  -0.237  -1.809
   54    HB3  ALA   7           HB3      ALA   7   1.074  -1.481  -1.008
   55    H    LYS   8           H        LYS   8  -1.473   0.100  -3.732
   56    HA   LYS   8           HA       LYS   8   0.371   1.848  -5.295
   57    HB2  LYS   8           HB3      LYS   8  -1.181  -0.106  -6.854
   58    HB3  LYS   8           HB2      LYS   8   0.520   0.327  -6.980
   59    HG2  LYS   8           HG3      LYS   8  -0.653  -1.484  -4.844
   60    HG3  LYS   8           HG2      LYS   8   0.232  -2.030  -6.266
   61    HD2  LYS   8           HD3      LYS   8   1.729   0.027  -4.883
   62    HD3  LYS   8           HD2      LYS   8   1.329  -1.293  -3.782
   63    HE2  LYS   8           HE3      LYS   8   2.250  -2.920  -5.384
   64    HE3  LYS   8           HE2      LYS   8   2.635  -1.611  -6.502
   65    HZ1  LYS   8           HZ1      LYS   8   4.406  -2.517  -4.825
   66    HZ2  LYS   8           HZ2      LYS   8   3.642  -1.445  -3.755
   67    HZ3  LYS   8           HZ3      LYS   8   4.326  -0.861  -5.197
   68    HA   PRO   9           HA       PRO   9  -3.135   4.366  -6.165
   69    HB2  PRO   9           HB2      PRO   9  -2.692   4.983  -8.835
   70    HB3  PRO   9           HB3      PRO   9  -1.915   5.790  -7.461
   71    HG2  PRO   9           HG3      PRO   9  -0.864   3.674  -9.253
   72    HG3  PRO   9           HG2      PRO   9  -0.025   5.037  -8.497
   73    HD2  PRO   9           HD3      PRO   9   0.202   2.490  -7.568
   74    HD3  PRO   9           HD2      PRO   9   0.302   3.906  -6.501
   75    H    HIS  10           H        HIS  10  -2.542   1.659  -8.343
   76    HA   HIS  10           HA       HIS  10  -5.469   1.320  -8.585
   77    HB2  HIS  10           HB3      HIS  10  -4.567   2.692 -10.561
   78    HB3  HIS  10           HB2      HIS  10  -3.731   1.220 -11.055
   79    HD1  HIS  10           HD1      HIS  10  -7.281   2.098  -9.935
   80    HD2  HIS  10           HD2      HIS  10  -5.312  -0.250 -12.768
   81    HE1  HIS  10           HE1      HIS  10  -9.086   0.971 -11.315
   82    HE2  HIS  10           HE2      HIS  10  -7.898  -0.460 -13.041
   83    H    ASN  11           H        ASN  11  -2.407   0.070  -8.136
   84    HA   ASN  11           HA       ASN  11  -3.270  -2.682  -8.925
   85    HB2  ASN  11           HB3      ASN  11  -0.472  -1.636  -8.396
   86    HB3  ASN  11           HB2      ASN  11  -0.888  -3.251  -8.968
   87   HD21  ASN  11          HD22      ASN  11  -0.374   0.051  -9.950
   88   HD22  ASN  11          HD21      ASN  11  -0.719  -0.172 -11.598
   89    H    CYS  12           H        CYS  12  -2.443  -4.411  -7.397
   90    HA   CYS  12           HA       CYS  12  -2.505  -3.423  -4.571
   91    HB2  CYS  12           HB3      CYS  12  -3.476  -6.125  -5.535
   92    HB3  CYS  12           HB2      CYS  12  -3.728  -5.395  -3.950
   93    H    VAL  13           H        VAL  13  -1.320  -4.887  -3.041
   94    HA   VAL  13           HA       VAL  13   1.296  -5.533  -4.067
   95    HB   VAL  13           HB       VAL  13   0.015  -6.383  -1.451
   96   HG11  VAL  13          HG11      VAL  13   2.640  -6.790  -2.670
   97   HG12  VAL  13          HG12      VAL  13   1.943  -7.547  -1.238
   98   HG13  VAL  13          HG13      VAL  13   2.748  -5.984  -1.106
   99   HG21  VAL  13          HG21      VAL  13   0.282  -4.263  -0.721
  100   HG22  VAL  13          HG22      VAL  13   0.590  -3.798  -2.395
  101   HG23  VAL  13          HG23      VAL  13   1.936  -4.206  -1.331
  102    H    TYR  14           H        TYR  14   2.014  -7.434  -4.929
  103    HA   TYR  14           HA       TYR  14   0.106  -9.580  -5.421
  104    HB2  TYR  14           HB3      TYR  14   1.838 -10.592  -6.722
  105    HB3  TYR  14           HB2      TYR  14   1.989  -8.855  -6.986
  106    HD1  TYR  14           HD1      TYR  14   3.740  -7.550  -5.763
  107    HD2  TYR  14           HD2      TYR  14   3.559 -11.840  -5.612
  108    HE1  TYR  14           HE1      TYR  14   6.072  -7.619  -4.921
  109    HE2  TYR  14           HE2      TYR  14   5.891 -11.907  -4.770
  110    HH   TYR  14           HH       TYR  14   7.829  -8.947  -4.484
  111    H    GLU  15           H        GLU  15   2.990  -9.163  -3.394
  112    HA   GLU  15           HA       GLU  15   2.026 -10.932  -1.357
  113    HB2  GLU  15           HB3      GLU  15   2.613 -12.602  -3.186
  114    HB3  GLU  15           HB2      GLU  15   4.291 -12.088  -3.007
  115    HG2  GLU  15           HG3      GLU  15   3.976 -14.042  -1.624
  116    HG3  GLU  15           HG2      GLU  15   4.117 -12.646  -0.554
  117    H    CYS  16           H        CYS  16   2.789  -9.383   0.096
  118    HA   CYS  16           HA       CYS  16   5.338  -8.098  -0.112
  119    HB2  CYS  16           HB3      CYS  16   3.455  -7.271   1.302
  120    HB3  CYS  16           HB2      CYS  16   3.725  -8.624   2.402
  121    H    PHE  17           H        PHE  17   7.306  -8.573   0.971
  122    HA   PHE  17           HA       PHE  17   7.507 -11.367   2.030
  123    HB2  PHE  17           HB3      PHE  17   9.355 -11.774   0.739
  124    HB3  PHE  17           HB2      PHE  17   8.627 -10.545  -0.292
  125    HD1  PHE  17           HD2      PHE  17   9.255  -8.059   0.241
  126    HD2  PHE  17           HD1      PHE  17  11.522 -11.458   1.565
  127    HE1  PHE  17           HE2      PHE  17  11.239  -6.609   0.575
  128    HE2  PHE  17           HE1      PHE  17  13.505 -10.007   1.897
  129    HZ   PHE  17           HZ       PHE  17  13.363  -7.584   1.401
  130    H    ASP  18           H        ASP  18  10.214 -11.111   2.889
  131    HA   ASP  18           HA       ASP  18   9.868  -9.980   5.462
  132    HB2  ASP  18           HB3      ASP  18  12.416 -10.484   3.898
  133    HB3  ASP  18           HB2      ASP  18  12.372 -10.075   5.612
  134    H    ALA  19           H        ALA  19  10.352  -7.956   6.318
  135    HA   ALA  19           HA       ALA  19  10.322  -5.727   4.455
  136    HB1  ALA  19           HB1      ALA  19  10.223  -6.082   7.407
  137    HB2  ALA  19           HB2      ALA  19   9.201  -5.102   6.357
  138    HB3  ALA  19           HB3      ALA  19  10.805  -4.527   6.813
  139    H    PHE  20           H        PHE  20  12.797  -7.701   5.115
  140    HA   PHE  20           HA       PHE  20  14.953  -6.138   6.012
  141    HB2  PHE  20           HB3      PHE  20  15.067  -8.581   5.466
  142    HB3  PHE  20           HB2      PHE  20  15.058  -8.161   3.753
  143    HD1  PHE  20           HD1      PHE  20  16.971  -7.888   6.917
  144    HD2  PHE  20           HD2      PHE  20  17.002  -7.245   2.670
  145    HE1  PHE  20           HE1      PHE  20  19.419  -7.503   6.993
  146    HE2  PHE  20           HE2      PHE  20  19.451  -6.860   2.747
  147    HZ   PHE  20           HZ       PHE  20  20.659  -6.989   4.908
  148    H    SER  21           H        SER  21  13.662  -6.417   2.691
  149    HA   SER  21           HA       SER  21  15.480  -4.275   1.793
  150    HB2  SER  21           HB3      SER  21  14.907  -6.275   0.345
  151    HB3  SER  21           HB2      SER  21  13.272  -5.632   0.224
  152    HG   SER  21           HG       SER  21  14.003  -4.348  -1.254
  153    H    SER  22           H        SER  22  12.592  -4.412   3.407
  154    HA   SER  22           HA       SER  22  10.873  -2.860   3.770
  155    HB2  SER  22           HB3      SER  22  13.209  -1.208   2.881
  156    HB3  SER  22           HB2      SER  22  11.639  -0.427   3.041
  157    HG   SER  22           HG       SER  22  13.111  -0.572   4.964
  158    H    TYR  23           H        TYR  23  10.356  -4.326   1.559
  159    HA   TYR  23           HA       TYR  23  10.115  -2.907  -0.903
  160    HB2  TYR  23           HB3      TYR  23   9.863  -5.355  -0.738
  161    HB3  TYR  23           HB2      TYR  23   8.375  -5.141   0.186
  162    HD1  TYR  23           HD2      TYR  23   9.952  -4.832  -3.130
  163    HD2  TYR  23           HD1      TYR  23   6.335  -4.322  -0.869
  164    HE1  TYR  23           HE2      TYR  23   8.663  -4.629  -5.239
  165    HE2  TYR  23           HE1      TYR  23   5.046  -4.121  -2.979
  166    HH   TYR  23           HH       TYR  23   5.467  -3.493  -5.336
  167    H    CYS  24           H        CYS  24   7.640  -3.501   1.611
  168    HA   CYS  24           HA       CYS  24   5.731  -1.712   0.378
  169    HB2  CYS  24           HB3      CYS  24   5.841  -3.439   2.709
  170    HB3  CYS  24           HB2      CYS  24   5.088  -1.893   3.100
  171    H    ASN  25           H        ASN  25   7.788  -1.420   3.278
  172    HA   ASN  25           HA       ASN  25   7.134   1.281   3.861
  173    HB2  ASN  25           HB3      ASN  25   9.763  -0.167   4.315
  174    HB3  ASN  25           HB2      ASN  25   9.263   1.325   5.114
  175   HD21  ASN  25          HD22      ASN  25   6.572  -0.691   4.570
  176   HD22  ASN  25          HD21      ASN  25   6.480  -1.392   6.113
  177    H    GLY  26           H        GLY  26   9.516  -0.137   1.668
  178    HA2  GLY  26           HA3      GLY  26  10.876   2.273   0.969
  179    HA3  GLY  26           HA2      GLY  26  10.764   0.845  -0.062
  180    H    VAL  27           H        VAL  27   7.920   0.755  -0.297
  181    HA   VAL  27           HA       VAL  27   7.511   2.553  -2.478
  182    HB   VAL  27           HB       VAL  27   5.532   1.007  -0.779
  183   HG11  VAL  27          HG11      VAL  27   4.065   1.381  -2.869
  184   HG12  VAL  27          HG12      VAL  27   5.175   2.694  -3.258
  185   HG13  VAL  27          HG13      VAL  27   4.246   2.740  -1.760
  186   HG21  VAL  27          HG21      VAL  27   5.991  -0.750  -2.131
  187   HG22  VAL  27          HG22      VAL  27   7.418   0.152  -2.641
  188   HG23  VAL  27          HG23      VAL  27   5.927   0.256  -3.579
  189    H    CYS  28           H        CYS  28   6.434   2.674   0.911
  190    HA   CYS  28           HA       CYS  28   4.967   5.124   0.674
  191    HB2  CYS  28           HB3      CYS  28   6.328   3.784   3.023
  192    HB3  CYS  28           HB2      CYS  28   5.403   5.277   3.187
  193    H    THR  29           H        THR  29   8.377   4.405   1.182
  194    HA   THR  29           HA       THR  29   9.245   6.997   1.987
  195    HB   THR  29           HB       THR  29  10.751   5.000   0.269
  196    HG1  THR  29           HG1      THR  29  11.371   4.090   2.185
  197   HG21  THR  29          HG21      THR  29  12.738   6.045   1.179
  198   HG22  THR  29          HG22      THR  29  11.767   7.071   2.236
  199   HG23  THR  29          HG23      THR  29  11.718   7.309   0.489
  200    H    LYS  30           H        LYS  30   9.101   5.539  -1.262
  201    HA   LYS  30           HA       LYS  30   9.917   7.912  -2.652
  202    HB2  LYS  30           HB3      LYS  30   8.345   5.476  -3.529
  203    HB3  LYS  30           HB2      LYS  30   8.882   6.739  -4.640
  204    HG2  LYS  30           HG3      LYS  30  11.037   6.033  -4.590
  205    HG3  LYS  30           HG2      LYS  30  11.000   5.767  -2.847
  206    HD2  LYS  30           HD3      LYS  30  10.149   3.600  -3.060
  207    HD3  LYS  30           HD2      LYS  30   9.516   3.900  -4.681
  208    HE2  LYS  30           HE3      LYS  30  11.633   2.467  -4.547
  209    HE3  LYS  30           HE2      LYS  30  11.692   3.839  -5.652
  210    HZ1  LYS  30           HZ1      LYS  30  12.466   4.658  -3.067
  211    HZ2  LYS  30           HZ2      LYS  30  13.362   4.696  -4.506
  212    HZ3  LYS  30           HZ3      LYS  30  13.390   3.308  -3.526
  213    H    ASN  31           H        ASN  31   6.744   6.592  -1.791
  214    HA   ASN  31           HA       ASN  31   5.154   8.525  -3.158
  215    HB2  ASN  31           HB3      ASN  31   4.372   6.362  -2.037
  216    HB3  ASN  31           HB2      ASN  31   4.429   7.249  -0.513
  217   HD21  ASN  31          HD22      ASN  31   1.928   6.480  -1.020
  218   HD22  ASN  31          HD21      ASN  31   0.977   7.718  -1.687
  219    H    GLY  32           H        GLY  32   6.876   8.611  -0.106
  220    HA2  GLY  32           HA3      GLY  32   7.593  10.745   0.843
  221    HA3  GLY  32           HA2      GLY  32   6.158  11.494   0.138
  222    H    ALA  33           H        ALA  33   5.165   8.583   1.292
  223    HA   ALA  33           HA       ALA  33   3.680   9.727   3.470
  224    HB1  ALA  33           HB1      ALA  33   3.476   7.116   4.011
  225    HB2  ALA  33           HB2      ALA  33   4.109   6.984   2.371
  226    HB3  ALA  33           HB3      ALA  33   2.601   7.850   2.666
  227    H    LYS  34           H        LYS  34   3.974   9.368   5.748
  228    HA   LYS  34           HA       LYS  34   6.634   9.593   6.704
  229    HB2  LYS  34           HB3      LYS  34   4.536  10.216   7.960
  230    HB3  LYS  34           HB2      LYS  34   4.276   8.497   8.259
  231    HG2  LYS  34           HG3      LYS  34   6.818   8.652   9.093
  232    HG3  LYS  34           HG2      LYS  34   6.350  10.326   9.385
  233    HD2  LYS  34           HD3      LYS  34   4.795   7.925  10.391
  234    HD3  LYS  34           HD2      LYS  34   5.961   8.828  11.358
  235    HE2  LYS  34           HE3      LYS  34   4.272  10.774  10.228
  236    HE3  LYS  34           HE2      LYS  34   3.203   9.480  10.769
  237    HZ1  LYS  34           HZ1      LYS  34   4.102   9.595  12.943
  238    HZ2  LYS  34           HZ2      LYS  34   3.735  11.186  12.483
  239    HZ3  LYS  34           HZ3      LYS  34   5.345  10.645  12.455
  240    H    SER  35           H        SER  35   4.569   6.843   7.628
  241    HA   SER  35           HA       SER  35   6.732   4.979   6.834
  242    HB2  SER  35           HB3      SER  35   5.537   5.099   9.618
  243    HB3  SER  35           HB2      SER  35   6.661   3.871   9.043
  244    HG   SER  35           HG       SER  35   7.490   6.443   8.583
  245    H    GLY  36           H        GLY  36   5.971   2.727   6.789
  246    HA2  GLY  36           HA3      GLY  36   3.027   2.399   6.902
  247    HA3  GLY  36           HA2      GLY  36   3.848   2.000   5.393
  248    H    TYR  37           H        TYR  37   2.412   0.060   6.849
  249    HA   TYR  37           HA       TYR  37   4.643  -1.694   7.808
  250    HB2  TYR  37           HB3      TYR  37   1.787  -1.690   8.825
  251    HB3  TYR  37           HB2      TYR  37   3.123  -2.667   9.435
  252    HD1  TYR  37           HD1      TYR  37   1.795   0.778   9.129
  253    HD2  TYR  37           HD2      TYR  37   4.798  -1.739  10.893
  254    HE1  TYR  37           HE1      TYR  37   2.455   2.626  10.651
  255    HE2  TYR  37           HE2      TYR  37   5.458   0.108  12.411
  256    HH   TYR  37           HH       TYR  37   5.320   2.606  12.432
  257    H    CYS  38           H        CYS  38   4.651  -3.770   6.980
  258    HA   CYS  38           HA       CYS  38   2.451  -4.452   5.068
  259    HB2  CYS  38           HB3      CYS  38   4.104  -4.645   3.547
  260    HB3  CYS  38           HB2      CYS  38   5.347  -4.453   4.781
  261    H    GLN  39           H        GLN  39   1.219  -6.093   5.821
  262    HA   GLN  39           HA       GLN  39   2.560  -8.286   7.329
  263    HB2  GLN  39           HB3      GLN  39   0.017  -6.855   8.157
  264    HB3  GLN  39           HB2      GLN  39   0.639  -8.322   8.918
  265    HG2  GLN  39           HG3      GLN  39   2.747  -7.132   9.458
  266    HG3  GLN  39           HG2      GLN  39   2.089  -5.662   8.742
  267   HE21  GLN  39          HE22      GLN  39  -0.598  -6.984  10.036
  268   HE22  GLN  39          HE21      GLN  39  -0.549  -6.321  11.597
  269    H    ILE  40           H        ILE  40   0.773 -10.145   7.600
  270    HA   ILE  40           HA       ILE  40  -0.245 -10.569   4.857
  271    HB   ILE  40           HB       ILE  40  -0.044 -12.812   5.254
  272   HG12  ILE  40          HG13      ILE  40  -0.955 -12.204   8.082
  273   HG13  ILE  40          HG12      ILE  40  -1.869 -13.031   6.816
  274   HG21  ILE  40          HG21      ILE  40   1.495 -12.053   7.726
  275   HG22  ILE  40          HG22      ILE  40   2.054 -11.537   6.135
  276   HG23  ILE  40          HG23      ILE  40   1.894 -13.255   6.497
  277   HD11  ILE  40          HD11      ILE  40   0.293 -14.065   8.570
  278   HD12  ILE  40          HD12      ILE  40   0.322 -14.610   6.894
  279   HD13  ILE  40          HD13      ILE  40  -1.105 -14.899   7.890
  280    H    LEU  41           H        LEU  41  -2.422 -10.769   4.379
  281    HA   LEU  41           HA       LEU  41  -4.319  -9.510   6.112
  282    HB2  LEU  41           HB3      LEU  41  -4.324  -9.994   3.497
  283    HB3  LEU  41           HB2      LEU  41  -5.204 -11.437   4.001
  284    HG   LEU  41           HG       LEU  41  -6.811  -9.698   3.527
  285   HD11  LEU  41          HD11      LEU  41  -8.056  -9.758   5.520
  286   HD12  LEU  41          HD12      LEU  41  -6.614  -9.685   6.529
  287   HD13  LEU  41          HD13      LEU  41  -7.008 -11.167   5.657
  288   HD21  LEU  41          HD21      LEU  41  -4.795  -7.990   4.473
  289   HD22  LEU  41          HD22      LEU  41  -6.111  -7.828   5.635
  290   HD23  LEU  41          HD23      LEU  41  -6.402  -7.515   3.924
  291    H    GLY  42           H        GLY  42  -3.557 -12.908   5.430
  292    HA2  GLY  42           HA3      GLY  42  -3.837 -14.717   6.966
  293    HA3  GLY  42           HA2      GLY  42  -4.828 -13.668   7.982
  294    H    THR  43           H        THR  43  -5.801 -13.320   4.801
  295    HA   THR  43           HA       THR  43  -7.578 -15.648   4.703
  296    HB   THR  43           HB       THR  43  -8.752 -12.870   5.007
  297    HG1  THR  43           HG1      THR  43  -7.831 -14.026   6.910
  298   HG21  THR  43          HG21      THR  43 -10.450 -13.867   3.881
  299   HG22  THR  43          HG22      THR  43 -10.750 -14.712   5.399
  300   HG23  THR  43          HG23      THR  43  -9.790 -15.482   4.136
  301    H    TYR  44           H        TYR  44  -8.166 -12.414   3.379
  302    HA   TYR  44           HA       TYR  44  -8.524 -13.374   0.716
  303    HB2  TYR  44           HB3      TYR  44  -7.801 -10.586   1.668
  304    HB3  TYR  44           HB2      TYR  44  -8.404 -10.987   0.061
  305    HD1  TYR  44           HD2      TYR  44 -10.702 -11.981  -0.195
  306    HD2  TYR  44           HD1      TYR  44  -9.278 -10.403   3.537
  307    HE1  TYR  44           HE2      TYR  44 -13.033 -11.869   0.648
  308    HE2  TYR  44           HE1      TYR  44 -11.607 -10.291   4.380
  309    HH   TYR  44           HH       TYR  44 -14.327 -11.494   2.423
  310    H    GLY  45           H        GLY  45  -5.669 -12.072   2.378
  311    HA2  GLY  45           HA3      GLY  45  -3.734 -13.461   0.979
  312    HA3  GLY  45           HA2      GLY  45  -4.053 -12.064  -0.047
  313    H    ASN  46           H        ASN  46  -2.691 -10.402   0.326
  314    HA   ASN  46           HA       ASN  46  -1.499 -10.126   3.035
  315    HB2  ASN  46           HB3      ASN  46  -0.488  -9.464   0.276
  316    HB3  ASN  46           HB2      ASN  46   0.230  -8.742   1.712
  317   HD21  ASN  46          HD22      ASN  46   0.896 -10.427   3.467
  318   HD22  ASN  46          HD21      ASN  46   1.549 -11.891   2.908
  319    H    GLY  47           H        GLY  47  -1.358  -8.014   3.949
  320    HA2  GLY  47           HA3      GLY  47  -3.002  -5.922   2.585
  321    HA3  GLY  47           HA2      GLY  47  -3.234  -6.279   4.296
  322    H    CYS  48           H        CYS  48  -1.701  -4.202   2.219
  323    HA   CYS  48           HA       CYS  48   0.475  -3.624   4.186
  324    HB2  CYS  48           HB3      CYS  48   1.174  -4.240   1.829
  325    HB3  CYS  48           HB2      CYS  48   0.365  -2.772   1.282
  326    H    TRP  49           H        TRP  49  -0.073  -1.879   5.446
  327    HA   TRP  49           HA       TRP  49  -1.788   0.220   4.204
  328    HB2  TRP  49           HB3      TRP  49  -1.851   0.811   6.858
  329    HB3  TRP  49           HB2      TRP  49  -3.038  -0.203   6.046
  330    HD1  TRP  49           HD1      TRP  49  -0.010  -0.373   8.344
  331    HE1  TRP  49           HE1      TRP  49   0.098  -2.717   9.408
  332    HE3  TRP  49           HE3      TRP  49  -3.700  -2.707   5.700
  333    HZ2  TRP  49           HZ2      TRP  49  -1.216  -5.243   9.171
  334    HZ3  TRP  49           HZ3      TRP  49  -4.251  -5.082   6.142
  335    HH2  TRP  49           HH2      TRP  49  -3.013  -6.353   7.872
  336    H    CYS  50           H        CYS  50  -1.087   2.298   4.108
  337    HA   CYS  50           HA       CYS  50   1.669   2.833   5.140
  338    HB2  CYS  50           HB3      CYS  50   1.123   3.002   2.608
  339    HB3  CYS  50           HB2      CYS  50   0.249   4.472   3.039
  340    H    ILE  51           H        ILE  51   1.867   4.442   6.684
  341    HA   ILE  51           HA       ILE  51  -0.637   5.866   7.426
  342    HB   ILE  51           HB       ILE  51   1.938   5.662   9.009
  343   HG12  ILE  51          HG13      ILE  51   1.163   3.406   8.733
  344   HG13  ILE  51          HG12      ILE  51   0.610   3.926  10.325
  345   HG21  ILE  51          HG21      ILE  51  -0.899   6.501   9.643
  346   HG22  ILE  51          HG22      ILE  51   0.571   7.463   9.793
  347   HG23  ILE  51          HG23      ILE  51   0.283   6.115  10.895
  348   HD11  ILE  51          HD11      ILE  51  -1.298   2.917   9.368
  349   HD12  ILE  51          HD12      ILE  51  -0.994   3.638   7.787
  350   HD13  ILE  51          HD13      ILE  51  -1.563   4.643   9.121
  351    H    ALA  52           H        ALA  52  -0.831   7.947   6.855
  352    HA   ALA  52           HA       ALA  52   1.187   9.928   7.178
  353    HB1  ALA  52           HB1      ALA  52   0.758   9.603   4.254
  354    HB2  ALA  52           HB2      ALA  52   1.837   8.434   5.011
  355    HB3  ALA  52           HB3      ALA  52   2.184  10.159   5.126
  356    H    LEU  53           H        LEU  53   0.264  11.375   4.694
  357    HA   LEU  53           HA       LEU  53  -2.539  11.580   4.553
  358    HB2  LEU  53           HB3      LEU  53  -1.675  12.509   7.047
  359    HB3  LEU  53           HB2      LEU  53  -1.891  13.972   6.091
  360    HG   LEU  53           HG       LEU  53  -4.154  12.937   5.375
  361   HD11  LEU  53          HD11      LEU  53  -5.088  11.439   7.186
  362   HD12  LEU  53          HD12      LEU  53  -3.447  11.276   7.813
  363   HD13  LEU  53          HD13      LEU  53  -3.837  10.685   6.198
  364   HD21  LEU  53          HD21      LEU  53  -4.211  14.861   6.753
  365   HD22  LEU  53          HD22      LEU  53  -3.489  14.010   8.120
  366   HD23  LEU  53          HD23      LEU  53  -5.155  13.671   7.650
  367    HA   PRO  54           HA       PRO  54  -0.307  15.706   3.037
  368    HB2  PRO  54           HB2      PRO  54   2.435  14.551   2.839
  369    HB3  PRO  54           HB3      PRO  54   1.929  16.188   3.302
  370    HG2  PRO  54           HG3      PRO  54   2.793  14.446   5.114
  371    HG3  PRO  54           HG2      PRO  54   1.480  15.581   5.473
  372    HD2  PRO  54           HD3      PRO  54   1.334  12.649   4.899
  373    HD3  PRO  54           HD2      PRO  54   0.341  13.632   5.997
  374    H    ASP  55           H        ASP  55   0.717  12.436   2.159
  375    HA   ASP  55           HA       ASP  55   1.238  12.918  -0.606
  376    HB2  ASP  55           HB3      ASP  55   0.210  10.439   0.809
  377    HB3  ASP  55           HB2      ASP  55   0.735  10.469  -0.875
  378    H    ASN  56           H        ASN  56  -1.749  12.211   1.164
  379    HA   ASN  56           HA       ASN  56  -3.991  12.354   0.496
  380    HB2  ASN  56           HB3      ASN  56  -2.903  14.187  -1.658
  381    HB3  ASN  56           HB2      ASN  56  -4.546  14.156  -1.018
  382   HD21  ASN  56          HD22      ASN  56  -4.022  13.972   1.759
  383   HD22  ASN  56          HD21      ASN  56  -3.223  15.382   2.267
  384    H    VAL  57           H        VAL  57  -2.694  10.104  -0.443
  385    HA   VAL  57           HA       VAL  57  -3.774   9.819  -3.214
  386    HB   VAL  57           HB       VAL  57  -1.413   8.426  -1.923
  387   HG11  VAL  57          HG11      VAL  57  -2.431   6.801  -3.318
  388   HG12  VAL  57          HG12      VAL  57  -1.178   7.523  -4.328
  389   HG13  VAL  57          HG13      VAL  57  -2.863   7.999  -4.537
  390   HG21  VAL  57          HG21      VAL  57  -1.540  10.900  -3.146
  391   HG22  VAL  57          HG22      VAL  57  -1.090   9.840  -4.481
  392   HG23  VAL  57          HG23      VAL  57  -0.090   9.904  -3.030
  393    HA   PRO  58           HA       PRO  58  -6.026   6.794  -0.607
  394    HB2  PRO  58           HB2      PRO  58  -8.537   7.594  -1.230
  395    HB3  PRO  58           HB3      PRO  58  -7.554   8.432  -0.015
  396    HG2  PRO  58           HG3      PRO  58  -8.300   9.275  -2.725
  397    HG3  PRO  58           HG2      PRO  58  -7.824  10.248  -1.326
  398    HD2  PRO  58           HD3      PRO  58  -6.186   9.454  -3.559
  399    HD3  PRO  58           HD2      PRO  58  -5.707  10.418  -2.144
  400    H    ILE  59           H        ILE  59  -8.176   5.473  -1.469
  401    HA   ILE  59           HA       ILE  59  -7.484   4.597  -4.238
  402    HB   ILE  59           HB       ILE  59  -8.821   2.950  -2.076
  403   HG12  ILE  59          HG13      ILE  59  -6.574   3.463  -1.315
  404   HG13  ILE  59          HG12      ILE  59  -6.572   1.812  -1.936
  405   HG21  ILE  59          HG21      ILE  59  -8.854   1.259  -3.605
  406   HG22  ILE  59          HG22      ILE  59  -7.316   1.741  -4.319
  407   HG23  ILE  59          HG23      ILE  59  -8.798   2.582  -4.770
  408   HD11  ILE  59          HD11      ILE  59  -4.670   2.703  -2.958
  409   HD12  ILE  59          HD12      ILE  59  -5.403   4.293  -3.163
  410   HD13  ILE  59          HD13      ILE  59  -5.894   2.957  -4.201
  411    H    ARG  60           H        ARG  60  -9.103   4.786  -5.732
  412    HA   ARG  60           HA       ARG  60 -11.758   5.640  -4.725
  413    HB2  ARG  60           HB3      ARG  60 -10.101   6.497  -6.878
  414    HB3  ARG  60           HB2      ARG  60 -11.572   5.817  -7.574
  415    HG2  ARG  60           HG3      ARG  60 -11.453   7.942  -5.414
  416    HG3  ARG  60           HG2      ARG  60 -11.879   8.210  -7.105
  417    HD2  ARG  60           HD3      ARG  60 -13.588   6.179  -6.437
  418    HD3  ARG  60           HD2      ARG  60 -13.496   7.069  -4.917
  419    HE   ARG  60           HE       ARG  60 -13.893   8.998  -6.926
  420   HH11  ARG  60          HH22      ARG  60 -15.443   6.203  -5.634
  421   HH12  ARG  60          HH21      ARG  60 -17.044   6.764  -5.986
  422   HH21  ARG  60          HH11      ARG  60 -15.976   9.747  -7.395
  423   HH22  ARG  60          HH12      ARG  60 -17.345   8.770  -6.982
  424    H    ILE  61           H        ILE  61 -10.430   2.776  -5.415
  425    HA   ILE  61           HA       ILE  61 -13.019   1.738  -6.439
  426    HB   ILE  61           HB       ILE  61 -11.617   0.159  -7.911
  427   HG12  ILE  61          HG13      ILE  61  -9.505   1.244  -6.626
  428   HG13  ILE  61          HG12      ILE  61  -9.386   0.576  -8.253
  429   HG21  ILE  61          HG21      ILE  61 -11.940   3.113  -8.440
  430   HG22  ILE  61          HG22      ILE  61 -12.975   1.791  -8.980
  431   HG23  ILE  61          HG23      ILE  61 -11.369   1.994  -9.679
  432   HD11  ILE  61          HD11      ILE  61 -10.087   3.475  -7.757
  433   HD12  ILE  61          HD12      ILE  61  -9.545   2.729  -9.260
  434   HD13  ILE  61          HD13      ILE  61  -8.421   2.926  -7.917
  435    HA   PRO  62           HA       PRO  62 -12.563  -1.322  -3.295
  436    HB2  PRO  62           HB2      PRO  62 -13.443  -3.577  -4.697
  437    HB3  PRO  62           HB3      PRO  62 -14.479  -2.421  -3.845
  438    HG2  PRO  62           HG3      PRO  62 -13.863  -2.639  -6.734
  439    HG3  PRO  62           HG2      PRO  62 -15.353  -2.122  -5.927
  440    HD2  PRO  62           HD3      PRO  62 -13.659  -0.353  -7.092
  441    HD3  PRO  62           HD2      PRO  62 -14.611   0.059  -5.649
  442    H    GLY  63           H        GLY  63 -11.322  -3.260  -2.715
  443    HA2  GLY  63           HA3      GLY  63  -8.747  -3.366  -3.974
  444    HA3  GLY  63           HA2      GLY  63  -9.329  -4.498  -2.752
  445    H    LYS  64           H        LYS  64 -11.081  -4.009  -5.759
  446    HA   LYS  64           HA       LYS  64 -11.210  -6.765  -6.381
  447    HB2  LYS  64           HB3      LYS  64 -12.687  -5.014  -7.373
  448    HB3  LYS  64           HB2      LYS  64 -11.322  -4.448  -8.336
  449    HG2  LYS  64           HG3      LYS  64 -11.128  -6.717  -9.343
  450    HG3  LYS  64           HG2      LYS  64 -12.555  -7.216  -8.435
  451    HD2  LYS  64           HD3      LYS  64 -13.850  -5.391  -9.546
  452    HD3  LYS  64           HD2      LYS  64 -12.430  -5.024 -10.526
  453    HE2  LYS  64           HE3      LYS  64 -12.615  -7.705 -10.928
  454    HE3  LYS  64           HE2      LYS  64 -14.317  -7.300 -10.714
  455    HZ1  LYS  64           HZ1      LYS  64 -14.353  -6.044 -12.580
  456    HZ2  LYS  64           HZ2      LYS  64 -13.104  -7.096 -13.037
  457    HZ3  LYS  64           HZ3      LYS  64 -12.734  -5.552 -12.431
  458    H    CYS  65           H        CYS  65  -8.844  -4.306  -7.280
  459    HA   CYS  65           HA       CYS  65  -6.734  -4.504  -8.283
  460    HB2  CYS  65           HB3      CYS  65  -6.949  -7.426  -7.504
  461    HB3  CYS  65           HB2      CYS  65  -5.474  -6.499  -7.778
  462    H    HIS  66           H        HIS  66  -7.991  -7.769  -8.995
  463    HA   HIS  66           HA       HIS  66  -8.303  -7.000 -11.843
  464    HB2  HIS  66           HB3      HIS  66  -5.954  -7.805 -11.564
  465    HB3  HIS  66           HB2      HIS  66  -6.583  -9.338 -10.957
  466    HD1  HIS  66           HD1      HIS  66  -7.079  -7.137 -14.049
  467    HD2  HIS  66           HD2      HIS  66  -6.959 -11.169 -12.983
  468    HE1  HIS  66           HE1      HIS  66  -7.350  -8.456 -16.197
  469    HE2  HIS  66           HE2      HIS  66  -7.278 -10.910 -15.558
  Start of MODEL   13
    1    H1   ALA   1           H1       ALA   1  -8.134   8.761   8.374
    2    H2   ALA   1           H2       ALA   1  -7.233   7.400   7.901
    3    H3   ALA   1           H3       ALA   1  -8.383   8.070   6.845
    4    HA   ALA   1           HA       ALA   1  -6.981   9.597   6.070
    5    HB1  ALA   1           HB1      ALA   1  -6.398  11.255   7.482
    6    HB2  ALA   1           HB2      ALA   1  -5.316  10.181   8.369
    7    HB3  ALA   1           HB3      ALA   1  -7.023  10.269   8.803
    8    H    ARG   2           H        ARG   2  -6.300   6.646   7.036
    9    HA   ARG   2           HA       ARG   2  -3.482   6.804   6.072
   10    HB2  ARG   2           HB3      ARG   2  -2.760   5.193   7.742
   11    HB3  ARG   2           HB2      ARG   2  -3.530   6.546   8.572
   12    HG2  ARG   2           HG3      ARG   2  -5.681   5.210   8.550
   13    HG3  ARG   2           HG2      ARG   2  -4.741   3.837   7.965
   14    HD2  ARG   2           HD3      ARG   2  -3.263   4.052   9.969
   15    HD3  ARG   2           HD2      ARG   2  -4.325   5.325  10.573
   16    HE   ARG   2           HE       ARG   2  -6.075   3.256  10.153
   17   HH11  ARG   2          HH22      ARG   2  -3.010   3.560  11.701
   18   HH12  ARG   2          HH21      ARG   2  -3.326   2.319  12.867
   19   HH21  ARG   2          HH11      ARG   2  -6.506   1.633  11.666
   20   HH22  ARG   2          HH12      ARG   2  -5.306   1.228  12.846
   21    H    ASP   3           H        ASP   3  -2.747   4.672   5.182
   22    HA   ASP   3           HA       ASP   3  -5.028   3.305   3.875
   23    HB2  ASP   3           HB3      ASP   3  -2.050   3.142   3.346
   24    HB3  ASP   3           HB2      ASP   3  -3.296   2.331   2.405
   25    H    ALA   4           H        ALA   4  -5.354   1.054   4.075
   26    HA   ALA   4           HA       ALA   4  -3.994  -0.158   6.420
   27    HB1  ALA   4           HB1      ALA   4  -6.304  -0.255   6.782
   28    HB2  ALA   4           HB2      ALA   4  -5.950  -1.854   6.124
   29    HB3  ALA   4           HB3      ALA   4  -6.649  -0.608   5.089
   30    H    TYR   5           H        TYR   5  -5.562  -1.836   3.716
   31    HA   TYR   5           HA       TYR   5  -3.118  -3.519   3.484
   32    HB2  TYR   5           HB3      TYR   5  -5.757  -4.007   2.103
   33    HB3  TYR   5           HB2      TYR   5  -4.516  -5.181   2.542
   34    HD1  TYR   5           HD2      TYR   5  -4.217  -5.884   4.892
   35    HD2  TYR   5           HD1      TYR   5  -7.345  -3.183   3.723
   36    HE1  TYR   5           HE2      TYR   5  -5.354  -6.263   7.064
   37    HE2  TYR   5           HE1      TYR   5  -8.484  -3.562   5.895
   38    HH   TYR   5           HH       TYR   5  -8.480  -5.546   7.650
   39    H    ILE   6           H        ILE   6  -4.759  -1.001   1.838
   40    HA   ILE   6           HA       ILE   6  -3.605  -1.744  -0.783
   41    HB   ILE   6           HB       ILE   6  -5.357   0.608  -0.016
   42   HG12  ILE   6          HG13      ILE   6  -6.092  -2.014  -1.357
   43   HG13  ILE   6          HG12      ILE   6  -6.419  -1.633   0.334
   44   HG21  ILE   6          HG21      ILE   6  -3.934  -0.158  -2.433
   45   HG22  ILE   6          HG22      ILE   6  -4.810   1.332  -2.079
   46   HG23  ILE   6          HG23      ILE   6  -5.673  -0.070  -2.711
   47   HD11  ILE   6          HD11      ILE   6  -8.060  -1.032  -1.856
   48   HD12  ILE   6          HD12      ILE   6  -7.320   0.506  -1.413
   49   HD13  ILE   6          HD13      ILE   6  -8.232  -0.411  -0.214
   50    H    ALA   7           H        ALA   7  -2.005  -0.505  -1.803
   51    HA   ALA   7           HA       ALA   7  -0.902   1.795  -0.266
   52    HB1  ALA   7           HB1      ALA   7   1.231   0.380  -1.560
   53    HB2  ALA   7           HB2      ALA   7   0.326  -0.752  -0.556
   54    HB3  ALA   7           HB3      ALA   7   1.016   0.703   0.160
   55    H    LYS   8           H        LYS   8  -2.510   1.331  -2.840
   56    HA   LYS   8           HA       LYS   8  -0.634   2.720  -4.701
   57    HB2  LYS   8           HB3      LYS   8  -2.920   0.817  -5.176
   58    HB3  LYS   8           HB2      LYS   8  -2.373   1.901  -6.452
   59    HG2  LYS   8           HG3      LYS   8  -0.166   0.521  -5.102
   60    HG3  LYS   8           HG2      LYS   8  -1.293  -0.586  -5.886
   61    HD2  LYS   8           HD3      LYS   8  -1.102   0.745  -7.979
   62    HD3  LYS   8           HD2      LYS   8   0.093   1.774  -7.191
   63    HE2  LYS   8           HE3      LYS   8   0.418  -1.224  -7.380
   64    HE3  LYS   8           HE2      LYS   8   1.020  -0.129  -8.625
   65    HZ1  LYS   8           HZ1      LYS   8   2.095  -0.701  -6.046
   66    HZ2  LYS   8           HZ2      LYS   8   1.867   0.965  -6.267
   67    HZ3  LYS   8           HZ3      LYS   8   2.817   0.087  -7.366
   68    HA   PRO   9           HA       PRO   9  -3.152   6.333  -4.465
   69    HB2  PRO   9           HB2      PRO   9  -3.148   7.128  -7.128
   70    HB3  PRO   9           HB3      PRO   9  -1.855   7.462  -5.963
   71    HG2  PRO   9           HG3      PRO   9  -2.015   5.375  -8.066
   72    HG3  PRO   9           HG2      PRO   9  -0.618   6.297  -7.487
   73    HD2  PRO   9           HD3      PRO   9  -1.044   3.711  -6.768
   74    HD3  PRO   9           HD2      PRO   9  -0.253   4.879  -5.687
   75    H    HIS  10           H        HIS  10  -4.009   4.003  -7.005
   76    HA   HIS  10           HA       HIS  10  -6.856   4.493  -6.392
   77    HB2  HIS  10           HB3      HIS  10  -5.731   4.736  -9.197
   78    HB3  HIS  10           HB2      HIS  10  -7.443   4.767  -8.777
   79    HD1  HIS  10           HD1      HIS  10  -4.321   6.831  -8.648
   80    HD2  HIS  10           HD2      HIS  10  -8.305   7.163  -7.457
   81    HE1  HIS  10           HE1      HIS  10  -4.687   9.263  -8.035
   82    HE2  HIS  10           HE2      HIS  10  -7.108   9.475  -7.310
   83    H    ASN  11           H        ASN  11  -4.539   2.332  -6.546
   84    HA   ASN  11           HA       ASN  11  -6.336   0.208  -7.642
   85    HB2  ASN  11           HB3      ASN  11  -3.319   0.262  -7.911
   86    HB3  ASN  11           HB2      ASN  11  -4.420  -0.932  -8.597
   87   HD21  ASN  11          HD22      ASN  11  -2.840   2.041  -9.230
   88   HD22  ASN  11          HD21      ASN  11  -3.715   2.476 -10.619
   89    H    CYS  12           H        CYS  12  -4.746  -1.970  -6.960
   90    HA   CYS  12           HA       CYS  12  -4.552  -1.725  -3.982
   91    HB2  CYS  12           HB3      CYS  12  -5.428  -4.122  -5.619
   92    HB3  CYS  12           HB2      CYS  12  -5.304  -4.067  -3.861
   93    H    VAL  13           H        VAL  13  -3.263  -3.900  -3.231
   94    HA   VAL  13           HA       VAL  13  -0.687  -3.740  -4.714
   95    HB   VAL  13           HB       VAL  13  -1.279  -4.938  -1.988
   96   HG11  VAL  13          HG11      VAL  13   1.313  -4.238  -3.402
   97   HG12  VAL  13          HG12      VAL  13   0.727  -5.864  -3.054
   98   HG13  VAL  13          HG13      VAL  13   1.190  -4.793  -1.733
   99   HG21  VAL  13          HG21      VAL  13  -1.170  -2.221  -2.802
  100   HG22  VAL  13          HG22      VAL  13   0.344  -2.557  -1.961
  101   HG23  VAL  13          HG23      VAL  13  -1.198  -2.847  -1.153
  102    H    TYR  14           H        TYR  14   0.056  -5.477  -5.854
  103    HA   TYR  14           HA       TYR  14  -1.651  -7.735  -6.343
  104    HB2  TYR  14           HB3      TYR  14   0.097  -8.547  -7.761
  105    HB3  TYR  14           HB2      TYR  14   0.125  -6.790  -7.907
  106    HD1  TYR  14           HD2      TYR  14   1.845  -5.455  -6.694
  107    HD2  TYR  14           HD1      TYR  14   1.920  -9.749  -6.754
  108    HE1  TYR  14           HE2      TYR  14   4.205  -5.424  -5.931
  109    HE2  TYR  14           HE1      TYR  14   4.280  -9.718  -5.992
  110    HH   TYR  14           HH       TYR  14   6.130  -8.357  -5.800
  111    H    GLU  15           H        GLU  15   1.169  -7.242  -4.256
  112    HA   GLU  15           HA       GLU  15   0.372  -9.327  -2.453
  113    HB2  GLU  15           HB3      GLU  15   1.210 -10.698  -4.422
  114    HB3  GLU  15           HB2      GLU  15   2.805 -10.003  -4.125
  115    HG2  GLU  15           HG3      GLU  15   2.720 -10.867  -1.794
  116    HG3  GLU  15           HG2      GLU  15   1.174 -11.636  -2.159
  117    H    CYS  16           H        CYS  16   0.900  -7.871  -0.805
  118    HA   CYS  16           HA       CYS  16   3.441  -6.446  -0.808
  119    HB2  CYS  16           HB3      CYS  16   2.364  -5.213   0.741
  120    HB3  CYS  16           HB2      CYS  16   1.006  -6.337   0.677
  121    H    PHE  17           H        PHE  17   5.353  -7.284  -0.146
  122    HA   PHE  17           HA       PHE  17   5.360  -9.953   1.116
  123    HB2  PHE  17           HB3      PHE  17   6.931  -9.845  -0.625
  124    HB3  PHE  17           HB2      PHE  17   7.451  -8.220  -0.180
  125    HD1  PHE  17           HD1      PHE  17   7.510 -11.789   0.870
  126    HD2  PHE  17           HD2      PHE  17   9.164  -7.866   1.441
  127    HE1  PHE  17           HE1      PHE  17   9.292 -12.748   2.306
  128    HE2  PHE  17           HE2      PHE  17  10.944  -8.824   2.876
  129    HZ   PHE  17           HZ       PHE  17  11.006 -11.264   3.310
  130    H    ASP  18           H        ASP  18   6.122 -10.355   3.181
  131    HA   ASP  18           HA       ASP  18   6.139  -8.099   5.024
  132    HB2  ASP  18           HB3      ASP  18   5.171 -10.333   5.599
  133    HB3  ASP  18           HB2      ASP  18   6.801 -11.005   5.567
  134    H    ALA  19           H        ALA  19   7.904  -6.913   5.468
  135    HA   ALA  19           HA       ALA  19  10.558  -8.251   5.545
  136    HB1  ALA  19           HB1      ALA  19   9.888  -6.824   3.342
  137    HB2  ALA  19           HB2      ALA  19  11.534  -6.902   3.967
  138    HB3  ALA  19           HB3      ALA  19  10.505  -5.525   4.362
  139    H    PHE  20           H        PHE  20  12.137  -6.962   6.810
  140    HA   PHE  20           HA       PHE  20  11.095  -5.975   9.234
  141    HB2  PHE  20           HB3      PHE  20  13.482  -6.641   8.837
  142    HB3  PHE  20           HB2      PHE  20  13.713  -5.132   7.952
  143    HD1  PHE  20           HD1      PHE  20  12.789  -6.552  11.269
  144    HD2  PHE  20           HD2      PHE  20  14.047  -3.069   9.093
  145    HE1  PHE  20           HE1      PHE  20  13.183  -5.359  13.407
  146    HE2  PHE  20           HE2      PHE  20  14.437  -1.875  11.231
  147    HZ   PHE  20           HZ       PHE  20  14.006  -3.021  13.388
  148    H    SER  21           H        SER  21  12.055  -4.175   6.311
  149    HA   SER  21           HA       SER  21  10.083  -2.206   6.456
  150    HB2  SER  21           HB3      SER  21  12.305  -1.789   8.354
  151    HB3  SER  21           HB2      SER  21  11.906  -0.389   7.363
  152    HG   SER  21           HG       SER  21  10.664  -0.521   9.307
  153    H    SER  22           H        SER  22  10.625  -2.818   4.170
  154    HA   SER  22           HA       SER  22  12.449  -0.823   3.026
  155    HB2  SER  22           HB3      SER  22  14.121  -2.447   3.249
  156    HB3  SER  22           HB2      SER  22  13.002  -3.777   2.962
  157    HG   SER  22           HG       SER  22  13.914  -1.849   1.083
  158    H    TYR  23           H        TYR  23  10.986  -3.898   1.890
  159    HA   TYR  23           HA       TYR  23  10.199  -2.851  -0.631
  160    HB2  TYR  23           HB3      TYR  23  10.312  -5.271  -0.116
  161    HB3  TYR  23           HB2      TYR  23   8.907  -5.099   0.936
  162    HD1  TYR  23           HD1      TYR  23  10.101  -5.020  -2.556
  163    HD2  TYR  23           HD2      TYR  23   6.685  -4.733   0.033
  164    HE1  TYR  23           HE1      TYR  23   8.599  -5.256  -4.514
  165    HE2  TYR  23           HE2      TYR  23   5.181  -4.972  -1.927
  166    HH   TYR  23           HH       TYR  23   6.349  -4.783  -5.171
  167    H    CYS  24           H        CYS  24   8.107  -3.479   2.212
  168    HA   CYS  24           HA       CYS  24   5.871  -2.062   1.067
  169    HB2  CYS  24           HB3      CYS  24   5.859  -3.795   2.990
  170    HB3  CYS  24           HB2      CYS  24   6.297  -2.440   4.029
  171    H    ASN  25           H        ASN  25   8.281  -1.179   3.537
  172    HA   ASN  25           HA       ASN  25   7.350   1.467   3.990
  173    HB2  ASN  25           HB3      ASN  25  10.198   0.419   4.076
  174    HB3  ASN  25           HB2      ASN  25   9.638   1.923   4.809
  175   HD21  ASN  25          HD22      ASN  25   7.217  -0.475   4.972
  176   HD22  ASN  25          HD21      ASN  25   7.494  -0.984   6.568
  177    H    GLY  26           H        GLY  26   9.497   0.120   1.526
  178    HA2  GLY  26           HA3      GLY  26  10.386   2.576   0.388
  179    HA3  GLY  26           HA2      GLY  26  10.275   1.045  -0.486
  180    H    VAL  27           H        VAL  27   7.487   0.602  -0.246
  181    HA   VAL  27           HA       VAL  27   6.497   2.163  -2.425
  182    HB   VAL  27           HB       VAL  27   5.039   0.512  -0.343
  183   HG11  VAL  27          HG11      VAL  27   3.397   0.583  -2.514
  184   HG12  VAL  27          HG12      VAL  27   4.075   2.211  -2.569
  185   HG13  VAL  27          HG13      VAL  27   3.226   1.658  -1.126
  186   HG21  VAL  27          HG21      VAL  27   6.735  -0.486  -2.071
  187   HG22  VAL  27          HG22      VAL  27   5.459  -0.170  -3.246
  188   HG23  VAL  27          HG23      VAL  27   5.156  -1.252  -1.887
  189    H    CYS  28           H        CYS  28   5.930   2.394   1.080
  190    HA   CYS  28           HA       CYS  28   4.164   4.663   0.898
  191    HB2  CYS  28           HB3      CYS  28   5.789   3.435   3.118
  192    HB3  CYS  28           HB2      CYS  28   4.932   4.955   3.369
  193    H    THR  29           H        THR  29   7.657   4.298   1.063
  194    HA   THR  29           HA       THR  29   8.389   6.938   1.767
  195    HB   THR  29           HB       THR  29   9.786   5.153  -0.248
  196    HG1  THR  29           HG1      THR  29  10.352   5.309   2.504
  197   HG21  THR  29          HG21      THR  29  11.312   6.800  -0.302
  198   HG22  THR  29          HG22      THR  29  11.563   6.597   1.432
  199   HG23  THR  29          HG23      THR  29  10.361   7.746   0.843
  200    H    LYS  30           H        LYS  30   7.799   5.557  -1.464
  201    HA   LYS  30           HA       LYS  30   8.210   8.008  -2.892
  202    HB2  LYS  30           HB3      LYS  30   6.638   5.506  -3.559
  203    HB3  LYS  30           HB2      LYS  30   6.899   6.825  -4.703
  204    HG2  LYS  30           HG3      LYS  30   9.045   6.215  -5.085
  205    HG3  LYS  30           HG2      LYS  30   9.363   5.965  -3.369
  206    HD2  LYS  30           HD3      LYS  30   8.573   3.754  -3.413
  207    HD3  LYS  30           HD2      LYS  30   7.685   4.001  -4.918
  208    HE2  LYS  30           HE3      LYS  30   9.633   3.927  -6.228
  209    HE3  LYS  30           HE2      LYS  30  10.680   4.293  -4.857
  210    HZ1  LYS  30           HZ1      LYS  30   9.704   1.763  -5.780
  211    HZ2  LYS  30           HZ2      LYS  30   9.427   1.996  -4.122
  212    HZ3  LYS  30           HZ3      LYS  30  11.005   2.110  -4.743
  213    H    ASN  31           H        ASN  31   5.325   6.486  -1.509
  214    HA   ASN  31           HA       ASN  31   3.402   8.331  -2.519
  215    HB2  ASN  31           HB3      ASN  31   3.418   6.756   0.075
  216    HB3  ASN  31           HB2      ASN  31   2.010   7.589  -0.583
  217   HD21  ASN  31          HD22      ASN  31   2.044   4.733  -0.213
  218   HD22  ASN  31          HD21      ASN  31   1.989   4.003  -1.744
  219    H    GLY  32           H        GLY  32   5.654   8.513   0.162
  220    HA2  GLY  32           HA3      GLY  32   6.407  10.658   1.025
  221    HA3  GLY  32           HA2      GLY  32   4.856  11.355   0.551
  222    H    ALA  33           H        ALA  33   4.144   8.418   1.825
  223    HA   ALA  33           HA       ALA  33   2.949   9.490   4.200
  224    HB1  ALA  33           HB1      ALA  33   3.479   6.709   3.181
  225    HB2  ALA  33           HB2      ALA  33   1.933   7.525   3.409
  226    HB3  ALA  33           HB3      ALA  33   2.842   6.953   4.807
  227    H    LYS  34           H        LYS  34   3.599   9.212   6.404
  228    HA   LYS  34           HA       LYS  34   6.351   9.584   6.955
  229    HB2  LYS  34           HB3      LYS  34   4.447  10.135   8.504
  230    HB3  LYS  34           HB2      LYS  34   4.294   8.412   8.847
  231    HG2  LYS  34           HG3      LYS  34   6.972   8.771   9.244
  232    HG3  LYS  34           HG2      LYS  34   6.349  10.340   9.751
  233    HD2  LYS  34           HD3      LYS  34   5.295   7.677  10.748
  234    HD3  LYS  34           HD2      LYS  34   6.448   8.686  11.622
  235    HE2  LYS  34           HE3      LYS  34   4.236  10.321  10.799
  236    HE3  LYS  34           HE2      LYS  34   3.612   8.894  11.625
  237    HZ1  LYS  34           HZ1      LYS  34   4.739  11.136  12.780
  238    HZ2  LYS  34           HZ2      LYS  34   5.889   9.903  12.971
  239    HZ3  LYS  34           HZ3      LYS  34   4.309   9.685  13.555
  240    H    SER  35           H        SER  35   4.417   6.646   7.704
  241    HA   SER  35           HA       SER  35   6.786   5.016   6.986
  242    HB2  SER  35           HB3      SER  35   6.778   3.809   9.081
  243    HB3  SER  35           HB2      SER  35   6.891   5.529   9.448
  244    HG   SER  35           HG       SER  35   5.299   4.367  10.695
  245    H    GLY  36           H        GLY  36   6.229   2.692   6.818
  246    HA2  GLY  36           HA3      GLY  36   3.333   2.110   6.631
  247    HA3  GLY  36           HA2      GLY  36   4.300   1.893   5.172
  248    H    TYR  37           H        TYR  37   2.890  -0.206   6.629
  249    HA   TYR  37           HA       TYR  37   5.238  -1.958   7.182
  250    HB2  TYR  37           HB3      TYR  37   2.739  -1.992   8.893
  251    HB3  TYR  37           HB2      TYR  37   4.240  -2.874   9.167
  252    HD1  TYR  37           HD1      TYR  37   6.387  -1.075   8.945
  253    HD2  TYR  37           HD2      TYR  37   2.425  -0.270  10.401
  254    HE1  TYR  37           HE1      TYR  37   7.262   0.833  10.265
  255    HE2  TYR  37           HE2      TYR  37   3.304   1.640  11.724
  256    HH   TYR  37           HH       TYR  37   5.112   3.053  11.932
  257    H    CYS  38           H        CYS  38   4.725  -4.256   6.849
  258    HA   CYS  38           HA       CYS  38   2.448  -4.597   4.981
  259    HB2  CYS  38           HB3      CYS  38   5.120  -5.731   5.176
  260    HB3  CYS  38           HB2      CYS  38   3.884  -6.979   5.032
  261    H    GLN  39           H        GLN  39   0.664  -5.584   5.683
  262    HA   GLN  39           HA       GLN  39   0.848  -7.269   8.145
  263    HB2  GLN  39           HB3      GLN  39  -1.460  -5.583   7.125
  264    HB3  GLN  39           HB2      GLN  39  -1.507  -6.602   8.566
  265    HG2  GLN  39           HG3      GLN  39   0.396  -5.309   9.514
  266    HG3  GLN  39           HG2      GLN  39   0.360  -4.256   8.100
  267   HE21  GLN  39          HE22      GLN  39  -2.814  -4.991   8.519
  268   HE22  GLN  39          HE21      GLN  39  -3.277  -3.729   9.555
  269    H    ILE  40           H        ILE  40  -1.285  -8.777   8.146
  270    HA   ILE  40           HA       ILE  40  -1.061 -10.296   5.618
  271    HB   ILE  40           HB       ILE  40  -2.101 -12.125   6.843
  272   HG12  ILE  40          HG13      ILE  40  -2.424 -10.118   9.101
  273   HG13  ILE  40          HG12      ILE  40  -3.740 -10.769   8.124
  274   HG21  ILE  40          HG21      ILE  40   0.361 -11.411   7.225
  275   HG22  ILE  40          HG22      ILE  40  -0.355 -12.542   8.373
  276   HG23  ILE  40          HG23      ILE  40  -0.199 -10.836   8.795
  277   HD11  ILE  40          HD11      ILE  40  -3.569 -12.007  10.234
  278   HD12  ILE  40          HD12      ILE  40  -1.880 -12.382   9.893
  279   HD13  ILE  40          HD13      ILE  40  -3.155 -13.055   8.877
  280    H    LEU  41           H        LEU  41  -2.803 -10.734   4.279
  281    HA   LEU  41           HA       LEU  41  -5.117  -8.928   4.576
  282    HB2  LEU  41           HB3      LEU  41  -3.901  -9.148   2.388
  283    HB3  LEU  41           HB2      LEU  41  -4.446 -10.823   2.309
  284    HG   LEU  41           HG       LEU  41  -6.812  -9.995   2.500
  285   HD11  LEU  41          HD11      LEU  41  -6.615  -7.379   1.597
  286   HD12  LEU  41          HD12      LEU  41  -5.361  -7.470   2.832
  287   HD13  LEU  41          HD13      LEU  41  -7.029  -7.867   3.240
  288   HD21  LEU  41          HD21      LEU  41  -5.459  -8.678   0.149
  289   HD22  LEU  41          HD22      LEU  41  -6.995  -9.545   0.194
  290   HD23  LEU  41          HD23      LEU  41  -5.477 -10.434   0.309
  291    H    GLY  42           H        GLY  42  -7.249  -9.688   4.845
  292    HA2  GLY  42           HA3      GLY  42  -7.782 -11.947   6.350
  293    HA3  GLY  42           HA2      GLY  42  -8.967 -11.271   5.228
  294    H    THR  43           H        THR  43  -7.270 -11.758   2.879
  295    HA   THR  43           HA       THR  43  -7.956 -14.596   2.497
  296    HB   THR  43           HB       THR  43  -7.574 -14.202   0.165
  297    HG1  THR  43           HG1      THR  43  -5.604 -12.858   0.848
  298   HG21  THR  43          HG21      THR  43  -9.285 -12.572   1.695
  299   HG22  THR  43          HG22      THR  43  -9.417 -12.929  -0.027
  300   HG23  THR  43          HG23      THR  43  -8.538 -11.498   0.513
  301    H    TYR  44           H        TYR  44  -6.239 -15.985   1.359
  302    HA   TYR  44           HA       TYR  44  -3.958 -16.282   2.988
  303    HB2  TYR  44           HB3      TYR  44  -3.183 -17.876   1.404
  304    HB3  TYR  44           HB2      TYR  44  -4.942 -17.936   1.279
  305    HD1  TYR  44           HD2      TYR  44  -6.110 -16.810  -0.607
  306    HD2  TYR  44           HD1      TYR  44  -1.826 -17.036  -0.399
  307    HE1  TYR  44           HE2      TYR  44  -5.962 -16.214  -3.009
  308    HE2  TYR  44           HE1      TYR  44  -1.678 -16.441  -2.801
  309    HH   TYR  44           HH       TYR  44  -3.496 -15.027  -4.460
  310    H    GLY  45           H        GLY  45  -4.593 -13.859   0.717
  311    HA2  GLY  45           HA3      GLY  45  -1.810 -13.407  -0.085
  312    HA3  GLY  45           HA2      GLY  45  -3.181 -12.369  -0.473
  313    H    ASN  46           H        ASN  46  -1.334 -10.782   0.175
  314    HA   ASN  46           HA       ASN  46  -1.737 -10.077   3.030
  315    HB2  ASN  46           HB3      ASN  46   0.801 -10.679   1.625
  316    HB3  ASN  46           HB2      ASN  46   0.811  -9.221   2.615
  317   HD21  ASN  46          HD22      ASN  46   2.221 -10.266   4.223
  318   HD22  ASN  46          HD21      ASN  46   1.610 -11.446   5.278
  319    H    GLY  47           H        GLY  47  -0.940  -7.700   3.357
  320    HA2  GLY  47           HA3      GLY  47  -1.267  -6.110   0.862
  321    HA3  GLY  47           HA2      GLY  47  -2.336  -5.776   2.224
  322    H    CYS  48           H        CYS  48  -0.713  -3.758   1.292
  323    HA   CYS  48           HA       CYS  48   1.576  -3.637   3.173
  324    HB2  CYS  48           HB3      CYS  48   1.096  -2.611   0.518
  325    HB3  CYS  48           HB2      CYS  48   1.508  -1.292   1.614
  326    H    TRP  49           H        TRP  49   1.768  -1.820   4.608
  327    HA   TRP  49           HA       TRP  49  -0.828  -0.444   5.140
  328    HB2  TRP  49           HB3      TRP  49   0.274  -2.126   6.853
  329    HB3  TRP  49           HB2      TRP  49   1.301  -0.743   7.230
  330    HD1  TRP  49           HD1      TRP  49   0.198   1.329   8.415
  331    HE1  TRP  49           HE1      TRP  49  -2.076   1.671   9.583
  332    HE3  TRP  49           HE3      TRP  49  -2.261  -2.834   6.784
  333    HZ2  TRP  49           HZ2      TRP  49  -4.605   0.347   9.796
  334    HZ3  TRP  49           HZ3      TRP  49  -4.597  -3.273   7.480
  335    HH2  TRP  49           HH2      TRP  49  -5.772  -1.688   8.984
  336    H    CYS  50           H        CYS  50  -0.796   1.786   5.263
  337    HA   CYS  50           HA       CYS  50   1.885   3.116   5.177
  338    HB2  CYS  50           HB3      CYS  50   0.202   2.969   3.005
  339    HB3  CYS  50           HB2      CYS  50  -0.282   4.498   3.737
  340    H    ILE  51           H        ILE  51   2.059   4.805   6.603
  341    HA   ILE  51           HA       ILE  51  -0.449   5.696   7.960
  342    HB   ILE  51           HB       ILE  51   2.376   5.595   9.055
  343   HG12  ILE  51          HG13      ILE  51   0.389   4.040  10.464
  344   HG13  ILE  51          HG12      ILE  51   0.418   3.572   8.765
  345   HG21  ILE  51          HG21      ILE  51   1.435   7.310  10.284
  346   HG22  ILE  51          HG22      ILE  51   0.836   5.936  11.211
  347   HG23  ILE  51          HG23      ILE  51  -0.210   6.729  10.033
  348   HD11  ILE  51          HD11      ILE  51   2.760   3.630  10.683
  349   HD12  ILE  51          HD12      ILE  51   2.928   3.387   8.945
  350   HD13  ILE  51          HD13      ILE  51   2.043   2.214   9.917
  351    H    ALA  52           H        ALA  52  -0.988   7.739   7.508
  352    HA   ALA  52           HA       ALA  52   0.902   9.920   7.561
  353    HB1  ALA  52           HB1      ALA  52   1.189  10.413   5.322
  354    HB2  ALA  52           HB2      ALA  52  -0.332   9.653   4.852
  355    HB3  ALA  52           HB3      ALA  52   1.079   8.656   5.205
  356    H    LEU  53           H        LEU  53  -0.241  12.000   7.237
  357    HA   LEU  53           HA       LEU  53  -3.217  11.725   7.247
  358    HB2  LEU  53           HB3      LEU  53  -2.401  11.983   9.573
  359    HB3  LEU  53           HB2      LEU  53  -1.591  13.481   9.109
  360    HG   LEU  53           HG       LEU  53  -4.266  13.683   8.187
  361   HD11  LEU  53          HD11      LEU  53  -5.561  13.357  10.219
  362   HD12  LEU  53          HD12      LEU  53  -4.113  12.886  11.108
  363   HD13  LEU  53          HD13      LEU  53  -4.739  11.847   9.828
  364   HD21  LEU  53          HD21      LEU  53  -2.986  14.934  10.637
  365   HD22  LEU  53          HD22      LEU  53  -4.317  15.594   9.687
  366   HD23  LEU  53          HD23      LEU  53  -2.702  15.486   8.986
  367    HA   PRO  54           HA       PRO  54  -1.697  14.879   4.152
  368    HB2  PRO  54           HB2      PRO  54  -3.978  13.790   2.624
  369    HB3  PRO  54           HB3      PRO  54  -2.290  14.005   2.123
  370    HG2  PRO  54           HG3      PRO  54  -3.352  11.588   2.604
  371    HG3  PRO  54           HG2      PRO  54  -1.651  11.964   2.924
  372    HD2  PRO  54           HD3      PRO  54  -3.917  11.696   4.863
  373    HD3  PRO  54           HD2      PRO  54  -2.206  11.259   5.056
  374    H    ASP  55           H        ASP  55  -5.158  14.036   4.197
  375    HA   ASP  55           HA       ASP  55  -5.845  16.603   5.453
  376    HB2  ASP  55           HB3      ASP  55  -5.581  17.129   3.008
  377    HB3  ASP  55           HB2      ASP  55  -6.858  15.961   2.667
  378    H    ASN  56           H        ASN  56  -7.601  14.323   3.328
  379    HA   ASN  56           HA       ASN  56  -8.868  12.915   5.490
  380    HB2  ASN  56           HB3      ASN  56 -10.987  13.928   5.605
  381    HB3  ASN  56           HB2      ASN  56  -9.890  15.309   5.544
  382   HD21  ASN  56          HD22      ASN  56  -9.849  16.598   3.593
  383   HD22  ASN  56          HD21      ASN  56 -10.995  16.399   2.357
  384    H    VAL  57           H        VAL  57  -7.657  12.516   2.801
  385    HA   VAL  57           HA       VAL  57  -9.945  11.070   1.539
  386    HB   VAL  57           HB       VAL  57  -7.630  12.409   0.113
  387   HG11  VAL  57          HG11      VAL  57  -9.841  10.582  -0.710
  388   HG12  VAL  57          HG12      VAL  57  -8.206  10.729  -1.355
  389   HG13  VAL  57          HG13      VAL  57  -9.440  11.907  -1.803
  390   HG21  VAL  57          HG21      VAL  57 -10.559  13.160   0.008
  391   HG22  VAL  57          HG22      VAL  57  -9.177  14.090  -0.573
  392   HG23  VAL  57          HG23      VAL  57  -9.446  13.898   1.160
  393    HA   PRO  58           HA       PRO  58  -6.495   8.115   2.430
  394    HB2  PRO  58           HB2      PRO  58  -7.948   6.290   3.816
  395    HB3  PRO  58           HB3      PRO  58  -7.268   7.742   4.578
  396    HG2  PRO  58           HG3      PRO  58 -10.056   7.169   3.745
  397    HG3  PRO  58           HG2      PRO  58  -9.455   8.102   5.125
  398    HD2  PRO  58           HD3      PRO  58 -10.407   9.196   2.734
  399    HD3  PRO  58           HD2      PRO  58  -9.400  10.051   3.922
  400    H    ILE  59           H        ILE  59  -9.763   6.697   2.061
  401    HA   ILE  59           HA       ILE  59  -8.730   5.170  -0.287
  402    HB   ILE  59           HB       ILE  59 -11.052   4.442   1.521
  403   HG12  ILE  59          HG13      ILE  59  -9.036   4.325   2.852
  404   HG13  ILE  59          HG12      ILE  59  -9.450   2.678   2.377
  405   HG21  ILE  59          HG21      ILE  59  -9.498   2.837  -0.532
  406   HG22  ILE  59          HG22      ILE  59 -11.107   3.516  -0.779
  407   HG23  ILE  59          HG23      ILE  59 -10.858   2.254   0.427
  408   HD11  ILE  59          HD11      ILE  59  -7.886   3.138   0.335
  409   HD12  ILE  59          HD12      ILE  59  -7.158   2.777   1.899
  410   HD13  ILE  59          HD13      ILE  59  -7.249   4.445   1.335
  411    H    ARG  60           H        ARG  60  -9.732   5.581  -2.216
  412    HA   ARG  60           HA       ARG  60 -12.159   7.307  -2.146
  413    HB2  ARG  60           HB3      ARG  60 -10.508   6.774  -4.605
  414    HB3  ARG  60           HB2      ARG  60 -11.508   8.177  -4.228
  415    HG2  ARG  60           HG3      ARG  60  -9.528   9.148  -3.667
  416    HG3  ARG  60           HG2      ARG  60  -9.719   8.242  -2.165
  417    HD2  ARG  60           HD3      ARG  60  -8.455   6.351  -3.176
  418    HD3  ARG  60           HD2      ARG  60  -8.204   7.323  -4.625
  419    HE   ARG  60           HE       ARG  60  -7.188   8.965  -2.714
  420   HH11  ARG  60          HH22      ARG  60  -6.872   5.585  -3.323
  421   HH12  ARG  60          HH21      ARG  60  -5.273   5.482  -2.668
  422   HH21  ARG  60          HH11      ARG  60  -5.102   8.849  -1.856
  423   HH22  ARG  60          HH12      ARG  60  -4.270   7.329  -1.837
  424    H    ILE  61           H        ILE  61 -11.420   4.117  -2.398
  425    HA   ILE  61           HA       ILE  61 -13.765   3.620  -4.179
  426    HB   ILE  61           HB       ILE  61 -12.412   1.423  -4.713
  427   HG12  ILE  61          HG13      ILE  61 -10.637   2.444  -2.976
  428   HG13  ILE  61          HG12      ILE  61 -10.141   1.446  -4.342
  429   HG21  ILE  61          HG21      ILE  61 -11.922   4.183  -5.841
  430   HG22  ILE  61          HG22      ILE  61 -12.961   2.909  -6.483
  431   HG23  ILE  61          HG23      ILE  61 -11.207   2.741  -6.564
  432   HD11  ILE  61          HD11      ILE  61 -10.377   4.450  -4.576
  433   HD12  ILE  61          HD12      ILE  61  -9.513   3.336  -5.635
  434   HD13  ILE  61          HD13      ILE  61  -8.895   3.675  -4.019
  435    HA   PRO  62           HA       PRO  62 -15.210   1.100  -0.833
  436    HB2  PRO  62           HB2      PRO  62 -16.729  -0.735  -2.168
  437    HB3  PRO  62           HB3      PRO  62 -17.220   0.957  -1.957
  438    HG2  PRO  62           HG3      PRO  62 -16.024  -0.384  -4.328
  439    HG3  PRO  62           HG2      PRO  62 -17.293   0.850  -4.246
  440    HD2  PRO  62           HD3      PRO  62 -14.683   1.418  -4.883
  441    HD3  PRO  62           HD2      PRO  62 -15.783   2.588  -4.122
  442    H    GLY  63           H        GLY  63 -12.619   0.267  -2.295
  443    HA2  GLY  63           HA3      GLY  63 -11.140  -1.497  -1.570
  444    HA3  GLY  63           HA2      GLY  63 -12.552  -2.472  -1.166
  445    H    LYS  64           H        LYS  64 -12.936  -0.927  -4.140
  446    HA   LYS  64           HA       LYS  64 -12.841  -3.438  -5.585
  447    HB2  LYS  64           HB3      LYS  64 -14.409  -1.534  -6.117
  448    HB3  LYS  64           HB2      LYS  64 -13.019  -0.633  -6.723
  449    HG2  LYS  64           HG3      LYS  64 -12.568  -2.386  -8.377
  450    HG3  LYS  64           HG2      LYS  64 -13.907  -3.345  -7.746
  451    HD2  LYS  64           HD3      LYS  64 -14.679  -2.158  -9.718
  452    HD3  LYS  64           HD2      LYS  64 -15.457  -1.454  -8.300
  453    HE2  LYS  64           HE3      LYS  64 -14.421   0.543  -8.581
  454    HE3  LYS  64           HE2      LYS  64 -12.875  -0.211  -8.968
  455    HZ1  LYS  64           HZ1      LYS  64 -14.871   0.810 -10.722
  456    HZ2  LYS  64           HZ2      LYS  64 -14.510  -0.806 -11.085
  457    HZ3  LYS  64           HZ3      LYS  64 -13.270   0.354 -11.060
  458    H    CYS  65           H        CYS  65 -11.197  -4.212  -6.852
  459    HA   CYS  65           HA       CYS  65  -8.733  -2.526  -7.053
  460    HB2  CYS  65           HB3      CYS  65  -9.014  -5.539  -6.889
  461    HB3  CYS  65           HB2      CYS  65  -7.490  -4.673  -7.087
  462    H    HIS  66           H        HIS  66  -7.454  -2.892  -9.032
  463    HA   HIS  66           HA       HIS  66  -7.435  -2.788 -11.389
  464    HB2  HIS  66           HB3      HIS  66  -7.083  -5.210 -10.887
  465    HB3  HIS  66           HB2      HIS  66  -8.825  -5.457 -11.013
  466    HD1  HIS  66           HD1      HIS  66  -6.073  -3.898 -13.169
  467    HD2  HIS  66           HD2      HIS  66  -9.567  -6.141 -13.579
  468    HE1  HIS  66           HE1      HIS  66  -6.327  -4.385 -15.643
  469    HE2  HIS  66           HE2      HIS  66  -8.450  -5.750 -15.903
  Start of MODEL   14
    1    H1   ALA   1           H1       ALA   1  -3.067   9.887   3.502
    2    H2   ALA   1           H2       ALA   1  -4.012  11.272   3.778
    3    H3   ALA   1           H3       ALA   1  -4.362  10.247   2.469
    4    HA   ALA   1           HA       ALA   1  -5.321  10.115   5.111
    5    HB1  ALA   1           HB1      ALA   1  -6.910   8.657   4.135
    6    HB2  ALA   1           HB2      ALA   1  -5.776   8.109   2.902
    7    HB3  ALA   1           HB3      ALA   1  -6.453   9.736   2.817
    8    H    ARG   2           H        ARG   2  -5.803   7.179   4.978
    9    HA   ARG   2           HA       ARG   2  -3.091   6.205   5.791
   10    HB2  ARG   2           HB3      ARG   2  -4.508   6.708   7.777
   11    HB3  ARG   2           HB2      ARG   2  -5.722   5.584   7.166
   12    HG2  ARG   2           HG3      ARG   2  -4.024   3.764   7.218
   13    HG3  ARG   2           HG2      ARG   2  -2.868   4.894   7.921
   14    HD2  ARG   2           HD3      ARG   2  -4.480   5.282   9.803
   15    HD3  ARG   2           HD2      ARG   2  -5.498   4.008   9.133
   16    HE   ARG   2           HE       ARG   2  -2.842   2.999   9.480
   17   HH11  ARG   2          HH22      ARG   2  -5.638   4.047  11.203
   18   HH12  ARG   2          HH21      ARG   2  -5.349   3.018  12.566
   19   HH21  ARG   2          HH11      ARG   2  -2.448   1.649  11.249
   20   HH22  ARG   2          HH12      ARG   2  -3.543   1.659  12.592
   21    H    ASP   3           H        ASP   3  -2.554   4.242   4.922
   22    HA   ASP   3           HA       ASP   3  -4.586   2.908   3.228
   23    HB2  ASP   3           HB3      ASP   3  -1.588   2.512   3.458
   24    HB3  ASP   3           HB2      ASP   3  -2.634   1.633   2.344
   25    H    ALA   4           H        ALA   4  -5.287   0.806   3.656
   26    HA   ALA   4           HA       ALA   4  -4.516  -0.267   6.314
   27    HB1  ALA   4           HB1      ALA   4  -6.556  -1.851   5.593
   28    HB2  ALA   4           HB2      ALA   4  -6.929  -0.460   4.577
   29    HB3  ALA   4           HB3      ALA   4  -6.818  -0.270   6.327
   30    H    TYR   5           H        TYR   5  -5.680  -2.026   3.464
   31    HA   TYR   5           HA       TYR   5  -3.342  -3.857   3.774
   32    HB2  TYR   5           HB3      TYR   5  -6.014  -4.313   2.412
   33    HB3  TYR   5           HB2      TYR   5  -4.734  -5.514   2.596
   34    HD1  TYR   5           HD1      TYR   5  -4.099  -6.336   4.861
   35    HD2  TYR   5           HD2      TYR   5  -7.453  -3.724   4.245
   36    HE1  TYR   5           HE1      TYR   5  -4.960  -6.910   7.115
   37    HE2  TYR   5           HE2      TYR   5  -8.314  -4.299   6.500
   38    HH   TYR   5           HH       TYR   5  -7.766  -5.261   8.485
   39    H    ILE   6           H        ILE   6  -3.799  -1.219   2.119
   40    HA   ILE   6           HA       ILE   6  -2.846  -2.356  -0.475
   41    HB   ILE   6           HB       ILE   6  -3.838  -0.453  -1.595
   42   HG12  ILE   6          HG13      ILE   6  -4.587   0.507   1.191
   43   HG13  ILE   6          HG12      ILE   6  -3.380   1.250   0.141
   44   HG21  ILE   6          HG21      ILE   6  -5.968  -1.206   0.380
   45   HG22  ILE   6          HG22      ILE   6  -5.267  -2.459  -0.643
   46   HG23  ILE   6          HG23      ILE   6  -6.073  -1.071  -1.375
   47   HD11  ILE   6          HD11      ILE   6  -5.284   2.556  -0.266
   48   HD12  ILE   6          HD12      ILE   6  -6.368   1.166  -0.198
   49   HD13  ILE   6          HD13      ILE   6  -5.316   1.397  -1.595
   50    H    ALA   7           H        ALA   7  -1.182  -1.097  -1.575
   51    HA   ALA   7           HA       ALA   7   0.567   0.313   0.366
   52    HB1  ALA   7           HB1      ALA   7   1.569  -1.553  -0.905
   53    HB2  ALA   7           HB2      ALA   7   2.341  -0.023  -1.318
   54    HB3  ALA   7           HB3      ALA   7   1.163  -0.740  -2.416
   55    H    LYS   8           H        LYS   8  -1.500   0.871  -2.321
   56    HA   LYS   8           HA       LYS   8  -0.643   3.716  -2.339
   57    HB2  LYS   8           HB3      LYS   8  -1.513   3.079  -4.963
   58    HB3  LYS   8           HB2      LYS   8   0.112   3.542  -4.455
   59    HG2  LYS   8           HG3      LYS   8   0.599   1.174  -3.900
   60    HG3  LYS   8           HG2      LYS   8  -1.012   0.724  -4.461
   61    HD2  LYS   8           HD3      LYS   8  -0.437   1.705  -6.699
   62    HD3  LYS   8           HD2      LYS   8   1.210   1.950  -6.117
   63    HE2  LYS   8           HE3      LYS   8   1.632  -0.356  -5.957
   64    HE3  LYS   8           HE2      LYS   8  -0.083  -0.763  -5.936
   65    HZ1  LYS   8           HZ1      LYS   8   1.625  -0.024  -8.207
   66    HZ2  LYS   8           HZ2      LYS   8  -0.031   0.337  -8.275
   67    HZ3  LYS   8           HZ3      LYS   8   0.479  -1.272  -8.080
   68    HA   PRO   9           HA       PRO   9  -4.967   4.498  -2.004
   69    HB2  PRO   9           HB2      PRO   9  -5.204   6.848  -3.407
   70    HB3  PRO   9           HB3      PRO   9  -4.521   6.734  -1.774
   71    HG2  PRO   9           HG3      PRO   9  -3.138   6.966  -4.393
   72    HG3  PRO   9           HG2      PRO   9  -2.721   7.677  -2.824
   73    HD2  PRO   9           HD3      PRO   9  -1.453   5.474  -3.851
   74    HD3  PRO   9           HD2      PRO   9  -1.613   5.781  -2.107
   75    H    HIS  10           H        HIS  10  -3.616   4.549  -5.271
   76    HA   HIS  10           HA       HIS  10  -6.317   4.204  -6.426
   77    HB2  HIS  10           HB3      HIS  10  -3.621   4.385  -7.801
   78    HB3  HIS  10           HB2      HIS  10  -5.197   4.432  -8.592
   79    HD1  HIS  10           HD1      HIS  10  -6.834   6.427  -7.385
   80    HD2  HIS  10           HD2      HIS  10  -2.694   6.940  -7.348
   81    HE1  HIS  10           HE1      HIS  10  -6.420   8.897  -6.994
   82    HE2  HIS  10           HE2      HIS  10  -3.904   9.219  -6.969
   83    H    ASN  11           H        ASN  11  -3.496   2.318  -5.612
   84    HA   ASN  11           HA       ASN  11  -4.922  -0.083  -6.640
   85    HB2  ASN  11           HB3      ASN  11  -1.956   0.029  -6.991
   86    HB3  ASN  11           HB2      ASN  11  -3.166  -0.848  -7.929
   87   HD21  ASN  11          HD22      ASN  11  -1.997   2.494  -7.287
   88   HD22  ASN  11          HD21      ASN  11  -2.447   3.104  -8.805
   89    H    CYS  12           H        CYS  12  -3.470  -2.098  -5.883
   90    HA   CYS  12           HA       CYS  12  -2.431  -1.598  -3.138
   91    HB2  CYS  12           HB3      CYS  12  -3.748  -3.541  -2.309
   92    HB3  CYS  12           HB2      CYS  12  -4.784  -2.226  -2.865
   93    H    VAL  13           H        VAL  13  -1.679  -3.995  -2.327
   94    HA   VAL  13           HA       VAL  13   0.022  -5.032  -4.554
   95    HB   VAL  13           HB       VAL  13   0.414  -5.313  -1.560
   96   HG11  VAL  13          HG11      VAL  13   2.832  -5.746  -2.643
   97   HG12  VAL  13          HG12      VAL  13   1.835  -6.301  -3.988
   98   HG13  VAL  13          HG13      VAL  13   1.671  -7.050  -2.400
   99   HG21  VAL  13          HG21      VAL  13   2.111  -3.599  -1.776
  100   HG22  VAL  13          HG22      VAL  13   0.613  -2.962  -2.454
  101   HG23  VAL  13          HG23      VAL  13   1.890  -3.537  -3.525
  102    H    TYR  14           H        TYR  14  -0.262  -7.115  -5.201
  103    HA   TYR  14           HA       TYR  14  -2.466  -8.668  -4.119
  104    HB2  TYR  14           HB3      TYR  14  -1.991 -10.236  -5.849
  105    HB3  TYR  14           HB2      TYR  14  -1.630  -8.657  -6.548
  106    HD1  TYR  14           HD1      TYR  14   0.731  -7.878  -6.736
  107    HD2  TYR  14           HD2      TYR  14  -0.259 -11.852  -5.443
  108    HE1  TYR  14           HE1      TYR  14   3.065  -8.599  -7.166
  109    HE2  TYR  14           HE2      TYR  14   2.074 -12.575  -5.874
  110    HH   TYR  14           HH       TYR  14   4.277 -11.636  -6.086
  111    H    GLU  15           H        GLU  15   1.045  -8.718  -3.830
  112    HA   GLU  15           HA       GLU  15   0.792 -10.457  -1.464
  113    HB2  GLU  15           HB3      GLU  15   1.106 -11.965  -3.492
  114    HB3  GLU  15           HB2      GLU  15   2.686 -11.209  -3.704
  115    HG2  GLU  15           HG3      GLU  15   3.021 -13.223  -2.420
  116    HG3  GLU  15           HG2      GLU  15   3.220 -11.856  -1.323
  117    H    CYS  16           H        CYS  16   1.558  -8.579  -0.345
  118    HA   CYS  16           HA       CYS  16   3.846  -7.073  -1.085
  119    HB2  CYS  16           HB3      CYS  16   2.923  -5.951   0.657
  120    HB3  CYS  16           HB2      CYS  16   2.203  -7.415   1.326
  121    H    PHE  17           H        PHE  17   5.779  -8.016  -1.507
  122    HA   PHE  17           HA       PHE  17   6.670 -10.496  -0.393
  123    HB2  PHE  17           HB3      PHE  17   7.784  -9.946  -2.359
  124    HB3  PHE  17           HB2      PHE  17   7.956  -8.252  -1.909
  125    HD1  PHE  17           HD2      PHE  17   9.704  -7.535  -0.328
  126    HD2  PHE  17           HD1      PHE  17   9.354 -11.628  -1.582
  127    HE1  PHE  17           HE2      PHE  17  11.975  -7.996   0.548
  128    HE2  PHE  17           HE1      PHE  17  11.628 -12.091  -0.705
  129    HZ   PHE  17           HZ       PHE  17  12.939 -10.275   0.359
  130    H    ASP  18           H        ASP  18   8.664 -10.678   1.047
  131    HA   ASP  18           HA       ASP  18   8.273  -9.645   3.577
  132    HB2  ASP  18           HB3      ASP  18   9.988 -11.368   2.984
  133    HB3  ASP  18           HB2      ASP  18  11.006 -10.080   2.338
  134    H    ALA  19           H        ALA  19   7.854  -7.520   3.956
  135    HA   ALA  19           HA       ALA  19   9.133  -5.366   2.500
  136    HB1  ALA  19           HB1      ALA  19   6.870  -5.139   3.453
  137    HB2  ALA  19           HB2      ALA  19   7.951  -3.901   4.090
  138    HB3  ALA  19           HB3      ALA  19   7.535  -5.302   5.077
  139    H    PHE  20           H        PHE  20  10.261  -7.367   4.931
  140    HA   PHE  20           HA       PHE  20  11.571  -5.697   6.758
  141    HB2  PHE  20           HB3      PHE  20  11.597  -8.203   6.808
  142    HB3  PHE  20           HB2      PHE  20  12.763  -8.180   5.484
  143    HD1  PHE  20           HD1      PHE  20  12.197  -7.246   9.026
  144    HD2  PHE  20           HD2      PHE  20  15.064  -7.575   5.845
  145    HE1  PHE  20           HE1      PHE  20  14.038  -6.907  10.652
  146    HE2  PHE  20           HE2      PHE  20  16.907  -7.237   7.471
  147    HZ   PHE  20           HZ       PHE  20  16.394  -6.903   9.873
  148    H    SER  21           H        SER  21  12.643  -6.653   3.487
  149    HA   SER  21           HA       SER  21  15.143  -5.272   3.577
  150    HB2  SER  21           HB3      SER  21  13.392  -5.759   1.153
  151    HB3  SER  21           HB2      SER  21  15.124  -5.435   1.146
  152    HG   SER  21           HG       SER  21  15.479  -7.386   2.125
  153    H    SER  22           H        SER  22  11.982  -4.260   2.265
  154    HA   SER  22           HA       SER  22  11.662  -1.740   3.171
  155    HB2  SER  22           HB3      SER  22  13.734  -0.792   2.705
  156    HB3  SER  22           HB2      SER  22  13.966  -1.762   1.251
  157    HG   SER  22           HG       SER  22  12.815   0.686   1.568
  158    H    TYR  23           H        TYR  23  10.856  -4.067   1.148
  159    HA   TYR  23           HA       TYR  23   9.954  -2.867  -1.249
  160    HB2  TYR  23           HB3      TYR  23   9.928  -5.312  -0.816
  161    HB3  TYR  23           HB2      TYR  23   8.583  -5.079   0.302
  162    HD1  TYR  23           HD1      TYR  23   9.637  -4.942  -3.235
  163    HD2  TYR  23           HD2      TYR  23   6.359  -4.519  -0.490
  164    HE1  TYR  23           HE1      TYR  23   8.041  -4.979  -5.134
  165    HE2  TYR  23           HE2      TYR  23   4.765  -4.556  -2.388
  166    HH   TYR  23           HH       TYR  23   5.117  -3.890  -5.097
  167    H    CYS  24           H        CYS  24   7.711  -3.729   1.399
  168    HA   CYS  24           HA       CYS  24   5.677  -1.936   0.522
  169    HB2  CYS  24           HB3      CYS  24   5.457  -3.881   2.179
  170    HB3  CYS  24           HB2      CYS  24   6.082  -2.773   3.399
  171    H    ASN  25           H        ASN  25   8.056  -1.573   3.158
  172    HA   ASN  25           HA       ASN  25   7.356   1.080   3.884
  173    HB2  ASN  25           HB3      ASN  25  10.079  -0.264   3.935
  174    HB3  ASN  25           HB2      ASN  25   9.673   1.230   4.780
  175   HD21  ASN  25          HD22      ASN  25   6.924  -0.714   4.766
  176   HD22  ASN  25          HD21      ASN  25   7.115  -1.448   6.284
  177    H    GLY  26           H        GLY  26   9.427  -0.180   1.320
  178    HA2  GLY  26           HA3      GLY  26  10.613   2.268   0.493
  179    HA3  GLY  26           HA2      GLY  26  10.333   0.883  -0.565
  180    H    VAL  27           H        VAL  27   7.493   0.773  -0.351
  181    HA   VAL  27           HA       VAL  27   6.736   2.674  -2.342
  182    HB   VAL  27           HB       VAL  27   5.061   1.023  -0.431
  183   HG11  VAL  27          HG11      VAL  27   3.517   1.617  -2.661
  184   HG12  VAL  27          HG12      VAL  27   4.330   3.143  -2.316
  185   HG13  VAL  27          HG13      VAL  27   3.353   2.364  -1.072
  186   HG21  VAL  27          HG21      VAL  27   6.334  -0.342  -1.971
  187   HG22  VAL  27          HG22      VAL  27   5.903   0.699  -3.327
  188   HG23  VAL  27          HG23      VAL  27   4.670  -0.297  -2.552
  189    H    CYS  28           H        CYS  28   6.089   2.569   1.160
  190    HA   CYS  28           HA       CYS  28   4.754   5.139   1.199
  191    HB2  CYS  28           HB3      CYS  28   6.046   3.496   3.398
  192    HB3  CYS  28           HB2      CYS  28   5.131   4.975   3.687
  193    H    THR  29           H        THR  29   8.063   4.122   1.213
  194    HA   THR  29           HA       THR  29   9.272   6.381   2.474
  195    HB   THR  29           HB       THR  29  10.415   4.652   0.267
  196    HG1  THR  29           HG1      THR  29  11.297   3.548   2.153
  197   HG21  THR  29          HG21      THR  29  12.216   5.978   0.495
  198   HG22  THR  29          HG22      THR  29  12.356   5.421   2.163
  199   HG23  THR  29          HG23      THR  29  11.435   6.879   1.794
  200    H    LYS  30           H        LYS  30   8.119   5.903  -0.825
  201    HA   LYS  30           HA       LYS  30   9.488   7.960  -2.155
  202    HB2  LYS  30           HB3      LYS  30   6.706   6.851  -2.466
  203    HB3  LYS  30           HB2      LYS  30   7.258   8.186  -3.477
  204    HG2  LYS  30           HG3      LYS  30   7.718   6.124  -4.653
  205    HG3  LYS  30           HG2      LYS  30   9.256   6.789  -4.103
  206    HD2  LYS  30           HD3      LYS  30   9.370   5.252  -2.273
  207    HD3  LYS  30           HD2      LYS  30   7.700   4.739  -2.514
  208    HE2  LYS  30           HE3      LYS  30   8.278   3.264  -4.128
  209    HE3  LYS  30           HE2      LYS  30   9.338   4.431  -4.919
  210    HZ1  LYS  30           HZ1      LYS  30  11.091   3.468  -4.003
  211    HZ2  LYS  30           HZ2      LYS  30  10.081   2.264  -3.363
  212    HZ3  LYS  30           HZ3      LYS  30  10.443   3.645  -2.442
  213    H    ASN  31           H        ASN  31   6.727   8.215   0.040
  214    HA   ASN  31           HA       ASN  31   6.022  10.914  -0.459
  215    HB2  ASN  31           HB3      ASN  31   4.877   9.222   1.104
  216    HB3  ASN  31           HB2      ASN  31   6.087   9.695   2.299
  217   HD21  ASN  31          HD22      ASN  31   5.418  11.376   3.627
  218   HD22  ASN  31          HD21      ASN  31   4.302  12.581   3.194
  219    H    GLY  32           H        GLY  32   8.664   9.524   1.415
  220    HA2  GLY  32           HA3      GLY  32  10.747  10.735   1.747
  221    HA3  GLY  32           HA2      GLY  32   9.848  12.248   1.623
  222    H    ALA  33           H        ALA  33   8.002  10.191   3.432
  223    HA   ALA  33           HA       ALA  33   9.307  10.301   5.998
  224    HB1  ALA  33           HB1      ALA  33   7.260  11.975   6.714
  225    HB2  ALA  33           HB2      ALA  33   7.723  12.637   5.146
  226    HB3  ALA  33           HB3      ALA  33   8.921  12.498   6.434
  227    H    LYS  34           H        LYS  34   6.445   9.953   4.034
  228    HA   LYS  34           HA       LYS  34   4.589   8.986   5.926
  229    HB2  LYS  34           HB3      LYS  34   4.161   9.395   3.472
  230    HB3  LYS  34           HB2      LYS  34   5.011   7.889   3.130
  231    HG2  LYS  34           HG3      LYS  34   3.387   6.653   4.500
  232    HG3  LYS  34           HG2      LYS  34   2.538   8.155   4.856
  233    HD2  LYS  34           HD3      LYS  34   2.337   8.463   2.318
  234    HD3  LYS  34           HD2      LYS  34   2.836   6.779   2.186
  235    HE2  LYS  34           HE3      LYS  34   0.624   6.307   2.394
  236    HE3  LYS  34           HE2      LYS  34   0.862   6.653   4.109
  237    HZ1  LYS  34           HZ1      LYS  34  -0.598   8.123   2.155
  238    HZ2  LYS  34           HZ2      LYS  34   0.561   9.103   2.914
  239    HZ3  LYS  34           HZ3      LYS  34  -0.598   8.283   3.847
  240    H    SER  35           H        SER  35   4.527   7.120   7.130
  241    HA   SER  35           HA       SER  35   6.627   5.082   6.539
  242    HB2  SER  35           HB3      SER  35   6.594   4.541   8.918
  243    HB3  SER  35           HB2      SER  35   6.866   6.269   8.716
  244    HG   SER  35           HG       SER  35   5.144   5.402  10.255
  245    H    GLY  36           H        GLY  36   5.975   2.939   6.328
  246    HA2  GLY  36           HA3      GLY  36   3.167   2.274   6.988
  247    HA3  GLY  36           HA2      GLY  36   3.707   2.017   5.330
  248    H    TYR  37           H        TYR  37   2.770  -0.037   7.063
  249    HA   TYR  37           HA       TYR  37   5.256  -1.685   7.294
  250    HB2  TYR  37           HB3      TYR  37   2.847  -2.023   9.090
  251    HB3  TYR  37           HB2      TYR  37   4.468  -2.682   9.307
  252    HD1  TYR  37           HD1      TYR  37   6.406  -0.905   9.487
  253    HD2  TYR  37           HD2      TYR  37   2.253  -0.062  10.194
  254    HE1  TYR  37           HE1      TYR  37   7.038   1.103  10.800
  255    HE2  TYR  37           HE2      TYR  37   2.885   1.947  11.507
  256    HH   TYR  37           HH       TYR  37   5.940   2.489  12.677
  257    H    CYS  38           H        CYS  38   4.867  -3.989   6.853
  258    HA   CYS  38           HA       CYS  38   2.535  -4.363   5.060
  259    HB2  CYS  38           HB3      CYS  38   4.695  -4.901   4.081
  260    HB3  CYS  38           HB2      CYS  38   5.061  -5.993   5.417
  261    H    GLN  39           H        GLN  39   0.819  -5.445   5.825
  262    HA   GLN  39           HA       GLN  39   1.225  -7.245   8.181
  263    HB2  GLN  39           HB3      GLN  39  -1.240  -5.686   7.362
  264    HB3  GLN  39           HB2      GLN  39  -1.104  -6.728   8.781
  265    HG2  GLN  39           HG3      GLN  39   0.779  -5.300   9.592
  266    HG3  GLN  39           HG2      GLN  39   0.499  -4.215   8.228
  267   HE21  GLN  39          HE22      GLN  39  -2.497  -5.423   9.015
  268   HE22  GLN  39          HE21      GLN  39  -3.015  -4.206  10.081
  269    H    ILE  40           H        ILE  40  -0.779  -8.838   8.286
  270    HA   ILE  40           HA       ILE  40  -0.744 -10.278   5.704
  271    HB   ILE  40           HB       ILE  40  -1.883 -11.125   8.366
  272   HG12  ILE  40          HG13      ILE  40   0.787 -11.817   7.098
  273   HG13  ILE  40          HG12      ILE  40   0.580 -10.681   8.432
  274   HG21  ILE  40          HG21      ILE  40  -1.064 -13.310   6.786
  275   HG22  ILE  40          HG22      ILE  40  -1.951 -12.229   5.709
  276   HG23  ILE  40          HG23      ILE  40  -2.716 -12.833   7.179
  277   HD11  ILE  40          HD11      ILE  40   1.002 -12.578   9.664
  278   HD12  ILE  40          HD12      ILE  40   0.360 -13.655   8.423
  279   HD13  ILE  40          HD13      ILE  40  -0.741 -12.768   9.478
  280    H    LEU  41           H        LEU  41  -2.482 -10.447   4.422
  281    HA   LEU  41           HA       LEU  41  -4.792  -8.796   4.777
  282    HB2  LEU  41           HB3      LEU  41  -3.827  -9.692   2.605
  283    HB3  LEU  41           HB2      LEU  41  -4.562 -11.240   3.008
  284    HG   LEU  41           HG       LEU  41  -6.776 -10.052   3.225
  285   HD11  LEU  41          HD11      LEU  41  -6.685  -7.799   3.336
  286   HD12  LEU  41          HD12      LEU  41  -6.361  -7.818   1.603
  287   HD13  LEU  41          HD13      LEU  41  -5.023  -7.770   2.749
  288   HD21  LEU  41          HD21      LEU  41  -5.212 -10.441   0.734
  289   HD22  LEU  41          HD22      LEU  41  -6.678  -9.473   0.571
  290   HD23  LEU  41          HD23      LEU  41  -6.772 -11.119   1.201
  291    H    GLY  42           H        GLY  42  -4.019 -12.073   5.678
  292    HA2  GLY  42           HA3      GLY  42  -5.272 -13.154   7.501
  293    HA3  GLY  42           HA2      GLY  42  -6.729 -12.346   6.906
  294    H    THR  43           H        THR  43  -5.254 -13.051   4.181
  295    HA   THR  43           HA       THR  43  -6.278 -15.842   3.986
  296    HB   THR  43           HB       THR  43  -7.300 -15.377   1.891
  297    HG1  THR  43           HG1      THR  43  -6.116 -12.807   1.981
  298   HG21  THR  43          HG21      THR  43  -7.737 -12.946   3.648
  299   HG22  THR  43          HG22      THR  43  -8.579 -14.488   3.801
  300   HG23  THR  43          HG23      THR  43  -8.817 -13.492   2.365
  301    H    TYR  44           H        TYR  44  -5.308 -16.853   1.862
  302    HA   TYR  44           HA       TYR  44  -2.543 -17.058   2.057
  303    HB2  TYR  44           HB3      TYR  44  -2.559 -18.104  -0.074
  304    HB3  TYR  44           HB2      TYR  44  -4.168 -18.409   0.581
  305    HD1  TYR  44           HD1      TYR  44  -6.106 -16.998  -0.157
  306    HD2  TYR  44           HD2      TYR  44  -2.241 -16.729  -2.011
  307    HE1  TYR  44           HE1      TYR  44  -7.120 -15.841  -2.101
  308    HE2  TYR  44           HE2      TYR  44  -3.254 -15.569  -3.955
  309    HH   TYR  44           HH       TYR  44  -6.617 -14.548  -3.936
  310    H    GLY  45           H        GLY  45  -4.307 -14.342   0.997
  311    HA2  GLY  45           HA3      GLY  45  -2.140 -13.271  -0.690
  312    HA3  GLY  45           HA2      GLY  45  -3.667 -12.466  -0.334
  313    H    ASN  46           H        ASN  46  -1.808 -10.725  -0.102
  314    HA   ASN  46           HA       ASN  46  -1.299 -10.449   2.810
  315    HB2  ASN  46           HB3      ASN  46   0.762 -11.305   1.490
  316    HB3  ASN  46           HB2      ASN  46   0.808  -9.689   0.786
  317   HD21  ASN  46          HD22      ASN  46   2.848  -9.211   1.930
  318   HD22  ASN  46          HD21      ASN  46   2.850  -8.904   3.599
  319    H    GLY  47           H        GLY  47  -0.778  -8.085   3.341
  320    HA2  GLY  47           HA3      GLY  47  -1.775  -6.218   1.240
  321    HA3  GLY  47           HA2      GLY  47  -2.569  -6.221   2.813
  322    H    CYS  48           H        CYS  48  -1.217  -3.969   1.672
  323    HA   CYS  48           HA       CYS  48   1.188  -3.724   3.402
  324    HB2  CYS  48           HB3      CYS  48   0.476  -2.694   0.750
  325    HB3  CYS  48           HB2      CYS  48   1.130  -1.459   1.827
  326    H    TRP  49           H        TRP  49   1.386  -1.793   4.717
  327    HA   TRP  49           HA       TRP  49  -1.205  -0.386   5.202
  328    HB2  TRP  49           HB3      TRP  49  -0.260  -2.157   6.946
  329    HB3  TRP  49           HB2      TRP  49   0.767  -0.803   7.417
  330    HD1  TRP  49           HD1      TRP  49  -0.491   1.452   8.234
  331    HE1  TRP  49           HE1      TRP  49  -2.779   1.764   9.382
  332    HE3  TRP  49           HE3      TRP  49  -2.633  -3.055   7.160
  333    HZ2  TRP  49           HZ2      TRP  49  -5.199   0.292   9.790
  334    HZ3  TRP  49           HZ3      TRP  49  -4.927  -3.575   7.939
  335    HH2  TRP  49           HH2      TRP  49  -6.211  -1.910   9.253
  336    H    CYS  50           H        CYS  50  -1.021   1.830   5.084
  337    HA   CYS  50           HA       CYS  50   1.688   3.017   5.481
  338    HB2  CYS  50           HB3      CYS  50   0.760   2.740   2.999
  339    HB3  CYS  50           HB2      CYS  50  -0.092   4.225   3.422
  340    H    ILE  51           H        ILE  51   1.673   4.745   6.833
  341    HA   ILE  51           HA       ILE  51  -0.962   6.019   7.423
  342    HB   ILE  51           HB       ILE  51   1.319   5.496   9.345
  343   HG12  ILE  51          HG13      ILE  51  -1.296   4.305   9.901
  344   HG13  ILE  51          HG12      ILE  51  -0.604   3.725   8.386
  345   HG21  ILE  51          HG21      ILE  51   0.162   7.506   9.988
  346   HG22  ILE  51          HG22      ILE  51  -0.445   6.215  11.024
  347   HG23  ILE  51          HG23      ILE  51  -1.409   6.775   9.658
  348   HD11  ILE  51          HD11      ILE  51   1.045   3.851  10.910
  349   HD12  ILE  51          HD12      ILE  51   1.339   2.902   9.453
  350   HD13  ILE  51          HD13      ILE  51   0.030   2.455  10.547
  351    H    ALA  52           H        ALA  52  -1.007   8.245   7.534
  352    HA   ALA  52           HA       ALA  52   1.455   9.816   7.701
  353    HB1  ALA  52           HB1      ALA  52   0.482   9.058   5.136
  354    HB2  ALA  52           HB2      ALA  52   1.785  10.190   5.507
  355    HB3  ALA  52           HB3      ALA  52   0.129  10.774   5.344
  356    H    LEU  53           H        LEU  53  -2.029   9.597   7.340
  357    HA   LEU  53           HA       LEU  53  -2.248  12.288   8.621
  358    HB2  LEU  53           HB3      LEU  53  -3.388  11.309   6.115
  359    HB3  LEU  53           HB2      LEU  53  -4.623  11.924   7.210
  360    HG   LEU  53           HG       LEU  53  -3.245  14.006   7.497
  361   HD11  LEU  53          HD11      LEU  53  -1.666  13.956   5.191
  362   HD12  LEU  53          HD12      LEU  53  -1.384  12.389   5.948
  363   HD13  LEU  53          HD13      LEU  53  -1.087  13.872   6.854
  364   HD21  LEU  53          HD21      LEU  53  -3.813  13.492   4.574
  365   HD22  LEU  53          HD22      LEU  53  -3.995  14.999   5.471
  366   HD23  LEU  53          HD23      LEU  53  -5.111  13.663   5.754
  367    HA   PRO  54           HA       PRO  54  -4.859  10.675  11.802
  368    HB2  PRO  54           HB2      PRO  54  -7.166  12.238  10.733
  369    HB3  PRO  54           HB3      PRO  54  -6.490  12.201  12.373
  370    HG2  PRO  54           HG3      PRO  54  -6.060  14.248  10.715
  371    HG3  PRO  54           HG2      PRO  54  -4.838  13.699  11.873
  372    HD2  PRO  54           HD3      PRO  54  -4.903  13.374   8.920
  373    HD3  PRO  54           HD2      PRO  54  -3.512  13.447  10.023
  374    H    ASP  55           H        ASP  55  -5.458  10.035   8.585
  375    HA   ASP  55           HA       ASP  55  -6.380   8.023   7.702
  376    HB2  ASP  55           HB3      ASP  55  -6.540   7.299  10.236
  377    HB3  ASP  55           HB2      ASP  55  -8.241   7.727  10.037
  378    H    ASN  56           H        ASN  56  -7.195  10.499   6.944
  379    HA   ASN  56           HA       ASN  56 -10.171  10.427   6.997
  380    HB2  ASN  56           HB3      ASN  56  -8.247  12.615   6.154
  381    HB3  ASN  56           HB2      ASN  56 -10.005  12.744   6.087
  382   HD21  ASN  56          HD22      ASN  56  -8.444  14.500   7.735
  383   HD22  ASN  56          HD21      ASN  56  -8.793  14.155   9.359
  384    H    VAL  57           H        VAL  57 -11.261   9.866   5.141
  385    HA   VAL  57           HA       VAL  57 -11.553   9.070   2.946
  386    HB   VAL  57           HB       VAL  57  -9.482  11.234   2.466
  387   HG11  VAL  57          HG11      VAL  57 -10.784   9.296   0.680
  388   HG12  VAL  57          HG12      VAL  57  -9.373  10.315   0.395
  389   HG13  VAL  57          HG13      VAL  57 -10.995  10.971   0.173
  390   HG21  VAL  57          HG21      VAL  57 -12.440  11.359   1.895
  391   HG22  VAL  57          HG22      VAL  57 -11.302  12.689   2.106
  392   HG23  VAL  57          HG23      VAL  57 -11.818  11.740   3.500
  393    HA   PRO  58           HA       PRO  58  -7.578   6.627   3.314
  394    HB2  PRO  58           HB2      PRO  58  -8.696   4.241   3.987
  395    HB3  PRO  58           HB3      PRO  58  -8.289   5.481   5.188
  396    HG2  PRO  58           HG3      PRO  58 -10.928   4.784   4.006
  397    HG3  PRO  58           HG2      PRO  58 -10.519   5.254   5.666
  398    HD2  PRO  58           HD3      PRO  58 -11.621   6.972   3.809
  399    HD3  PRO  58           HD2      PRO  58 -10.648   7.504   5.197
  400    H    ILE  59           H        ILE  59 -10.503   4.826   2.296
  401    HA   ILE  59           HA       ILE  59  -9.129   4.293  -0.304
  402    HB   ILE  59           HB       ILE  59 -11.208   2.595   1.105
  403   HG12  ILE  59          HG13      ILE  59  -8.229   2.123   0.757
  404   HG13  ILE  59          HG12      ILE  59  -8.985   2.660   2.258
  405   HG21  ILE  59          HG21      ILE  59 -10.212   2.668  -1.594
  406   HG22  ILE  59          HG22      ILE  59 -11.416   1.586  -0.895
  407   HG23  ILE  59          HG23      ILE  59  -9.705   1.163  -0.828
  408   HD11  ILE  59          HD11      ILE  59  -9.221   0.004   0.869
  409   HD12  ILE  59          HD12      ILE  59 -10.519   0.561   1.926
  410   HD13  ILE  59          HD13      ILE  59  -8.891   0.343   2.568
  411    H    ARG  60           H        ARG  60 -10.117   5.193  -2.034
  412    HA   ARG  60           HA       ARG  60 -13.024   5.849  -1.815
  413    HB2  ARG  60           HB3      ARG  60 -11.189   7.331  -3.671
  414    HB3  ARG  60           HB2      ARG  60 -12.680   7.881  -2.908
  415    HG2  ARG  60           HG3      ARG  60 -11.206   8.994  -1.548
  416    HG3  ARG  60           HG2      ARG  60 -11.200   7.448  -0.697
  417    HD2  ARG  60           HD3      ARG  60  -9.239   6.741  -2.068
  418    HD3  ARG  60           HD2      ARG  60  -9.216   8.339  -2.811
  419    HE   ARG  60           HE       ARG  60  -9.108   8.436   0.102
  420   HH11  ARG  60          HH22      ARG  60  -7.377   8.083  -2.858
  421   HH12  ARG  60          HH21      ARG  60  -5.878   8.656  -2.205
  422   HH21  ARG  60          HH11      ARG  60  -7.161   9.187   0.973
  423   HH22  ARG  60          HH12      ARG  60  -5.756   9.281  -0.036
  424    H    ILE  61           H        ILE  61 -10.817   3.865  -3.245
  425    HA   ILE  61           HA       ILE  61 -11.657   3.896  -5.994
  426    HB   ILE  61           HB       ILE  61 -10.335   1.939  -6.229
  427   HG12  ILE  61          HG13      ILE  61 -11.256   1.441  -3.434
  428   HG13  ILE  61          HG12      ILE  61 -11.103   0.313  -4.783
  429   HG21  ILE  61          HG21      ILE  61  -8.299   2.527  -5.161
  430   HG22  ILE  61          HG22      ILE  61  -9.136   3.207  -3.765
  431   HG23  ILE  61          HG23      ILE  61  -9.179   4.047  -5.315
  432   HD11  ILE  61          HD11      ILE  61  -8.561   0.630  -4.533
  433   HD12  ILE  61          HD12      ILE  61  -9.375  -0.313  -3.285
  434   HD13  ILE  61          HD13      ILE  61  -8.927   1.364  -2.972
  435    HA   PRO  62           HA       PRO  62 -15.607   1.908  -5.786
  436    HB2  PRO  62           HB2      PRO  62 -15.393   0.221  -8.005
  437    HB3  PRO  62           HB3      PRO  62 -15.910   1.917  -8.043
  438    HG2  PRO  62           HG3      PRO  62 -13.275   0.727  -8.688
  439    HG3  PRO  62           HG2      PRO  62 -14.090   2.131  -9.394
  440    HD2  PRO  62           HD3      PRO  62 -12.023   2.385  -7.655
  441    HD3  PRO  62           HD2      PRO  62 -13.341   3.573  -7.739
  442    H    GLY  63           H        GLY  63 -12.833   0.378  -4.996
  443    HA2  GLY  63           HA3      GLY  63 -12.821  -1.498  -3.456
  444    HA3  GLY  63           HA2      GLY  63 -14.295  -2.087  -4.223
  445    H    LYS  64           H        LYS  64 -12.133  -1.008  -6.564
  446    HA   LYS  64           HA       LYS  64 -11.772  -3.551  -7.758
  447    HB2  LYS  64           HB3      LYS  64 -11.406  -1.314  -8.869
  448    HB3  LYS  64           HB2      LYS  64  -9.875  -1.200  -8.000
  449    HG2  LYS  64           HG3      LYS  64  -9.318  -3.496  -9.011
  450    HG3  LYS  64           HG2      LYS  64 -10.680  -3.222 -10.097
  451    HD2  LYS  64           HD3      LYS  64  -8.363  -1.295  -9.759
  452    HD3  LYS  64           HD2      LYS  64  -8.477  -2.486 -11.054
  453    HE2  LYS  64           HE3      LYS  64  -9.617  -0.928 -12.224
  454    HE3  LYS  64           HE2      LYS  64 -10.952  -1.198 -11.105
  455    HZ1  LYS  64           HZ1      LYS  64 -10.338   1.138 -11.215
  456    HZ2  LYS  64           HZ2      LYS  64  -8.756   0.765 -10.730
  457    HZ3  LYS  64           HZ3      LYS  64 -10.052   0.510  -9.662
  458    H    CYS  65           H        CYS  65  -9.778  -1.792  -5.431
  459    HA   CYS  65           HA       CYS  65  -7.955  -4.152  -5.279
  460    HB2  CYS  65           HB3      CYS  65  -7.520  -1.294  -5.199
  461    HB3  CYS  65           HB2      CYS  65  -6.907  -2.050  -3.727
  462    H    HIS  66           H        HIS  66  -7.307  -4.839  -3.093
  463    HA   HIS  66           HA       HIS  66  -8.759  -3.868  -0.772
  464    HB2  HIS  66           HB3      HIS  66 -10.534  -5.190  -1.924
  465    HB3  HIS  66           HB2      HIS  66  -9.490  -6.610  -1.847
  466    HD1  HIS  66           HD1      HIS  66 -10.831  -4.011   0.622
  467    HD2  HIS  66           HD2      HIS  66  -9.963  -8.087   0.431
  468    HE1  HIS  66           HE1      HIS  66 -11.493  -4.992   2.863
  469    HE2  HIS  66           HE2      HIS  66 -10.969  -7.471   2.758
  Start of MODEL   15
    1    H1   ALA   1           H1       ALA   1  -8.113   8.590   8.293
    2    H2   ALA   1           H2       ALA   1  -7.326   7.478   7.277
    3    H3   ALA   1           H3       ALA   1  -7.960   8.919   6.636
    4    HA   ALA   1           HA       ALA   1  -6.148  10.080   7.134
    5    HB1  ALA   1           HB1      ALA   1  -6.859   8.998   9.752
    6    HB2  ALA   1           HB2      ALA   1  -6.199  10.580   9.337
    7    HB3  ALA   1           HB3      ALA   1  -5.117   9.207   9.571
    8    H    ARG   2           H        ARG   2  -6.099   6.623   7.764
    9    HA   ARG   2           HA       ARG   2  -3.422   6.515   6.455
   10    HB2  ARG   2           HB3      ARG   2  -2.639   4.864   8.056
   11    HB3  ARG   2           HB2      ARG   2  -3.169   6.292   8.943
   12    HG2  ARG   2           HG3      ARG   2  -5.399   5.179   9.270
   13    HG3  ARG   2           HG2      ARG   2  -4.720   3.720   8.548
   14    HD2  ARG   2           HD3      ARG   2  -2.935   3.735  10.291
   15    HD3  ARG   2           HD2      ARG   2  -3.732   5.113  11.051
   16    HE   ARG   2           HE       ARG   2  -4.629   2.333  11.166
   17   HH11  ARG   2          HH22      ARG   2  -5.462   5.675  11.326
   18   HH12  ARG   2          HH21      ARG   2  -6.876   5.413  12.290
   19   HH21  ARG   2          HH11      ARG   2  -6.472   1.972  12.424
   20   HH22  ARG   2          HH12      ARG   2  -7.448   3.317  12.912
   21    H    ASP   3           H        ASP   3  -2.989   4.375   5.482
   22    HA   ASP   3           HA       ASP   3  -5.529   3.076   4.640
   23    HB2  ASP   3           HB3      ASP   3  -2.750   2.987   3.439
   24    HB3  ASP   3           HB2      ASP   3  -4.142   2.112   2.805
   25    H    ALA   4           H        ALA   4  -5.723   0.770   4.761
   26    HA   ALA   4           HA       ALA   4  -3.975  -0.413   6.839
   27    HB1  ALA   4           HB1      ALA   4  -6.171  -0.760   7.507
   28    HB2  ALA   4           HB2      ALA   4  -5.844  -2.261   6.643
   29    HB3  ALA   4           HB3      ALA   4  -6.745  -0.968   5.853
   30    H    TYR   5           H        TYR   5  -5.612  -1.719   3.937
   31    HA   TYR   5           HA       TYR   5  -3.279  -3.533   3.569
   32    HB2  TYR   5           HB3      TYR   5  -5.872  -3.607   2.022
   33    HB3  TYR   5           HB2      TYR   5  -4.718  -4.915   2.285
   34    HD1  TYR   5           HD2      TYR   5  -4.532  -6.003   4.509
   35    HD2  TYR   5           HD1      TYR   5  -7.498  -3.009   3.682
   36    HE1  TYR   5           HE2      TYR   5  -5.778  -6.678   6.544
   37    HE2  TYR   5           HE1      TYR   5  -8.748  -3.685   5.718
   38    HH   TYR   5           HH       TYR   5  -7.438  -6.095   7.960
   39    H    ILE   6           H        ILE   6  -4.247  -0.551   2.497
   40    HA   ILE   6           HA       ILE   6  -3.122  -0.989  -0.232
   41    HB   ILE   6           HB       ILE   6  -4.806   1.323   0.763
   42   HG12  ILE   6          HG13      ILE   6  -5.596  -1.099  -0.887
   43   HG13  ILE   6          HG12      ILE   6  -6.042  -0.831   0.799
   44   HG21  ILE   6          HG21      ILE   6  -4.675   0.609  -2.098
   45   HG22  ILE   6          HG22      ILE   6  -3.164   1.214  -1.423
   46   HG23  ILE   6          HG23      ILE   6  -4.625   2.196  -1.331
   47   HD11  ILE   6          HD11      ILE   6  -6.781   1.542  -0.402
   48   HD12  ILE   6          HD12      ILE   6  -7.875   0.210  -0.028
   49   HD13  ILE   6          HD13      ILE   6  -7.170   0.346  -1.639
   50    H    ALA   7           H        ALA   7  -1.244   0.035  -0.764
   51    HA   ALA   7           HA       ALA   7  -0.062   1.847   1.281
   52    HB1  ALA   7           HB1      ALA   7   1.847   0.705   0.952
   53    HB2  ALA   7           HB2      ALA   7   1.793   1.062  -0.774
   54    HB3  ALA   7           HB3      ALA   7   0.976  -0.367  -0.144
   55    H    LYS   8           H        LYS   8  -1.541   1.862  -1.744
   56    HA   LYS   8           HA       LYS   8  -0.205   4.425  -2.486
   57    HB2  LYS   8           HB3      LYS   8  -1.802   3.328  -4.624
   58    HB3  LYS   8           HB2      LYS   8  -0.078   3.680  -4.606
   59    HG2  LYS   8           HG3      LYS   8  -1.228   1.160  -3.372
   60    HG3  LYS   8           HG2      LYS   8  -0.708   1.247  -5.049
   61    HD2  LYS   8           HD3      LYS   8   1.154   2.188  -2.893
   62    HD3  LYS   8           HD2      LYS   8   1.002   0.461  -3.223
   63    HE2  LYS   8           HE3      LYS   8   2.041   0.625  -5.246
   64    HE3  LYS   8           HE2      LYS   8   1.295   2.180  -5.615
   65    HZ1  LYS   8           HZ1      LYS   8   3.088   3.237  -4.899
   66    HZ2  LYS   8           HZ2      LYS   8   3.876   1.741  -4.761
   67    HZ3  LYS   8           HZ3      LYS   8   3.074   2.405  -3.418
   68    HA   PRO   9           HA       PRO   9  -4.100   6.444  -2.057
   69    HB2  PRO   9           HB2      PRO   9  -4.105   8.256  -4.085
   70    HB3  PRO   9           HB3      PRO   9  -3.029   8.389  -2.681
   71    HG2  PRO   9           HG3      PRO   9  -2.441   7.449  -5.436
   72    HG3  PRO   9           HG2      PRO   9  -1.434   8.386  -4.319
   73    HD2  PRO   9           HD3      PRO   9  -1.152   5.665  -4.768
   74    HD3  PRO   9           HD2      PRO   9  -0.591   6.506  -3.307
   75    H    HIS  10           H        HIS  10  -3.687   6.075  -5.604
   76    HA   HIS  10           HA       HIS  10  -6.542   5.250  -5.748
   77    HB2  HIS  10           HB3      HIS  10  -4.630   6.182  -7.908
   78    HB3  HIS  10           HB2      HIS  10  -6.310   5.719  -8.183
   79    HD1  HIS  10           HD1      HIS  10  -4.187   8.417  -6.664
   80    HD2  HIS  10           HD2      HIS  10  -8.238   7.595  -7.229
   81    HE1  HIS  10           HE1      HIS  10  -5.438  10.553  -6.114
   82    HE2  HIS  10           HE2      HIS  10  -7.903  10.063  -6.455
   83    H    ASN  11           H        ASN  11  -3.503   3.889  -5.619
   84    HA   ASN  11           HA       ASN  11  -4.421   1.488  -7.156
   85    HB2  ASN  11           HB3      ASN  11  -1.585   2.475  -6.734
   86    HB3  ASN  11           HB2      ASN  11  -2.047   1.024  -7.623
   87   HD21  ASN  11          HD22      ASN  11  -2.018   4.557  -7.728
   88   HD22  ASN  11          HD21      ASN  11  -2.464   4.691  -9.361
   89    H    CYS  12           H        CYS  12  -3.560  -0.582  -6.284
   90    HA   CYS  12           HA       CYS  12  -3.061  -0.434  -3.335
   91    HB2  CYS  12           HB3      CYS  12  -4.622  -2.588  -4.789
   92    HB3  CYS  12           HB2      CYS  12  -4.419  -2.421  -3.045
   93    H    VAL  13           H        VAL  13  -2.256  -2.813  -2.645
   94    HA   VAL  13           HA       VAL  13   0.077  -3.352  -4.410
   95    HB   VAL  13           HB       VAL  13  -0.466  -4.265  -1.567
   96   HG11  VAL  13          HG11      VAL  13   2.299  -4.198  -2.318
   97   HG12  VAL  13          HG12      VAL  13   1.415  -5.125  -3.530
   98   HG13  VAL  13          HG13      VAL  13   1.332  -5.590  -1.831
   99   HG21  VAL  13          HG21      VAL  13   0.906  -1.874  -2.762
  100   HG22  VAL  13          HG22      VAL  13   1.518  -2.552  -1.254
  101   HG23  VAL  13          HG23      VAL  13  -0.141  -1.963  -1.347
  102    H    TYR  14           H        TYR  14   0.274  -5.277  -5.477
  103    HA   TYR  14           HA       TYR  14  -2.014  -7.030  -5.660
  104    HB2  TYR  14           HB3      TYR  14  -0.736  -8.255  -7.264
  105    HB3  TYR  14           HB2      TYR  14  -0.290  -6.563  -7.483
  106    HD1  TYR  14           HD2      TYR  14   1.853  -5.698  -6.530
  107    HD2  TYR  14           HD1      TYR  14   0.855  -9.876  -6.486
  108    HE1  TYR  14           HE2      TYR  14   4.227  -6.260  -6.082
  109    HE2  TYR  14           HE1      TYR  14   3.229 -10.437  -6.038
  110    HH   TYR  14           HH       TYR  14   5.285  -8.914  -4.850
  111    H    GLU  15           H        GLU  15   1.175  -7.320  -4.104
  112    HA   GLU  15           HA       GLU  15   0.175  -9.049  -2.043
  113    HB2  GLU  15           HB3      GLU  15   0.191 -10.599  -4.086
  114    HB3  GLU  15           HB2      GLU  15   1.949 -10.459  -4.049
  115    HG2  GLU  15           HG3      GLU  15   1.394 -12.428  -2.797
  116    HG3  GLU  15           HG2      GLU  15   1.845 -11.193  -1.620
  117    H    CYS  16           H        CYS  16   1.422  -7.808  -0.622
  118    HA   CYS  16           HA       CYS  16   4.169  -7.097  -1.173
  119    HB2  CYS  16           HB3      CYS  16   3.396  -5.656   0.428
  120    HB3  CYS  16           HB2      CYS  16   2.294  -6.849   1.113
  121    H    PHE  17           H        PHE  17   6.061  -8.114  -0.453
  122    HA   PHE  17           HA       PHE  17   5.690 -10.837   0.743
  123    HB2  PHE  17           HB3      PHE  17   7.145 -11.733  -0.775
  124    HB3  PHE  17           HB2      PHE  17   6.666 -10.344  -1.749
  125    HD1  PHE  17           HD1      PHE  17   8.070  -8.241  -1.687
  126    HD2  PHE  17           HD2      PHE  17   9.350 -11.936   0.091
  127    HE1  PHE  17           HE1      PHE  17  10.406  -7.407  -1.634
  128    HE2  PHE  17           HE2      PHE  17  11.684 -11.102   0.143
  129    HZ   PHE  17           HZ       PHE  17  12.210  -8.840  -0.714
  130    H    ASP  18           H        ASP  18   8.035 -11.526   1.664
  131    HA   ASP  18           HA       ASP  18   8.528 -10.101   3.985
  132    HB2  ASP  18           HB3      ASP  18  10.541 -11.595   2.280
  133    HB3  ASP  18           HB2      ASP  18  10.837 -11.078   3.941
  134    H    ALA  19           H        ALA  19   9.358  -8.119   4.434
  135    HA   ALA  19           HA       ALA  19  10.106  -6.310   2.342
  136    HB1  ALA  19           HB1      ALA  19  11.164  -5.586   4.962
  137    HB2  ALA  19           HB2      ALA  19   9.479  -6.100   5.051
  138    HB3  ALA  19           HB3      ALA  19   9.940  -4.772   3.986
  139    H    PHE  20           H        PHE  20  11.996  -8.329   4.551
  140    HA   PHE  20           HA       PHE  20  14.314  -8.732   4.641
  141    HB2  PHE  20           HB3      PHE  20  13.691  -9.739   2.429
  142    HB3  PHE  20           HB2      PHE  20  14.099  -8.204   1.662
  143    HD1  PHE  20           HD2      PHE  20  15.451 -11.080   3.567
  144    HD2  PHE  20           HD1      PHE  20  16.387  -7.514   1.363
  145    HE1  PHE  20           HE2      PHE  20  17.843 -11.735   3.522
  146    HE2  PHE  20           HE1      PHE  20  18.779  -8.168   1.319
  147    HZ   PHE  20           HZ       PHE  20  19.507 -10.279   2.397
  148    H    SER  21           H        SER  21  13.117  -5.777   4.236
  149    HA   SER  21           HA       SER  21  15.418  -4.342   4.963
  150    HB2  SER  21           HB3      SER  21  16.535  -4.522   2.950
  151    HB3  SER  21           HB2      SER  21  15.048  -4.729   2.029
  152    HG   SER  21           HG       SER  21  16.449  -2.540   2.310
  153    H    SER  22           H        SER  22  12.708  -3.979   2.669
  154    HA   SER  22           HA       SER  22  10.909  -2.572   4.193
  155    HB2  SER  22           HB3      SER  22  11.640  -0.134   3.346
  156    HB3  SER  22           HB2      SER  22  12.209  -0.793   4.874
  157    HG   SER  22           HG       SER  22  14.147  -1.073   4.041
  158    H    TYR  23           H        TYR  23  10.830  -4.182   1.918
  159    HA   TYR  23           HA       TYR  23  10.572  -2.798  -0.557
  160    HB2  TYR  23           HB3      TYR  23  10.632  -5.271  -0.357
  161    HB3  TYR  23           HB2      TYR  23   9.032  -5.233   0.386
  162    HD1  TYR  23           HD1      TYR  23  10.934  -4.683  -2.731
  163    HD2  TYR  23           HD2      TYR  23   7.043  -4.741  -0.913
  164    HE1  TYR  23           HE1      TYR  23   9.885  -4.644  -4.977
  165    HE2  TYR  23           HE2      TYR  23   5.993  -4.704  -3.160
  166    HH   TYR  23           HH       TYR  23   6.379  -4.355  -5.363
  167    H    CYS  24           H        CYS  24   8.042  -3.692   1.803
  168    HA   CYS  24           HA       CYS  24   5.975  -2.211   0.424
  169    HB2  CYS  24           HB3      CYS  24   5.426  -4.054   1.959
  170    HB3  CYS  24           HB2      CYS  24   6.125  -3.153   3.304
  171    H    ASN  25           H        ASN  25   7.865  -1.566   3.375
  172    HA   ASN  25           HA       ASN  25   6.816   1.021   3.895
  173    HB2  ASN  25           HB3      ASN  25   9.630   0.026   4.437
  174    HB3  ASN  25           HB2      ASN  25   8.822   1.367   5.250
  175   HD21  ASN  25          HD22      ASN  25   6.606  -1.128   4.537
  176   HD22  ASN  25          HD21      ASN  25   6.595  -1.879   6.059
  177    H    GLY  26           H        GLY  26   9.491  -0.043   1.833
  178    HA2  GLY  26           HA3      GLY  26  10.500   2.543   1.178
  179    HA3  GLY  26           HA2      GLY  26  10.684   1.106   0.171
  180    H    VAL  27           H        VAL  27   7.997   0.537  -0.390
  181    HA   VAL  27           HA       VAL  27   7.472   2.293  -2.568
  182    HB   VAL  27           HB       VAL  27   5.654   0.368  -1.097
  183   HG11  VAL  27          HG11      VAL  27   5.173   2.247  -3.344
  184   HG12  VAL  27          HG12      VAL  27   4.030   1.549  -2.195
  185   HG13  VAL  27          HG13      VAL  27   4.582   0.602  -3.577
  186   HG21  VAL  27          HG21      VAL  27   6.532  -1.242  -2.434
  187   HG22  VAL  27          HG22      VAL  27   7.849  -0.104  -2.715
  188   HG23  VAL  27          HG23      VAL  27   6.504  -0.195  -3.852
  189    H    CYS  28           H        CYS  28   6.064   2.143   0.690
  190    HA   CYS  28           HA       CYS  28   4.183   4.273   0.301
  191    HB2  CYS  28           HB3      CYS  28   4.455   2.506   2.252
  192    HB3  CYS  28           HB2      CYS  28   5.460   3.764   2.971
  193    H    THR  29           H        THR  29   7.573   4.187   1.268
  194    HA   THR  29           HA       THR  29   7.823   6.884   2.149
  195    HB   THR  29           HB       THR  29   9.926   5.196   0.768
  196    HG1  THR  29           HG1      THR  29   9.561   5.466   3.543
  197   HG21  THR  29          HG21      THR  29  10.876   7.308   0.940
  198   HG22  THR  29          HG22      THR  29  11.315   6.621   2.504
  199   HG23  THR  29          HG23      THR  29   9.945   7.723   2.378
  200    H    LYS  30           H        LYS  30   8.088   5.477  -1.107
  201    HA   LYS  30           HA       LYS  30   9.076   7.768  -2.444
  202    HB2  LYS  30           HB3      LYS  30   7.377   5.443  -3.303
  203    HB3  LYS  30           HB2      LYS  30   7.620   6.788  -4.414
  204    HG2  LYS  30           HG3      LYS  30   9.358   5.249  -4.916
  205    HG3  LYS  30           HG2      LYS  30  10.135   6.503  -3.953
  206    HD2  LYS  30           HD3      LYS  30   9.897   5.111  -1.936
  207    HD3  LYS  30           HD2      LYS  30   9.097   3.862  -2.892
  208    HE2  LYS  30           HE3      LYS  30  11.042   3.138  -3.819
  209    HE3  LYS  30           HE2      LYS  30  11.691   4.771  -3.963
  210    HZ1  LYS  30           HZ1      LYS  30  12.834   3.273  -2.321
  211    HZ2  LYS  30           HZ2      LYS  30  11.438   3.375  -1.364
  212    HZ3  LYS  30           HZ3      LYS  30  12.331   4.777  -1.714
  213    H    ASN  31           H        ASN  31   5.842   7.048  -1.279
  214    HA   ASN  31           HA       ASN  31   4.340   8.904  -2.770
  215    HB2  ASN  31           HB3      ASN  31   3.495   7.265  -0.997
  216    HB3  ASN  31           HB2      ASN  31   3.964   8.476   0.198
  217   HD21  ASN  31          HD22      ASN  31   2.568  10.266   0.499
  218   HD22  ASN  31          HD21      ASN  31   1.171  10.537  -0.426
  219    H    GLY  32           H        GLY  32   6.497   9.442  -0.011
  220    HA2  GLY  32           HA3      GLY  32   7.251  12.036  -0.657
  221    HA3  GLY  32           HA2      GLY  32   5.775  12.240   0.286
  222    H    ALA  33           H        ALA  33   6.100  10.124   2.132
  223    HA   ALA  33           HA       ALA  33   8.625   9.922   3.381
  224    HB1  ALA  33           HB1      ALA  33   8.028  11.611   5.309
  225    HB2  ALA  33           HB2      ALA  33   7.064  12.393   4.057
  226    HB3  ALA  33           HB3      ALA  33   8.804  12.203   3.841
  227    H    LYS  34           H        LYS  34   5.179   9.942   3.540
  228    HA   LYS  34           HA       LYS  34   4.557   9.094   6.092
  229    HB2  LYS  34           HB3      LYS  34   2.783   7.680   5.061
  230    HB3  LYS  34           HB2      LYS  34   2.865   9.282   4.327
  231    HG2  LYS  34           HG3      LYS  34   4.167   8.407   2.463
  232    HG3  LYS  34           HG2      LYS  34   4.223   6.813   3.210
  233    HD2  LYS  34           HD3      LYS  34   2.481   6.833   1.510
  234    HD3  LYS  34           HD2      LYS  34   1.735   6.715   3.103
  235    HE2  LYS  34           HE3      LYS  34   0.864   8.843   3.008
  236    HE3  LYS  34           HE2      LYS  34   2.185   9.452   2.011
  237    HZ1  LYS  34           HZ1      LYS  34   0.486   9.362   0.502
  238    HZ2  LYS  34           HZ2      LYS  34  -0.233   7.997   1.206
  239    HZ3  LYS  34           HZ3      LYS  34   1.175   7.825   0.271
  240    H    SER  35           H        SER  35   4.693   7.149   7.236
  241    HA   SER  35           HA       SER  35   6.657   5.188   6.154
  242    HB2  SER  35           HB3      SER  35   7.044   4.529   8.460
  243    HB3  SER  35           HB2      SER  35   7.141   6.286   8.366
  244    HG   SER  35           HG       SER  35   4.767   4.875   9.011
  245    H    GLY  36           H        GLY  36   6.099   2.932   6.164
  246    HA2  GLY  36           HA3      GLY  36   3.317   2.286   6.960
  247    HA3  GLY  36           HA2      GLY  36   3.792   1.983   5.292
  248    H    TYR  37           H        TYR  37   2.899  -0.028   7.051
  249    HA   TYR  37           HA       TYR  37   5.369  -1.695   7.286
  250    HB2  TYR  37           HB3      TYR  37   2.938  -1.904   9.085
  251    HB3  TYR  37           HB2      TYR  37   4.476  -2.746   9.268
  252    HD1  TYR  37           HD2      TYR  37   6.595  -1.039   9.231
  253    HD2  TYR  37           HD1      TYR  37   2.594  -0.077  10.467
  254    HE1  TYR  37           HE2      TYR  37   7.468   0.854  10.575
  255    HE2  TYR  37           HE1      TYR  37   3.467   1.818  11.812
  256    HH   TYR  37           HH       TYR  37   6.715   2.178  12.587
  257    H    CYS  38           H        CYS  38   4.971  -3.993   6.783
  258    HA   CYS  38           HA       CYS  38   2.613  -4.304   5.006
  259    HB2  CYS  38           HB3      CYS  38   4.769  -4.848   3.997
  260    HB3  CYS  38           HB2      CYS  38   5.103  -6.005   5.285
  261    H    GLN  39           H        GLN  39   0.885  -5.285   5.830
  262    HA   GLN  39           HA       GLN  39   1.272  -7.233   8.064
  263    HB2  GLN  39           HB3      GLN  39  -1.135  -5.519   7.365
  264    HB3  GLN  39           HB2      GLN  39  -1.058  -6.668   8.704
  265    HG2  GLN  39           HG3      GLN  39   0.872  -5.411   9.641
  266    HG3  GLN  39           HG2      GLN  39   0.713  -4.233   8.339
  267   HE21  GLN  39          HE22      GLN  39  -2.404  -5.116   8.894
  268   HE22  GLN  39          HE21      GLN  39  -2.833  -3.969  10.069
  269    H    ILE  40           H        ILE  40  -0.614  -8.916   8.076
  270    HA   ILE  40           HA       ILE  40  -0.716 -10.023   5.336
  271    HB   ILE  40           HB       ILE  40  -1.346 -12.113   6.382
  272   HG12  ILE  40          HG13      ILE  40  -1.578 -10.483   8.935
  273   HG13  ILE  40          HG12      ILE  40  -2.910 -11.246   8.066
  274   HG21  ILE  40          HG21      ILE  40   1.034 -10.722   6.902
  275   HG22  ILE  40          HG22      ILE  40   0.780 -12.462   7.039
  276   HG23  ILE  40          HG23      ILE  40   0.572 -11.426   8.452
  277   HD11  ILE  40          HD11      ILE  40  -1.175 -13.351   8.392
  278   HD12  ILE  40          HD12      ILE  40  -2.551 -13.009   9.442
  279   HD13  ILE  40          HD13      ILE  40  -0.941 -12.447   9.888
  280    H    LEU  41           H        LEU  41  -2.537 -10.149   4.154
  281    HA   LEU  41           HA       LEU  41  -4.841  -8.599   4.804
  282    HB2  LEU  41           HB3      LEU  41  -4.123  -9.201   2.483
  283    HB3  LEU  41           HB2      LEU  41  -4.626 -10.862   2.796
  284    HG   LEU  41           HG       LEU  41  -6.924 -10.000   3.327
  285   HD11  LEU  41          HD11      LEU  41  -6.754  -7.752   3.876
  286   HD12  LEU  41          HD12      LEU  41  -7.239  -7.624   2.186
  287   HD13  LEU  41          HD13      LEU  41  -5.545  -7.432   2.633
  288   HD21  LEU  41          HD21      LEU  41  -5.981  -9.176   0.570
  289   HD22  LEU  41          HD22      LEU  41  -7.576  -9.775   1.024
  290   HD23  LEU  41          HD23      LEU  41  -6.186 -10.860   1.052
  291    H    GLY  42           H        GLY  42  -3.994 -11.934   5.378
  292    HA2  GLY  42           HA3      GLY  42  -5.104 -13.166   7.196
  293    HA3  GLY  42           HA2      GLY  42  -6.597 -12.306   6.796
  294    H    THR  43           H        THR  43  -5.356 -12.805   3.905
  295    HA   THR  43           HA       THR  43  -6.451 -15.558   3.585
  296    HB   THR  43           HB       THR  43  -7.571 -14.911   1.572
  297    HG1  THR  43           HG1      THR  43  -6.821 -13.339   0.427
  298   HG21  THR  43          HG21      THR  43  -9.266 -13.738   2.537
  299   HG22  THR  43          HG22      THR  43  -8.200 -12.426   3.041
  300   HG23  THR  43          HG23      THR  43  -8.295 -13.902   4.001
  301    H    TYR  44           H        TYR  44  -5.665 -16.425   1.324
  302    HA   TYR  44           HA       TYR  44  -2.911 -16.731   1.294
  303    HB2  TYR  44           HB3      TYR  44  -3.105 -17.541  -0.932
  304    HB3  TYR  44           HB2      TYR  44  -4.679 -17.862  -0.203
  305    HD1  TYR  44           HD1      TYR  44  -6.604 -16.323  -0.653
  306    HD2  TYR  44           HD2      TYR  44  -2.862 -15.976  -2.731
  307    HE1  TYR  44           HE1      TYR  44  -7.698 -14.931  -2.388
  308    HE2  TYR  44           HE2      TYR  44  -3.955 -14.582  -4.467
  309    HH   TYR  44           HH       TYR  44  -6.178 -12.993  -4.415
  310    H    GLY  45           H        GLY  45  -4.666 -13.882   0.526
  311    HA2  GLY  45           HA3      GLY  45  -2.480 -12.715  -1.078
  312    HA3  GLY  45           HA2      GLY  45  -4.006 -11.927  -0.683
  313    H    ASN  46           H        ASN  46  -2.101 -10.238  -0.313
  314    HA   ASN  46           HA       ASN  46  -1.671 -10.151   2.623
  315    HB2  ASN  46           HB3      ASN  46   0.411 -10.979   1.306
  316    HB3  ASN  46           HB2      ASN  46   0.524  -9.317   0.728
  317   HD21  ASN  46          HD22      ASN  46   1.226  -7.692   2.224
  318   HD22  ASN  46          HD21      ASN  46   1.730  -8.052   3.804
  319    H    GLY  47           H        GLY  47  -0.992  -7.821   3.257
  320    HA2  GLY  47           HA3      GLY  47  -1.967  -5.825   1.272
  321    HA3  GLY  47           HA2      GLY  47  -2.721  -5.870   2.864
  322    H    CYS  48           H        CYS  48  -1.140  -3.704   1.614
  323    HA   CYS  48           HA       CYS  48   1.243  -3.626   3.373
  324    HB2  CYS  48           HB3      CYS  48   0.520  -2.405   0.796
  325    HB3  CYS  48           HB2      CYS  48   1.301  -1.295   1.921
  326    H    TRP  49           H        TRP  49   1.466  -1.982   4.935
  327    HA   TRP  49           HA       TRP  49  -1.053  -0.509   5.567
  328    HB2  TRP  49           HB3      TRP  49   0.086  -2.269   7.173
  329    HB3  TRP  49           HB2      TRP  49   1.166  -0.926   7.544
  330    HD1  TRP  49           HD1      TRP  49   0.124   1.212   8.725
  331    HE1  TRP  49           HE1      TRP  49  -2.049   1.543  10.075
  332    HE3  TRP  49           HE3      TRP  49  -2.387  -3.027   7.396
  333    HZ2  TRP  49           HZ2      TRP  49  -4.525   0.182  10.532
  334    HZ3  TRP  49           HZ3      TRP  49  -4.647  -3.488   8.302
  335    HH2  TRP  49           HH2      TRP  49  -5.718  -1.890   9.867
  336    H    CYS  50           H        CYS  50  -0.958   1.709   5.414
  337    HA   CYS  50           HA       CYS  50   1.757   2.979   5.474
  338    HB2  CYS  50           HB3      CYS  50  -0.519   3.365   3.571
  339    HB3  CYS  50           HB2      CYS  50   0.508   4.744   3.954
  340    H    ILE  51           H        ILE  51   1.966   4.680   6.858
  341    HA   ILE  51           HA       ILE  51  -0.522   5.716   8.144
  342    HB   ILE  51           HB       ILE  51   2.224   5.345   9.370
  343   HG12  ILE  51          HG13      ILE  51  -0.096   4.014  10.574
  344   HG13  ILE  51          HG12      ILE  51   0.229   3.472   8.929
  345   HG21  ILE  51          HG21      ILE  51   1.542   6.923  10.831
  346   HG22  ILE  51          HG22      ILE  51   0.282   5.801  11.346
  347   HG23  ILE  51          HG23      ILE  51  -0.058   6.994  10.092
  348   HD11  ILE  51          HD11      ILE  51   2.414   3.684  11.004
  349   HD12  ILE  51          HD12      ILE  51   2.450   2.813   9.471
  350   HD13  ILE  51          HD13      ILE  51   1.454   2.219  10.800
  351    H    ALA  52           H        ALA  52  -0.708   7.913   8.384
  352    HA   ALA  52           HA       ALA  52  -0.026  10.193   8.380
  353    HB1  ALA  52           HB1      ALA  52   2.409   9.184   8.545
  354    HB2  ALA  52           HB2      ALA  52   2.162  10.845   8.009
  355    HB3  ALA  52           HB3      ALA  52   2.453   9.573   6.825
  356    H    LEU  53           H        LEU  53  -1.882   9.652   6.800
  357    HA   LEU  53           HA       LEU  53  -1.062  10.581   4.083
  358    HB2  LEU  53           HB3      LEU  53  -1.666   8.203   3.957
  359    HB3  LEU  53           HB2      LEU  53  -3.199   8.535   4.758
  360    HG   LEU  53           HG       LEU  53  -3.931   9.921   2.893
  361   HD11  LEU  53          HD11      LEU  53  -2.320   9.790   0.808
  362   HD12  LEU  53          HD12      LEU  53  -1.079   9.557   2.039
  363   HD13  LEU  53          HD13      LEU  53  -2.061  11.020   2.045
  364   HD21  LEU  53          HD21      LEU  53  -4.631   7.972   2.007
  365   HD22  LEU  53          HD22      LEU  53  -3.229   7.127   2.664
  366   HD23  LEU  53          HD23      LEU  53  -3.129   7.905   1.085
  367    HA   PRO  54           HA       PRO  54  -3.985  13.597   6.091
  368    HB2  PRO  54           HB2      PRO  54  -2.638  15.318   4.074
  369    HB3  PRO  54           HB3      PRO  54  -2.935  15.619   5.796
  370    HG2  PRO  54           HG3      PRO  54  -0.503  15.019   4.858
  371    HG3  PRO  54           HG2      PRO  54  -1.056  14.492   6.456
  372    HD2  PRO  54           HD3      PRO  54  -0.737  12.893   3.954
  373    HD3  PRO  54           HD2      PRO  54  -0.557  12.389   5.650
  374    H    ASP  55           H        ASP  55  -3.381  12.592   2.815
  375    HA   ASP  55           HA       ASP  55  -5.360  14.045   1.410
  376    HB2  ASP  55           HB3      ASP  55  -4.376  11.203   1.021
  377    HB3  ASP  55           HB2      ASP  55  -5.400  12.057  -0.134
  378    H    ASN  56           H        ASN  56  -5.640  11.197   3.484
  379    HA   ASN  56           HA       ASN  56  -7.542  10.176   4.402
  380    HB2  ASN  56           HB3      ASN  56  -8.060  12.730   4.721
  381    HB3  ASN  56           HB2      ASN  56  -9.218  12.470   3.415
  382   HD21  ASN  56          HD22      ASN  56  -9.136   9.507   4.770
  383   HD22  ASN  56          HD21      ASN  56 -10.344   9.669   5.953
  384    H    VAL  57           H        VAL  57  -6.806   9.358   1.857
  385    HA   VAL  57           HA       VAL  57  -9.452   8.908   0.548
  386    HB   VAL  57           HB       VAL  57  -8.220   8.746  -1.603
  387   HG11  VAL  57          HG11      VAL  57  -7.853  11.304  -0.019
  388   HG12  VAL  57          HG12      VAL  57  -9.229  10.879  -1.036
  389   HG13  VAL  57          HG13      VAL  57  -7.654  11.189  -1.768
  390   HG21  VAL  57          HG21      VAL  57  -6.004   8.291  -1.367
  391   HG22  VAL  57          HG22      VAL  57  -5.950   8.971   0.260
  392   HG23  VAL  57          HG23      VAL  57  -5.825  10.032  -1.144
  393    HA   PRO  58           HA       PRO  58  -7.544   4.861   1.757
  394    HB2  PRO  58           HB2      PRO  58  -9.684   3.855   3.090
  395    HB3  PRO  58           HB3      PRO  58  -8.516   4.949   3.854
  396    HG2  PRO  58           HG3      PRO  58 -11.245   5.509   2.829
  397    HG3  PRO  58           HG2      PRO  58 -10.402   6.182   4.234
  398    HD2  PRO  58           HD3      PRO  58 -10.680   7.465   1.776
  399    HD3  PRO  58           HD2      PRO  58  -9.460   7.870   3.003
  400    H    ILE  59           H        ILE  59 -11.081   4.785   1.261
  401    HA   ILE  59           HA       ILE  59 -10.626   2.973  -1.065
  402    HB   ILE  59           HB       ILE  59 -12.968   2.975   0.863
  403   HG12  ILE  59          HG13      ILE  59 -10.704   0.976   0.552
  404   HG13  ILE  59          HG12      ILE  59 -10.818   2.160   1.854
  405   HG21  ILE  59          HG21      ILE  59 -12.658   1.954  -1.778
  406   HG22  ILE  59          HG22      ILE  59 -14.006   1.698  -0.670
  407   HG23  ILE  59          HG23      ILE  59 -12.646   0.576  -0.677
  408   HD11  ILE  59          HD11      ILE  59 -13.130   1.167   2.347
  409   HD12  ILE  59          HD12      ILE  59 -11.742   0.158   2.753
  410   HD13  ILE  59          HD13      ILE  59 -12.667  -0.163   1.285
  411    H    ARG  60           H        ARG  60 -11.480   3.701  -2.957
  412    HA   ARG  60           HA       ARG  60 -13.828   5.472  -2.940
  413    HB2  ARG  60           HB3      ARG  60 -12.752   7.291  -4.120
  414    HB3  ARG  60           HB2      ARG  60 -11.808   6.969  -2.664
  415    HG2  ARG  60           HG3      ARG  60 -10.336   5.461  -4.074
  416    HG3  ARG  60           HG2      ARG  60 -11.181   6.085  -5.490
  417    HD2  ARG  60           HD3      ARG  60  -9.615   7.722  -3.478
  418    HD3  ARG  60           HD2      ARG  60  -9.130   7.361  -5.134
  419    HE   ARG  60           HE       ARG  60 -11.698   8.635  -5.154
  420   HH11  ARG  60          HH22      ARG  60  -8.346   9.181  -4.552
  421   HH12  ARG  60          HH21      ARG  60  -8.402  10.852  -5.006
  422   HH21  ARG  60          HH11      ARG  60 -11.789  10.813  -5.749
  423   HH22  ARG  60          HH12      ARG  60 -10.350  11.775  -5.683
  424    H    ILE  61           H        ILE  61 -11.346   3.701  -4.672
  425    HA   ILE  61           HA       ILE  61 -12.693   3.833  -7.244
  426    HB   ILE  61           HB       ILE  61 -11.043   1.715  -7.541
  427   HG12  ILE  61          HG13      ILE  61  -9.049   2.001  -6.167
  428   HG13  ILE  61          HG12      ILE  61  -9.785   3.356  -5.318
  429   HG21  ILE  61          HG21      ILE  61  -9.363   3.314  -8.320
  430   HG22  ILE  61          HG22      ILE  61 -10.126   4.600  -7.385
  431   HG23  ILE  61          HG23      ILE  61 -10.974   3.883  -8.755
  432   HD11  ILE  61          HD11      ILE  61  -9.849   0.898  -4.300
  433   HD12  ILE  61          HD12      ILE  61 -11.250   0.745  -5.358
  434   HD13  ILE  61          HD13      ILE  61 -11.220   1.989  -4.108
  435    HA   PRO  62           HA       PRO  62 -15.710   0.657  -6.947
  436    HB2  PRO  62           HB2      PRO  62 -15.010  -0.892  -9.196
  437    HB3  PRO  62           HB3      PRO  62 -16.129   0.482  -9.173
  438    HG2  PRO  62           HG3      PRO  62 -13.294   0.363 -10.009
  439    HG3  PRO  62           HG2      PRO  62 -14.611   1.389 -10.602
  440    HD2  PRO  62           HD3      PRO  62 -12.657   2.358  -8.994
  441    HD3  PRO  62           HD2      PRO  62 -14.324   2.968  -8.920
  442    H    GLY  63           H        GLY  63 -12.408  -0.040  -6.694
  443    HA2  GLY  63           HA3      GLY  63 -11.592  -1.734  -5.167
  444    HA3  GLY  63           HA2      GLY  63 -13.048  -2.675  -5.486
  445    H    LYS  64           H        LYS  64 -11.730  -1.348  -8.317
  446    HA   LYS  64           HA       LYS  64 -11.231  -3.841  -9.551
  447    HB2  LYS  64           HB3      LYS  64 -11.505  -1.694 -10.779
  448    HB3  LYS  64           HB2      LYS  64  -9.920  -1.183 -10.197
  449    HG2  LYS  64           HG3      LYS  64  -8.907  -3.177 -11.290
  450    HG3  LYS  64           HG2      LYS  64 -10.495  -3.602 -11.934
  451    HD2  LYS  64           HD3      LYS  64 -10.587  -1.400 -13.089
  452    HD3  LYS  64           HD2      LYS  64  -8.961  -1.048 -12.502
  453    HE2  LYS  64           HE3      LYS  64  -7.969  -2.601 -13.899
  454    HE3  LYS  64           HE2      LYS  64  -9.405  -3.623 -13.955
  455    HZ1  LYS  64           HZ1      LYS  64 -10.139  -1.197 -15.052
  456    HZ2  LYS  64           HZ2      LYS  64  -9.901  -2.663 -15.872
  457    HZ3  LYS  64           HZ3      LYS  64  -8.620  -1.557 -15.723
  458    H    CYS  65           H        CYS  65  -9.092  -1.743  -7.681
  459    HA   CYS  65           HA       CYS  65  -6.660  -3.163  -8.284
  460    HB2  CYS  65           HB3      CYS  65  -5.657  -1.803  -6.670
  461    HB3  CYS  65           HB2      CYS  65  -7.036  -0.820  -7.160
  462    H    HIS  66           H        HIS  66  -5.564  -4.726  -6.965
  463    HA   HIS  66           HA       HIS  66  -7.430  -6.351  -5.304
  464    HB2  HIS  66           HB3      HIS  66  -4.713  -7.137  -6.393
  465    HB3  HIS  66           HB2      HIS  66  -5.930  -8.207  -5.696
  466    HD1  HIS  66           HD1      HIS  66  -8.440  -7.704  -7.070
  467    HD2  HIS  66           HD2      HIS  66  -4.834  -7.348  -9.136
  468    HE1  HIS  66           HE1      HIS  66  -9.000  -7.922  -9.532
  469    HE2  HIS  66           HE2      HIS  66  -6.812  -7.705 -10.799
  Start of MODEL   16
    1    H1   ALA   1           H1       ALA   1  -5.276  12.226   4.273
    2    H2   ALA   1           H2       ALA   1  -4.748  11.093   3.122
    3    H3   ALA   1           H3       ALA   1  -3.753  11.497   4.439
    4    HA   ALA   1           HA       ALA   1  -5.641  10.631   5.896
    5    HB1  ALA   1           HB1      ALA   1  -6.984  10.487   3.559
    6    HB2  ALA   1           HB2      ALA   1  -7.326   9.418   4.919
    7    HB3  ALA   1           HB3      ALA   1  -6.300   8.862   3.597
    8    H    ARG   2           H        ARG   2  -5.764   7.758   5.283
    9    HA   ARG   2           HA       ARG   2  -2.868   7.064   5.138
   10    HB2  ARG   2           HB3      ARG   2  -3.052   5.620   7.080
   11    HB3  ARG   2           HB2      ARG   2  -3.593   7.235   7.537
   12    HG2  ARG   2           HG3      ARG   2  -5.954   6.497   7.087
   13    HG3  ARG   2           HG2      ARG   2  -5.342   4.860   6.842
   14    HD2  ARG   2           HD3      ARG   2  -4.342   4.942   9.132
   15    HD3  ARG   2           HD2      ARG   2  -5.102   6.515   9.371
   16    HE   ARG   2           HE       ARG   2  -6.941   4.353   8.602
   17   HH11  ARG   2          HH22      ARG   2  -5.398   6.187  11.081
   18   HH12  ARG   2          HH21      ARG   2  -6.604   5.837  12.274
   19   HH21  ARG   2          HH11      ARG   2  -8.524   3.886  10.146
   20   HH22  ARG   2          HH12      ARG   2  -8.374   4.535  11.745
   21    H    ASP   3           H        ASP   3  -2.521   4.771   4.602
   22    HA   ASP   3           HA       ASP   3  -4.810   3.686   3.036
   23    HB2  ASP   3           HB3      ASP   3  -2.227   4.161   2.249
   24    HB3  ASP   3           HB2      ASP   3  -2.166   2.447   2.668
   25    H    ALA   4           H        ALA   4  -5.341   1.440   3.238
   26    HA   ALA   4           HA       ALA   4  -4.568   0.315   5.870
   27    HB1  ALA   4           HB1      ALA   4  -6.834  -0.315   3.967
   28    HB2  ALA   4           HB2      ALA   4  -6.947   0.463   5.547
   29    HB3  ALA   4           HB3      ALA   4  -6.511  -1.242   5.433
   30    H    TYR   5           H        TYR   5  -5.512  -1.366   2.874
   31    HA   TYR   5           HA       TYR   5  -3.139  -3.145   3.278
   32    HB2  TYR   5           HB3      TYR   5  -5.509  -3.738   1.507
   33    HB3  TYR   5           HB2      TYR   5  -4.373  -4.874   2.237
   34    HD1  TYR   5           HD1      TYR   5  -7.268  -2.682   2.833
   35    HD2  TYR   5           HD2      TYR   5  -4.562  -5.524   4.577
   36    HE1  TYR   5           HE1      TYR   5  -8.771  -2.908   4.797
   37    HE2  TYR   5           HE2      TYR   5  -6.062  -5.750   6.541
   38    HH   TYR   5           HH       TYR   5  -9.195  -4.799   6.577
   39    H    ILE   6           H        ILE   6  -3.947  -0.518   1.499
   40    HA   ILE   6           HA       ILE   6  -2.622  -1.529  -0.974
   41    HB   ILE   6           HB       ILE   6  -4.318   0.952  -0.609
   42   HG12  ILE   6          HG13      ILE   6  -5.020  -1.731  -1.841
   43   HG13  ILE   6          HG12      ILE   6  -5.596  -1.157  -0.275
   44   HG21  ILE   6          HG21      ILE   6  -3.637   1.491  -2.679
   45   HG22  ILE   6          HG22      ILE   6  -4.184  -0.075  -3.277
   46   HG23  ILE   6          HG23      ILE   6  -2.540   0.110  -2.663
   47   HD11  ILE   6          HD11      ILE   6  -7.247  -0.009  -1.279
   48   HD12  ILE   6          HD12      ILE   6  -6.710  -0.631  -2.840
   49   HD13  ILE   6          HD13      ILE   6  -6.061   0.890  -2.227
   50    H    ALA   7           H        ALA   7  -0.740  -0.563  -1.665
   51    HA   ALA   7           HA       ALA   7   0.366   1.593   0.080
   52    HB1  ALA   7           HB1      ALA   7   2.122   0.186   0.246
   53    HB2  ALA   7           HB2      ALA   7   2.454   0.543  -1.448
   54    HB3  ALA   7           HB3      ALA   7   1.479  -0.862  -1.018
   55    H    LYS   8           H        LYS   8  -1.289   1.480  -2.618
   56    HA   LYS   8           HA       LYS   8   0.413   3.503  -4.001
   57    HB2  LYS   8           HB3      LYS   8  -1.475   2.086  -5.736
   58    HB3  LYS   8           HB2      LYS   8   0.236   2.417  -5.985
   59    HG2  LYS   8           HG3      LYS   8  -0.830   0.216  -4.183
   60    HG3  LYS   8           HG2      LYS   8  -0.262  -0.029  -5.830
   61    HD2  LYS   8           HD3      LYS   8   1.661   1.494  -4.266
   62    HD3  LYS   8           HD2      LYS   8   1.316  -0.069  -3.526
   63    HE2  LYS   8           HE3      LYS   8   1.903   0.187  -6.477
   64    HE3  LYS   8           HE2      LYS   8   3.195   0.007  -5.290
   65    HZ1  LYS   8           HZ1      LYS   8   1.578  -1.932  -4.508
   66    HZ2  LYS   8           HZ2      LYS   8   2.797  -2.165  -5.664
   67    HZ3  LYS   8           HZ3      LYS   8   1.192  -1.914  -6.164
   68    HA   PRO   9           HA       PRO   9  -3.049   6.209  -3.701
   69    HB2  PRO   9           HB2      PRO   9  -2.952   7.485  -6.155
   70    HB3  PRO   9           HB3      PRO   9  -1.918   7.882  -4.770
   71    HG2  PRO   9           HG3      PRO   9  -1.308   6.276  -7.189
   72    HG3  PRO   9           HG2      PRO   9  -0.269   7.371  -6.263
   73    HD2  PRO   9           HD3      PRO   9  -0.101   4.655  -6.058
   74    HD3  PRO   9           HD2      PRO   9   0.297   5.747  -4.715
   75    H    HIS  10           H        HIS  10  -2.875   4.349  -6.729
   76    HA   HIS  10           HA       HIS  10  -5.829   4.036  -6.581
   77    HB2  HIS  10           HB3      HIS  10  -4.321   4.608  -9.147
   78    HB3  HIS  10           HB2      HIS  10  -6.065   4.412  -8.969
   79    HD1  HIS  10           HD1      HIS  10  -7.173   6.231  -7.185
   80    HD2  HIS  10           HD2      HIS  10  -3.522   7.244  -8.931
   81    HE1  HIS  10           HE1      HIS  10  -6.912   8.737  -6.904
   82    HE2  HIS  10           HE2      HIS  10  -4.694   9.363  -7.962
   83    H    ASN  11           H        ASN  11  -2.836   2.614  -6.740
   84    HA   ASN  11           HA       ASN  11  -3.923   0.163  -8.070
   85    HB2  ASN  11           HB3      ASN  11  -1.033   1.007  -7.693
   86    HB3  ASN  11           HB2      ASN  11  -1.586  -0.446  -8.527
   87   HD21  ASN  11          HD22      ASN  11  -1.114   3.003  -8.840
   88   HD22  ASN  11          HD21      ASN  11  -1.650   3.130 -10.445
   89    H    CYS  12           H        CYS  12  -2.951  -1.901  -7.114
   90    HA   CYS  12           HA       CYS  12  -2.737  -1.620  -4.140
   91    HB2  CYS  12           HB3      CYS  12  -3.879  -3.942  -5.719
   92    HB3  CYS  12           HB2      CYS  12  -3.830  -3.798  -3.962
   93    H    VAL  13           H        VAL  13  -1.719  -3.793  -3.235
   94    HA   VAL  13           HA       VAL  13   0.849  -4.132  -4.689
   95    HB   VAL  13           HB       VAL  13   0.050  -5.044  -1.906
   96   HG11  VAL  13          HG11      VAL  13   2.254  -5.709  -3.575
   97   HG12  VAL  13          HG12      VAL  13   2.024  -6.120  -1.876
   98   HG13  VAL  13          HG13      VAL  13   2.862  -4.632  -2.317
   99   HG21  VAL  13          HG21      VAL  13   0.251  -2.857  -1.371
  100   HG22  VAL  13          HG22      VAL  13   0.842  -2.451  -2.983
  101   HG23  VAL  13          HG23      VAL  13   1.967  -3.015  -1.746
  102    H    TYR  14           H        TYR  14   1.415  -6.078  -5.610
  103    HA   TYR  14           HA       TYR  14  -0.626  -8.048  -6.086
  104    HB2  TYR  14           HB3      TYR  14   1.027  -9.226  -7.336
  105    HB3  TYR  14           HB2      TYR  14   1.404  -7.517  -7.553
  106    HD1  TYR  14           HD1      TYR  14   3.241  -6.461  -6.213
  107    HD2  TYR  14           HD2      TYR  14   2.531 -10.698  -6.192
  108    HE1  TYR  14           HE1      TYR  14   5.504  -6.836  -5.270
  109    HE2  TYR  14           HE2      TYR  14   4.794 -11.072  -5.248
  110    HH   TYR  14           HH       TYR  14   7.197  -8.872  -5.312
  111    H    GLU  15           H        GLU  15   2.268  -8.049  -4.003
  112    HA   GLU  15           HA       GLU  15   1.022  -9.637  -1.972
  113    HB2  GLU  15           HB3      GLU  15   1.313 -11.392  -3.782
  114    HB3  GLU  15           HB2      GLU  15   3.055 -11.152  -3.635
  115    HG2  GLU  15           HG3      GLU  15   2.898 -11.706  -1.214
  116    HG3  GLU  15           HG2      GLU  15   1.179 -12.039  -1.425
  117    H    CYS  16           H        CYS  16   2.044  -8.200  -0.538
  118    HA   CYS  16           HA       CYS  16   4.818  -7.469  -0.755
  119    HB2  CYS  16           HB3      CYS  16   3.801  -5.972   0.655
  120    HB3  CYS  16           HB2      CYS  16   2.670  -7.175   1.279
  121    H    PHE  17           H        PHE  17   6.627  -8.376   0.284
  122    HA   PHE  17           HA       PHE  17   6.158 -11.043   1.562
  123    HB2  PHE  17           HB3      PHE  17   7.909 -11.965   0.366
  124    HB3  PHE  17           HB2      PHE  17   7.336 -10.785  -0.809
  125    HD1  PHE  17           HD2      PHE  17   8.388  -8.387  -0.644
  126    HD2  PHE  17           HD1      PHE  17  10.154 -11.925   1.030
  127    HE1  PHE  17           HE2      PHE  17  10.598  -7.265  -0.600
  128    HE2  PHE  17           HE1      PHE  17  12.364 -10.802   1.074
  129    HZ   PHE  17           HZ       PHE  17  12.585  -8.472   0.261
  130    H    ASP  18           H        ASP  18   9.012 -11.268   2.238
  131    HA   ASP  18           HA       ASP  18   8.974 -10.092   4.815
  132    HB2  ASP  18           HB3      ASP  18  11.331 -10.982   3.129
  133    HB3  ASP  18           HB2      ASP  18  11.436 -10.569   4.839
  134    H    ALA  19           H        ALA  19   9.781  -8.161   5.623
  135    HA   ALA  19           HA       ALA  19  10.049  -5.973   3.718
  136    HB1  ALA  19           HB1      ALA  19  10.202  -6.161   6.728
  137    HB2  ALA  19           HB2      ALA  19   8.941  -5.419   5.745
  138    HB3  ALA  19           HB3      ALA  19  10.526  -4.655   5.870
  139    H    PHE  20           H        PHE  20  12.190  -8.287   4.350
  140    HA   PHE  20           HA       PHE  20  14.569  -7.118   5.257
  141    HB2  PHE  20           HB3      PHE  20  14.293  -9.520   4.573
  142    HB3  PHE  20           HB2      PHE  20  14.340  -9.001   2.888
  143    HD1  PHE  20           HD1      PHE  20  16.284  -9.282   6.022
  144    HD2  PHE  20           HD2      PHE  20  16.399  -8.276   1.848
  145    HE1  PHE  20           HE1      PHE  20  18.764  -9.288   6.089
  146    HE2  PHE  20           HE2      PHE  20  18.879  -8.283   1.914
  147    HZ   PHE  20           HZ       PHE  20  20.060  -8.789   4.035
  148    H    SER  21           H        SER  21  13.144  -6.996   2.001
  149    HA   SER  21           HA       SER  21  15.242  -5.117   1.112
  150    HB2  SER  21           HB3      SER  21  14.354  -5.395  -1.070
  151    HB3  SER  21           HB2      SER  21  14.216  -6.989  -0.336
  152    HG   SER  21           HG       SER  21  12.036  -6.326   0.255
  153    H    SER  22           H        SER  22  12.617  -4.812   2.993
  154    HA   SER  22           HA       SER  22  11.128  -3.065   3.486
  155    HB2  SER  22           HB3      SER  22  12.053  -0.839   3.289
  156    HB3  SER  22           HB2      SER  22  13.370  -1.928   3.716
  157    HG   SER  22           HG       SER  22  12.907  -1.681   1.015
  158    H    TYR  23           H        TYR  23  10.754  -4.493   0.959
  159    HA   TYR  23           HA       TYR  23  10.209  -2.763  -1.225
  160    HB2  TYR  23           HB3      TYR  23  10.220  -5.196  -1.468
  161    HB3  TYR  23           HB2      TYR  23   8.814  -5.329  -0.410
  162    HD1  TYR  23           HD2      TYR  23   6.608  -4.489  -1.131
  163    HD2  TYR  23           HD1      TYR  23  10.007  -4.440  -3.758
  164    HE1  TYR  23           HE2      TYR  23   5.104  -4.127  -3.071
  165    HE2  TYR  23           HE1      TYR  23   8.504  -4.074  -5.697
  166    HH   TYR  23           HH       TYR  23   5.559  -4.733  -5.887
  167    H    CYS  24           H        CYS  24   8.051  -3.865   1.394
  168    HA   CYS  24           HA       CYS  24   5.769  -2.386   0.478
  169    HB2  CYS  24           HB3      CYS  24   5.642  -4.251   2.122
  170    HB3  CYS  24           HB2      CYS  24   6.454  -3.229   3.309
  171    H    ASN  25           H        ASN  25   8.002  -1.686   3.176
  172    HA   ASN  25           HA       ASN  25   7.032   0.946   3.660
  173    HB2  ASN  25           HB3      ASN  25   9.818  -0.168   4.115
  174    HB3  ASN  25           HB2      ASN  25   9.164   1.296   4.854
  175   HD21  ASN  25          HD22      ASN  25   6.736  -1.071   4.451
  176   HD22  ASN  25          HD21      ASN  25   6.739  -1.684   6.035
  177    H    GLY  26           H        GLY  26   9.481  -0.285   1.431
  178    HA2  GLY  26           HA3      GLY  26  10.631   2.188   0.649
  179    HA3  GLY  26           HA2      GLY  26  10.539   0.761  -0.385
  180    H    VAL  27           H        VAL  27   7.757   0.488  -0.618
  181    HA   VAL  27           HA       VAL  27   7.172   2.406  -2.667
  182    HB   VAL  27           HB       VAL  27   5.366   0.510  -1.142
  183   HG11  VAL  27          HG11      VAL  27   3.929   2.190  -2.025
  184   HG12  VAL  27          HG12      VAL  27   3.883   0.879  -3.205
  185   HG13  VAL  27          HG13      VAL  27   4.863   2.312  -3.516
  186   HG21  VAL  27          HG21      VAL  27   6.113  -1.071  -2.570
  187   HG22  VAL  27          HG22      VAL  27   7.357   0.072  -3.080
  188   HG23  VAL  27          HG23      VAL  27   5.831  -0.022  -3.959
  189    H    CYS  28           H        CYS  28   6.066   2.086   0.691
  190    HA   CYS  28           HA       CYS  28   4.373   4.428   0.624
  191    HB2  CYS  28           HB3      CYS  28   4.510   2.400   2.329
  192    HB3  CYS  28           HB2      CYS  28   5.651   3.457   3.159
  193    H    THR  29           H        THR  29   7.767   3.852   1.302
  194    HA   THR  29           HA       THR  29   8.403   6.310   2.585
  195    HB   THR  29           HB       THR  29  10.174   4.685   0.741
  196    HG1  THR  29           HG1      THR  29   9.178   4.275   3.278
  197   HG21  THR  29          HG21      THR  29  11.180   6.811   1.231
  198   HG22  THR  29          HG22      THR  29  11.953   5.622   2.280
  199   HG23  THR  29          HG23      THR  29  10.720   6.701   2.931
  200    H    LYS  30           H        LYS  30   7.984   5.536  -0.831
  201    HA   LYS  30           HA       LYS  30   9.284   7.687  -2.048
  202    HB2  LYS  30           HB3      LYS  30   6.877   6.070  -2.707
  203    HB3  LYS  30           HB2      LYS  30   7.062   7.588  -3.582
  204    HG2  LYS  30           HG3      LYS  30   8.164   5.859  -4.857
  205    HG3  LYS  30           HG2      LYS  30   9.416   6.879  -4.151
  206    HD2  LYS  30           HD3      LYS  30   9.757   5.274  -2.343
  207    HD3  LYS  30           HD2      LYS  30   8.432   4.279  -2.948
  208    HE2  LYS  30           HE3      LYS  30  10.009   3.175  -4.132
  209    HE3  LYS  30           HE2      LYS  30  10.033   4.592  -5.179
  210    HZ1  LYS  30           HZ1      LYS  30  12.248   3.990  -4.366
  211    HZ2  LYS  30           HZ2      LYS  30  11.729   4.231  -2.769
  212    HZ3  LYS  30           HZ3      LYS  30  11.783   5.540  -3.851
  213    H    ASN  31           H        ASN  31   6.374   7.750  -0.100
  214    HA   ASN  31           HA       ASN  31   5.273  10.223  -0.906
  215    HB2  ASN  31           HB3      ASN  31   4.369   8.580   0.850
  216    HB3  ASN  31           HB2      ASN  31   5.468   9.367   1.985
  217   HD21  ASN  31          HD22      ASN  31   4.661  11.216   3.002
  218   HD22  ASN  31          HD21      ASN  31   3.329  12.117   2.460
  219    H    GLY  32           H        GLY  32   8.121   9.512   1.021
  220    HA2  GLY  32           HA3      GLY  32   9.960  11.123   1.095
  221    HA3  GLY  32           HA2      GLY  32   8.770  12.421   0.986
  222    H    ALA  33           H        ALA  33   7.543  10.124   3.049
  223    HA   ALA  33           HA       ALA  33   8.966  10.491   5.470
  224    HB1  ALA  33           HB1      ALA  33   8.540  12.657   5.947
  225    HB2  ALA  33           HB2      ALA  33   6.876  12.148   6.237
  226    HB3  ALA  33           HB3      ALA  33   7.343  12.781   4.658
  227    H    LYS  34           H        LYS  34   5.945   9.971   3.800
  228    HA   LYS  34           HA       LYS  34   4.316   9.062   5.920
  229    HB2  LYS  34           HB3      LYS  34   3.707   9.334   3.439
  230    HB3  LYS  34           HB2      LYS  34   4.423   7.741   3.200
  231    HG2  LYS  34           HG3      LYS  34   2.876   6.804   4.891
  232    HG3  LYS  34           HG2      LYS  34   2.144   8.396   5.083
  233    HD2  LYS  34           HD3      LYS  34   1.860   8.252   2.466
  234    HD3  LYS  34           HD2      LYS  34   1.993   6.517   2.756
  235    HE2  LYS  34           HE3      LYS  34   0.232   7.094   4.688
  236    HE3  LYS  34           HE2      LYS  34  -0.150   8.419   3.590
  237    HZ1  LYS  34           HZ1      LYS  34  -0.841   5.695   3.371
  238    HZ2  LYS  34           HZ2      LYS  34   0.116   6.131   2.041
  239    HZ3  LYS  34           HZ3      LYS  34  -1.308   6.994   2.381
  240    H    SER  35           H        SER  35   4.367   7.208   7.166
  241    HA   SER  35           HA       SER  35   6.501   5.229   6.492
  242    HB2  SER  35           HB3      SER  35   5.270   5.861   9.188
  243    HB3  SER  35           HB2      SER  35   6.562   4.702   8.891
  244    HG   SER  35           HG       SER  35   7.785   6.489   8.049
  245    H    GLY  36           H        GLY  36   5.905   3.042   6.383
  246    HA2  GLY  36           HA3      GLY  36   3.136   2.348   7.163
  247    HA3  GLY  36           HA2      GLY  36   3.615   2.065   5.489
  248    H    TYR  37           H        TYR  37   2.760  -0.025   7.074
  249    HA   TYR  37           HA       TYR  37   5.272  -1.613   7.372
  250    HB2  TYR  37           HB3      TYR  37   2.839  -1.948   9.145
  251    HB3  TYR  37           HB2      TYR  37   4.433  -2.672   9.354
  252    HD1  TYR  37           HD1      TYR  37   6.432  -1.089   9.735
  253    HD2  TYR  37           HD2      TYR  37   2.329   0.133  10.112
  254    HE1  TYR  37           HE1      TYR  37   7.139   0.872  11.079
  255    HE2  TYR  37           HE2      TYR  37   3.038   2.095  11.456
  256    HH   TYR  37           HH       TYR  37   4.893   3.405  11.956
  257    H    CYS  38           H        CYS  38   4.848  -3.980   7.037
  258    HA   CYS  38           HA       CYS  38   2.638  -4.337   5.085
  259    HB2  CYS  38           HB3      CYS  38   4.878  -4.957   4.311
  260    HB3  CYS  38           HB2      CYS  38   5.055  -6.068   5.671
  261    H    GLN  39           H        GLN  39   0.832  -5.299   5.784
  262    HA   GLN  39           HA       GLN  39   1.006  -7.129   8.144
  263    HB2  GLN  39           HB3      GLN  39  -1.295  -5.386   7.207
  264    HB3  GLN  39           HB2      GLN  39  -1.348  -6.482   8.591
  265    HG2  GLN  39           HG3      GLN  39   0.543  -5.242   9.620
  266    HG3  GLN  39           HG2      GLN  39   0.519  -4.115   8.264
  267   HE21  GLN  39          HE22      GLN  39  -2.658  -4.884   8.611
  268   HE22  GLN  39          HE21      GLN  39  -3.139  -3.679   9.705
  269    H    ILE  40           H        ILE  40  -1.005  -8.703   8.095
  270    HA   ILE  40           HA       ILE  40  -0.975  -9.941   5.394
  271    HB   ILE  40           HB       ILE  40  -1.715 -11.979   6.521
  272   HG12  ILE  40          HG13      ILE  40  -1.739 -10.279   9.038
  273   HG13  ILE  40          HG12      ILE  40  -3.174 -10.888   8.213
  274   HG21  ILE  40          HG21      ILE  40   0.374 -12.441   7.281
  275   HG22  ILE  40          HG22      ILE  40   0.331 -11.135   8.465
  276   HG23  ILE  40          HG23      ILE  40   0.747 -10.790   6.787
  277   HD11  ILE  40          HD11      ILE  40  -2.950 -12.635   9.659
  278   HD12  ILE  40          HD12      ILE  40  -1.236 -12.320   9.931
  279   HD13  ILE  40          HD13      ILE  40  -1.754 -13.190   8.488
  280    H    LEU  41           H        LEU  41  -2.978 -10.726   4.466
  281    HA   LEU  41           HA       LEU  41  -5.181  -8.869   4.853
  282    HB2  LEU  41           HB3      LEU  41  -5.021 -11.368   3.145
  283    HB3  LEU  41           HB2      LEU  41  -6.223 -10.088   3.008
  284    HG   LEU  41           HG       LEU  41  -3.240  -9.769   2.585
  285   HD11  LEU  41          HD11      LEU  41  -5.123 -10.797   0.852
  286   HD12  LEU  41          HD12      LEU  41  -3.622 -10.011   0.361
  287   HD13  LEU  41          HD13      LEU  41  -5.120  -9.083   0.431
  288   HD21  LEU  41          HD21      LEU  41  -5.531  -7.843   2.785
  289   HD22  LEU  41          HD22      LEU  41  -4.220  -7.489   1.658
  290   HD23  LEU  41          HD23      LEU  41  -3.878  -7.676   3.378
  291    H    GLY  42           H        GLY  42  -7.288  -9.418   5.632
  292    HA2  GLY  42           HA3      GLY  42  -7.463 -11.114   7.863
  293    HA3  GLY  42           HA2      GLY  42  -8.863 -10.613   6.911
  294    H    THR  43           H        THR  43  -7.993 -11.841   4.447
  295    HA   THR  43           HA       THR  43  -8.633 -14.658   5.118
  296    HB   THR  43           HB       THR  43  -9.058 -14.866   2.663
  297    HG1  THR  43           HG1      THR  43  -7.530 -12.958   2.359
  298   HG21  THR  43          HG21      THR  43 -10.712 -12.563   3.032
  299   HG22  THR  43          HG22      THR  43 -10.532 -13.369   4.592
  300   HG23  THR  43          HG23      THR  43 -11.152 -14.263   3.203
  301    H    TYR  44           H        TYR  44  -7.294 -14.801   2.158
  302    HA   TYR  44           HA       TYR  44  -4.601 -15.477   3.273
  303    HB2  TYR  44           HB3      TYR  44  -5.981 -16.504   0.771
  304    HB3  TYR  44           HB2      TYR  44  -4.381 -16.992   1.332
  305    HD1  TYR  44           HD2      TYR  44  -4.161 -18.111   3.601
  306    HD2  TYR  44           HD1      TYR  44  -7.948 -17.483   1.674
  307    HE1  TYR  44           HE2      TYR  44  -5.196 -19.812   5.081
  308    HE2  TYR  44           HE1      TYR  44  -8.983 -19.184   3.152
  309    HH   TYR  44           HH       TYR  44  -7.555 -21.420   4.660
  310    H    GLY  45           H        GLY  45  -2.941 -14.202   2.609
  311    HA2  GLY  45           HA3      GLY  45  -2.019 -13.317   0.295
  312    HA3  GLY  45           HA2      GLY  45  -3.454 -12.296   0.386
  313    H    ASN  46           H        ASN  46  -1.501 -10.686   0.315
  314    HA   ASN  46           HA       ASN  46  -0.984  -9.874   3.117
  315    HB2  ASN  46           HB3      ASN  46   1.021 -11.118   2.227
  316    HB3  ASN  46           HB2      ASN  46   1.174  -9.866   0.994
  317   HD21  ASN  46          HD22      ASN  46   3.110 -10.432   3.173
  318   HD22  ASN  46          HD21      ASN  46   3.214  -9.012   4.096
  319    H    GLY  47           H        GLY  47  -0.713  -7.586   3.357
  320    HA2  GLY  47           HA3      GLY  47  -1.066  -5.963   0.889
  321    HA3  GLY  47           HA2      GLY  47  -2.217  -5.755   2.209
  322    H    CYS  48           H        CYS  48  -0.715  -3.575   1.420
  323    HA   CYS  48           HA       CYS  48   1.480  -3.372   3.409
  324    HB2  CYS  48           HB3      CYS  48   0.831  -1.983   0.857
  325    HB3  CYS  48           HB2      CYS  48   1.659  -1.046   2.099
  326    H    TRP  49           H        TRP  49   1.488  -1.637   4.929
  327    HA   TRP  49           HA       TRP  49  -1.167  -0.325   5.327
  328    HB2  TRP  49           HB3      TRP  49  -0.276  -2.174   6.984
  329    HB3  TRP  49           HB2      TRP  49   0.739  -0.864   7.583
  330    HD1  TRP  49           HD1      TRP  49  -0.403   1.087   8.889
  331    HE1  TRP  49           HE1      TRP  49  -2.768   1.410   9.866
  332    HE3  TRP  49           HE3      TRP  49  -2.834  -2.757   6.579
  333    HZ2  TRP  49           HZ2      TRP  49  -5.353   0.191   9.689
  334    HZ3  TRP  49           HZ3      TRP  49  -5.242  -3.157   6.999
  335    HH2  TRP  49           HH2      TRP  49  -6.504  -1.692   8.550
  336    H    CYS  50           H        CYS  50  -1.014   1.874   5.084
  337    HA   CYS  50           HA       CYS  50   1.632   3.148   5.688
  338    HB2  CYS  50           HB3      CYS  50  -0.410   3.733   3.556
  339    HB3  CYS  50           HB2      CYS  50   0.739   4.963   4.075
  340    H    ILE  51           H        ILE  51   1.623   4.685   7.256
  341    HA   ILE  51           HA       ILE  51  -1.006   5.843   8.062
  342    HB   ILE  51           HB       ILE  51   1.239   4.918   9.872
  343   HG12  ILE  51          HG13      ILE  51  -1.588   3.956  10.031
  344   HG13  ILE  51          HG12      ILE  51  -0.582   3.335   8.724
  345   HG21  ILE  51          HG21      ILE  51  -0.511   5.516  11.653
  346   HG22  ILE  51          HG22      ILE  51  -1.328   6.431  10.387
  347   HG23  ILE  51          HG23      ILE  51   0.308   6.870  10.874
  348   HD11  ILE  51          HD11      ILE  51   0.964   2.362  10.207
  349   HD12  ILE  51          HD12      ILE  51  -0.589   2.048  10.981
  350   HD13  ILE  51          HD13      ILE  51   0.433   3.364  11.559
  351    H    ALA  52           H        ALA  52  -0.990   8.004   8.696
  352    HA   ALA  52           HA       ALA  52   1.262   9.590   9.322
  353    HB1  ALA  52           HB1      ALA  52   0.605   9.423   6.381
  354    HB2  ALA  52           HB2      ALA  52   2.186   9.312   7.160
  355    HB3  ALA  52           HB3      ALA  52   1.353  10.863   7.072
  356    H    LEU  53           H        LEU  53  -1.956   9.251   8.075
  357    HA   LEU  53           HA       LEU  53  -2.745  11.723   9.466
  358    HB2  LEU  53           HB3      LEU  53  -2.151  12.462   7.165
  359    HB3  LEU  53           HB2      LEU  53  -3.306  11.302   6.511
  360    HG   LEU  53           HG       LEU  53  -5.035  12.526   8.042
  361   HD11  LEU  53          HD11      LEU  53  -2.811  13.908   8.854
  362   HD12  LEU  53          HD12      LEU  53  -4.456  14.526   8.977
  363   HD13  LEU  53          HD13      LEU  53  -3.446  14.978   7.605
  364   HD21  LEU  53          HD21      LEU  53  -5.590  12.917   5.871
  365   HD22  LEU  53          HD22      LEU  53  -3.915  13.205   5.399
  366   HD23  LEU  53          HD23      LEU  53  -4.854  14.497   6.146
  367    HA   PRO  54           HA       PRO  54  -6.098   9.035  10.750
  368    HB2  PRO  54           HB2      PRO  54  -7.708  11.505  10.193
  369    HB3  PRO  54           HB3      PRO  54  -7.761  10.422  11.597
  370    HG2  PRO  54           HG3      PRO  54  -6.492  12.789  11.648
  371    HG3  PRO  54           HG2      PRO  54  -5.949  11.389  12.585
  372    HD2  PRO  54           HD3      PRO  54  -4.670  12.656  10.264
  373    HD3  PRO  54           HD2      PRO  54  -3.986  11.508  11.430
  374    H    ASP  55           H        ASP  55  -8.017   8.030   9.795
  375    HA   ASP  55           HA       ASP  55  -7.896   7.962   6.880
  376    HB2  ASP  55           HB3      ASP  55  -8.311   5.930   8.276
  377    HB3  ASP  55           HB2      ASP  55  -9.871   6.609   8.741
  378    H    ASN  56           H        ASN  56  -8.925   9.440   5.663
  379    HA   ASN  56           HA       ASN  56 -11.711  10.160   6.310
  380    HB2  ASN  56           HB3      ASN  56  -9.544  12.240   5.875
  381    HB3  ASN  56           HB2      ASN  56 -11.267  12.575   6.045
  382   HD21  ASN  56          HD22      ASN  56  -8.755  13.155   7.830
  383   HD22  ASN  56          HD21      ASN  56  -9.259  12.655   9.371
  384    H    VAL  57           H        VAL  57  -8.967  10.682   4.114
  385    HA   VAL  57           HA       VAL  57 -10.839  10.272   1.829
  386    HB   VAL  57           HB       VAL  57  -8.488  12.184   1.833
  387   HG11  VAL  57          HG11      VAL  57  -9.817  10.973  -0.264
  388   HG12  VAL  57          HG12      VAL  57  -8.928  12.492  -0.370
  389   HG13  VAL  57          HG13      VAL  57 -10.671  12.508  -0.105
  390   HG21  VAL  57          HG21      VAL  57 -11.444  12.634   2.299
  391   HG22  VAL  57          HG22      VAL  57 -10.374  13.923   1.746
  392   HG23  VAL  57          HG23      VAL  57 -10.094  13.154   3.309
  393    HA   PRO  58           HA       PRO  58  -7.160   7.440   1.685
  394    HB2  PRO  58           HB2      PRO  58  -8.496   5.084   1.690
  395    HB3  PRO  58           HB3      PRO  58  -8.139   5.972   3.182
  396    HG2  PRO  58           HG3      PRO  58 -10.683   5.787   1.657
  397    HG3  PRO  58           HG2      PRO  58 -10.413   5.834   3.408
  398    HD2  PRO  58           HD3      PRO  58 -11.189   8.021   1.870
  399    HD3  PRO  58           HD2      PRO  58 -10.416   8.129   3.466
  400    H    ILE  59           H        ILE  59  -9.429   5.324   0.202
  401    HA   ILE  59           HA       ILE  59  -8.668   6.320  -2.498
  402    HB   ILE  59           HB       ILE  59  -8.932   3.671  -2.969
  403   HG12  ILE  59          HG13      ILE  59  -7.671   2.478  -1.159
  404   HG13  ILE  59          HG12      ILE  59  -7.810   3.916  -0.153
  405   HG21  ILE  59          HG21      ILE  59  -6.539   5.309  -2.146
  406   HG22  ILE  59          HG22      ILE  59  -7.032   4.815  -3.766
  407   HG23  ILE  59          HG23      ILE  59  -6.363   3.627  -2.648
  408   HD11  ILE  59          HD11      ILE  59 -10.261   2.656  -1.371
  409   HD12  ILE  59          HD12      ILE  59 -10.146   3.695   0.050
  410   HD13  ILE  59          HD13      ILE  59  -9.581   2.027   0.129
  411    H    ARG  60           H        ARG  60 -10.405   6.712  -3.747
  412    HA   ARG  60           HA       ARG  60 -13.081   6.313  -2.843
  413    HB2  ARG  60           HB3      ARG  60 -12.032   6.745  -5.655
  414    HB3  ARG  60           HB2      ARG  60 -13.713   6.938  -5.154
  415    HG2  ARG  60           HG3      ARG  60 -13.290   9.023  -4.426
  416    HG3  ARG  60           HG2      ARG  60 -12.026   8.414  -3.356
  417    HD2  ARG  60           HD3      ARG  60 -10.397   8.494  -5.169
  418    HD3  ARG  60           HD2      ARG  60 -11.649   8.993  -6.307
  419    HE   ARG  60           HE       ARG  60 -10.308  10.718  -4.377
  420   HH11  ARG  60          HH22      ARG  60 -13.163  10.094  -6.208
  421   HH12  ARG  60          HH21      ARG  60 -13.673  11.749  -6.226
  422   HH21  ARG  60          HH11      ARG  60 -10.958  12.882  -4.390
  423   HH22  ARG  60          HH12      ARG  60 -12.425  13.328  -5.196
  424    H    ILE  61           H        ILE  61 -10.948   4.375  -4.868
  425    HA   ILE  61           HA       ILE  61 -12.889   2.548  -5.866
  426    HB   ILE  61           HB       ILE  61  -9.969   2.047  -5.202
  427   HG12  ILE  61          HG13      ILE  61 -10.657   2.505  -7.995
  428   HG13  ILE  61          HG12      ILE  61 -11.080   3.889  -6.987
  429   HG21  ILE  61          HG21      ILE  61 -10.072   0.237  -6.773
  430   HG22  ILE  61          HG22      ILE  61 -11.695   0.693  -7.287
  431   HG23  ILE  61          HG23      ILE  61 -11.435   0.022  -5.677
  432   HD11  ILE  61          HD11      ILE  61  -8.373   2.523  -7.047
  433   HD12  ILE  61          HD12      ILE  61  -8.800   3.915  -6.052
  434   HD13  ILE  61          HD13      ILE  61  -8.757   4.068  -7.808
  435    HA   PRO  62           HA       PRO  62 -13.966   0.486  -2.041
  436    HB2  PRO  62           HB2      PRO  62 -14.805  -1.936  -3.108
  437    HB3  PRO  62           HB3      PRO  62 -15.807  -0.480  -2.980
  438    HG2  PRO  62           HG3      PRO  62 -14.375  -1.593  -5.322
  439    HG3  PRO  62           HG2      PRO  62 -15.920  -0.729  -5.240
  440    HD2  PRO  62           HD3      PRO  62 -13.619   0.442  -6.109
  441    HD3  PRO  62           HD2      PRO  62 -14.916   1.352  -5.307
  442    H    GLY  63           H        GLY  63 -11.383  -0.370  -3.980
  443    HA2  GLY  63           HA3      GLY  63  -9.380  -1.381  -3.095
  444    HA3  GLY  63           HA2      GLY  63 -10.366  -2.203  -1.886
  445    H    LYS  64           H        LYS  64 -11.775  -2.330  -4.963
  446    HA   LYS  64           HA       LYS  64 -11.648  -5.160  -5.143
  447    HB2  LYS  64           HB3      LYS  64 -12.527  -4.896  -7.395
  448    HB3  LYS  64           HB2      LYS  64 -13.295  -3.702  -6.348
  449    HG2  LYS  64           HG3      LYS  64 -11.598  -2.021  -7.105
  450    HG3  LYS  64           HG2      LYS  64 -10.979  -3.216  -8.244
  451    HD2  LYS  64           HD3      LYS  64 -13.352  -3.390  -9.160
  452    HD3  LYS  64           HD2      LYS  64 -13.729  -1.959  -8.199
  453    HE2  LYS  64           HE3      LYS  64 -13.084  -0.883 -10.119
  454    HE3  LYS  64           HE2      LYS  64 -11.484  -1.085  -9.407
  455    HZ1  LYS  64           HZ1      LYS  64 -12.779  -2.859 -11.404
  456    HZ2  LYS  64           HZ2      LYS  64 -11.308  -3.204 -10.633
  457    HZ3  LYS  64           HZ3      LYS  64 -11.433  -1.852 -11.654
  458    H    CYS  65           H        CYS  65  -9.484  -2.663  -6.361
  459    HA   CYS  65           HA       CYS  65  -7.377  -2.825  -7.380
  460    HB2  CYS  65           HB3      CYS  65  -7.406  -5.586  -6.121
  461    HB3  CYS  65           HB2      CYS  65  -5.981  -4.702  -6.668
  462    H    HIS  66           H        HIS  66  -9.968  -4.638  -8.355
  463    HA   HIS  66           HA       HIS  66  -8.533  -6.208 -10.401
  464    HB2  HIS  66           HB3      HIS  66 -11.501  -5.850  -9.879
  465    HB3  HIS  66           HB2      HIS  66 -10.803  -6.966 -11.051
  466    HD1  HIS  66           HD1      HIS  66 -11.446  -6.523  -7.415
  467    HD2  HIS  66           HD2      HIS  66  -9.345  -9.172  -9.860
  468    HE1  HIS  66           HE1      HIS  66 -10.864  -8.523  -5.972
  469    HE2  HIS  66           HE2      HIS  66  -9.586 -10.141  -7.449
  Start of MODEL   17
    1    H1   ALA   1           H1       ALA   1  -8.445   9.256   4.283
    2    H2   ALA   1           H2       ALA   1  -7.902   8.403   5.648
    3    H3   ALA   1           H3       ALA   1  -7.462   7.888   4.090
    4    HA   ALA   1           HA       ALA   1  -6.388  10.186   3.857
    5    HB1  ALA   1           HB1      ALA   1  -6.815   9.901   6.835
    6    HB2  ALA   1           HB2      ALA   1  -7.242  11.268   5.805
    7    HB3  ALA   1           HB3      ALA   1  -5.548  10.926   6.160
    8    H    ARG   2           H        ARG   2  -6.278   7.068   5.116
    9    HA   ARG   2           HA       ARG   2  -3.327   7.016   4.715
   10    HB2  ARG   2           HB3      ARG   2  -3.037   5.609   6.685
   11    HB3  ARG   2           HB2      ARG   2  -3.855   7.094   7.166
   12    HG2  ARG   2           HG3      ARG   2  -6.049   5.855   6.885
   13    HG3  ARG   2           HG2      ARG   2  -5.105   4.377   6.698
   14    HD2  ARG   2           HD3      ARG   2  -4.037   4.830   8.912
   15    HD3  ARG   2           HD2      ARG   2  -5.107   6.219   9.106
   16    HE   ARG   2           HE       ARG   2  -5.861   3.424   9.429
   17   HH11  ARG   2          HH22      ARG   2  -6.865   6.610   8.578
   18   HH12  ARG   2          HH21      ARG   2  -8.524   6.343   8.997
   19   HH21  ARG   2          HH11      ARG   2  -8.022   3.056   9.982
   20   HH22  ARG   2          HH12      ARG   2  -9.180   4.331   9.792
   21    H    ASP   3           H        ASP   3  -2.579   4.667   4.430
   22    HA   ASP   3           HA       ASP   3  -4.552   3.255   2.723
   23    HB2  ASP   3           HB3      ASP   3  -1.577   2.824   3.140
   24    HB3  ASP   3           HB2      ASP   3  -2.580   1.900   2.023
   25    H    ALA   4           H        ALA   4  -5.147   1.072   3.153
   26    HA   ALA   4           HA       ALA   4  -4.573   0.192   5.943
   27    HB1  ALA   4           HB1      ALA   4  -6.693  -1.318   5.238
   28    HB2  ALA   4           HB2      ALA   4  -6.971   0.078   4.197
   29    HB3  ALA   4           HB3      ALA   4  -6.860   0.290   5.944
   30    H    TYR   5           H        TYR   5  -5.852  -1.752   3.280
   31    HA   TYR   5           HA       TYR   5  -3.660  -3.696   3.795
   32    HB2  TYR   5           HB3      TYR   5  -6.150  -4.073   2.110
   33    HB3  TYR   5           HB2      TYR   5  -5.083  -5.330   2.737
   34    HD1  TYR   5           HD2      TYR   5  -5.099  -5.940   5.109
   35    HD2  TYR   5           HD1      TYR   5  -7.721  -2.904   3.565
   36    HE1  TYR   5           HE2      TYR   5  -6.437  -6.036   7.195
   37    HE2  TYR   5           HE1      TYR   5  -9.060  -3.004   5.652
   38    HH   TYR   5           HH       TYR   5  -7.986  -4.792   8.443
   39    H    ILE   6           H        ILE   6  -4.021  -1.130   1.852
   40    HA   ILE   6           HA       ILE   6  -2.751  -2.473  -0.492
   41    HB   ILE   6           HB       ILE   6  -3.622  -0.643  -1.864
   42   HG12  ILE   6          HG13      ILE   6  -4.932   0.346   0.689
   43   HG13  ILE   6          HG12      ILE   6  -3.539   1.108  -0.080
   44   HG21  ILE   6          HG21      ILE   6  -5.035  -2.722  -1.044
   45   HG22  ILE   6          HG22      ILE   6  -5.806  -1.433  -1.968
   46   HG23  ILE   6          HG23      ILE   6  -5.980  -1.485  -0.215
   47   HD11  ILE   6          HD11      ILE   6  -4.965   1.247  -2.198
   48   HD12  ILE   6          HD12      ILE   6  -5.429   2.316  -0.875
   49   HD13  ILE   6          HD13      ILE   6  -6.341   0.838  -1.175
   50    H    ALA   7           H        ALA   7  -1.089  -1.218  -1.598
   51    HA   ALA   7           HA       ALA   7   0.288   0.737   0.189
   52    HB1  ALA   7           HB1      ALA   7   2.367  -0.236  -0.264
   53    HB2  ALA   7           HB2      ALA   7   1.791  -1.008  -1.742
   54    HB3  ALA   7           HB3      ALA   7   1.321  -1.653  -0.168
   55    H    LYS   8           H        LYS   8  -0.905  -0.063  -2.940
   56    HA   LYS   8           HA       LYS   8   0.184   2.505  -3.998
   57    HB2  LYS   8           HB3      LYS   8  -0.539   0.517  -6.027
   58    HB3  LYS   8           HB2      LYS   8   0.931   1.480  -5.878
   59    HG2  LYS   8           HG3      LYS   8   1.568  -0.104  -3.948
   60    HG3  LYS   8           HG2      LYS   8   0.285  -1.154  -4.550
   61    HD2  LYS   8           HD3      LYS   8   2.514  -0.104  -6.310
   62    HD3  LYS   8           HD2      LYS   8   2.605  -1.648  -5.464
   63    HE2  LYS   8           HE3      LYS   8   0.457  -2.314  -6.580
   64    HE3  LYS   8           HE2      LYS   8   0.543  -0.830  -7.527
   65    HZ1  LYS   8           HZ1      LYS   8   1.497  -2.867  -8.604
   66    HZ2  LYS   8           HZ2      LYS   8   2.738  -2.817  -7.450
   67    HZ3  LYS   8           HZ3      LYS   8   2.538  -1.527  -8.536
   68    HA   PRO   9           HA       PRO   9  -4.038   3.512  -4.821
   69    HB2  PRO   9           HB2      PRO   9  -3.868   5.055  -7.051
   70    HB3  PRO   9           HB3      PRO   9  -3.275   5.590  -5.468
   71    HG2  PRO   9           HG3      PRO   9  -1.762   4.542  -7.801
   72    HG3  PRO   9           HG2      PRO   9  -1.333   5.824  -6.657
   73    HD2  PRO   9           HD3      PRO   9  -0.340   3.246  -6.536
   74    HD3  PRO   9           HD2      PRO   9  -0.432   4.349  -5.146
   75    H    HIS  10           H        HIS  10  -2.726   3.102  -8.122
   76    HA   HIS  10           HA       HIS  10  -5.106   2.076  -9.238
   77    HB2  HIS  10           HB3      HIS  10  -2.250   1.492 -10.074
   78    HB3  HIS  10           HB2      HIS  10  -3.683   1.249 -11.074
   79    HD1  HIS  10           HD1      HIS  10  -5.262   3.757 -10.712
   80    HD2  HIS  10           HD2      HIS  10  -1.102   3.825 -11.012
   81    HE1  HIS  10           HE1      HIS  10  -4.634   6.098 -11.455
   82    HE2  HIS  10           HE2      HIS  10  -2.105   6.150 -11.637
   83    H    ASN  11           H        ASN  11  -2.403   0.338  -7.698
   84    HA   ASN  11           HA       ASN  11  -4.179  -2.063  -7.595
   85    HB2  ASN  11           HB3      ASN  11  -1.203  -2.170  -8.144
   86    HB3  ASN  11           HB2      ASN  11  -2.341  -3.516  -8.170
   87   HD21  ASN  11          HD22      ASN  11  -2.409  -0.210  -9.629
   88   HD22  ASN  11          HD21      ASN  11  -2.759  -0.755 -11.198
   89    H    CYS  12           H        CYS  12  -3.161  -3.717  -5.991
   90    HA   CYS  12           HA       CYS  12  -2.295  -2.194  -3.571
   91    HB2  CYS  12           HB3      CYS  12  -3.468  -4.982  -3.617
   92    HB3  CYS  12           HB2      CYS  12  -3.351  -3.876  -2.250
   93    H    VAL  13           H        VAL  13  -0.911  -3.650  -2.046
   94    HA   VAL  13           HA       VAL  13   1.550  -4.251  -3.229
   95    HB   VAL  13           HB       VAL  13   0.810  -4.176  -0.698
   96   HG11  VAL  13          HG11      VAL  13   0.875  -7.165  -1.132
   97   HG12  VAL  13          HG12      VAL  13  -0.639  -6.259  -1.085
   98   HG13  VAL  13          HG13      VAL  13   0.419  -6.282   0.325
   99   HG21  VAL  13          HG21      VAL  13   2.828  -5.900  -0.313
  100   HG22  VAL  13          HG22      VAL  13   3.100  -4.282  -0.959
  101   HG23  VAL  13          HG23      VAL  13   3.016  -5.665  -2.050
  102    H    TYR  14           H        TYR  14   2.351  -5.995  -4.369
  103    HA   TYR  14           HA       TYR  14   0.483  -7.914  -5.449
  104    HB2  TYR  14           HB3      TYR  14   2.308  -8.749  -6.707
  105    HB3  TYR  14           HB2      TYR  14   2.668  -7.035  -6.510
  106    HD1  TYR  14           HD1      TYR  14   4.276  -6.305  -4.703
  107    HD2  TYR  14           HD2      TYR  14   3.721 -10.427  -5.776
  108    HE1  TYR  14           HE1      TYR  14   6.419  -6.885  -3.594
  109    HE2  TYR  14           HE2      TYR  14   5.862 -11.005  -4.667
  110    HH   TYR  14           HH       TYR  14   7.266  -9.793  -2.641
  111    H    GLU  15           H        GLU  15   3.213  -8.236  -3.168
  112    HA   GLU  15           HA       GLU  15   1.864 -10.091  -1.469
  113    HB2  GLU  15           HB3      GLU  15   2.147 -11.592  -3.466
  114    HB3  GLU  15           HB2      GLU  15   3.890 -11.381  -3.325
  115    HG2  GLU  15           HG3      GLU  15   3.313 -13.429  -2.189
  116    HG3  GLU  15           HG2      GLU  15   3.719 -12.235  -0.957
  117    H    CYS  16           H        CYS  16   2.870  -8.739   0.101
  118    HA   CYS  16           HA       CYS  16   5.594  -8.017   0.195
  119    HB2  CYS  16           HB3      CYS  16   3.740  -7.218   1.735
  120    HB3  CYS  16           HB2      CYS  16   3.921  -8.735   2.617
  121    H    PHE  17           H        PHE  17   7.019  -9.663  -0.353
  122    HA   PHE  17           HA       PHE  17   6.822 -12.323   0.810
  123    HB2  PHE  17           HB3      PHE  17   8.758 -12.843  -0.477
  124    HB3  PHE  17           HB2      PHE  17   7.826 -11.720  -1.466
  125    HD1  PHE  17           HD2      PHE  17   8.436  -9.213  -1.346
  126    HD2  PHE  17           HD1      PHE  17  10.972 -12.343   0.152
  127    HE1  PHE  17           HE2      PHE  17  10.377  -7.674  -1.409
  128    HE2  PHE  17           HE1      PHE  17  12.911 -10.801   0.088
  129    HZ   PHE  17           HZ       PHE  17  12.615  -8.467  -0.694
  130    H    ASP  18           H        ASP  18   8.999  -9.543   1.273
  131    HA   ASP  18           HA       ASP  18   9.510 -10.509   4.020
  132    HB2  ASP  18           HB3      ASP  18  11.334 -11.395   2.488
  133    HB3  ASP  18           HB2      ASP  18  11.786  -9.715   2.191
  134    H    ALA  19           H        ALA  19   8.563  -8.714   4.967
  135    HA   ALA  19           HA       ALA  19   8.729  -6.055   3.960
  136    HB1  ALA  19           HB1      ALA  19   8.580  -6.453   6.910
  137    HB2  ALA  19           HB2      ALA  19   7.302  -7.178   5.933
  138    HB3  ALA  19           HB3      ALA  19   7.590  -5.439   5.858
  139    H    PHE  20           H        PHE  20  10.988  -7.995   5.771
  140    HA   PHE  20           HA       PHE  20  12.585  -6.027   6.999
  141    HB2  PHE  20           HB3      PHE  20  12.959  -8.508   7.157
  142    HB3  PHE  20           HB2      PHE  20  13.612  -8.471   5.519
  143    HD1  PHE  20           HD1      PHE  20  14.120  -7.306   8.999
  144    HD2  PHE  20           HD2      PHE  20  15.801  -7.578   5.056
  145    HE1  PHE  20           HE1      PHE  20  16.330  -6.623   9.894
  146    HE2  PHE  20           HE2      PHE  20  18.011  -6.895   5.951
  147    HZ   PHE  20           HZ       PHE  20  18.275  -6.418   8.371
  148    H    SER  21           H        SER  21  12.562  -7.156   3.629
  149    HA   SER  21           HA       SER  21  14.718  -5.466   2.741
  150    HB2  SER  21           HB3      SER  21  13.960  -5.991   0.502
  151    HB3  SER  21           HB2      SER  21  13.783  -7.448   1.475
  152    HG   SER  21           HG       SER  21  11.609  -7.066   1.627
  153    H    SER  22           H        SER  22  11.493  -4.877   3.676
  154    HA   SER  22           HA       SER  22  10.321  -2.855   3.856
  155    HB2  SER  22           HB3      SER  22  12.257  -1.195   2.395
  156    HB3  SER  22           HB2      SER  22  11.574  -0.974   4.003
  157    HG   SER  22           HG       SER  22  13.390  -1.718   4.728
  158    H    TYR  23           H        TYR  23   9.932  -4.619   1.616
  159    HA   TYR  23           HA       TYR  23   9.927  -3.253  -0.889
  160    HB2  TYR  23           HB3      TYR  23   9.514  -5.692  -0.662
  161    HB3  TYR  23           HB2      TYR  23   7.957  -5.340   0.091
  162    HD1  TYR  23           HD2      TYR  23   6.116  -4.367  -1.197
  163    HD2  TYR  23           HD1      TYR  23   9.884  -5.288  -3.042
  164    HE1  TYR  23           HE2      TYR  23   5.081  -4.113  -3.436
  165    HE2  TYR  23           HE1      TYR  23   8.850  -5.032  -5.282
  166    HH   TYR  23           HH       TYR  23   6.992  -4.081  -6.350
  167    H    CYS  24           H        CYS  24   7.159  -3.799   1.313
  168    HA   CYS  24           HA       CYS  24   5.546  -1.778   0.012
  169    HB2  CYS  24           HB3      CYS  24   4.746  -3.774   1.458
  170    HB3  CYS  24           HB2      CYS  24   5.117  -2.742   2.840
  171    H    ASN  25           H        ASN  25   7.333  -1.889   3.090
  172    HA   ASN  25           HA       ASN  25   6.784   0.765   3.922
  173    HB2  ASN  25           HB3      ASN  25   9.311  -0.863   4.348
  174    HB3  ASN  25           HB2      ASN  25   8.847   0.566   5.273
  175   HD21  ASN  25          HD22      ASN  25   6.039  -1.124   4.466
  176   HD22  ASN  25          HD21      ASN  25   5.857  -2.015   5.899
  177    H    GLY  26           H        GLY  26   9.256  -0.544   1.761
  178    HA2  GLY  26           HA3      GLY  26  10.739   1.868   1.384
  179    HA3  GLY  26           HA2      GLY  26  10.668   0.538   0.226
  180    H    VAL  27           H        VAL  27   7.857   0.569  -0.242
  181    HA   VAL  27           HA       VAL  27   7.681   2.559  -2.281
  182    HB   VAL  27           HB       VAL  27   5.524   0.939  -0.899
  183   HG11  VAL  27          HG11      VAL  27   4.172   2.519  -1.857
  184   HG12  VAL  27          HG12      VAL  27   4.484   1.580  -3.318
  185   HG13  VAL  27          HG13      VAL  27   5.416   3.042  -2.993
  186   HG21  VAL  27          HG21      VAL  27   6.210   0.436  -3.715
  187   HG22  VAL  27          HG22      VAL  27   6.014  -0.707  -2.386
  188   HG23  VAL  27          HG23      VAL  27   7.547   0.140  -2.603
  189    H    CYS  28           H        CYS  28   6.388   2.458   1.029
  190    HA   CYS  28           HA       CYS  28   4.902   4.886   0.898
  191    HB2  CYS  28           HB3      CYS  28   6.232   3.409   3.167
  192    HB3  CYS  28           HB2      CYS  28   5.371   4.924   3.436
  193    H    THR  29           H        THR  29   8.306   4.268   1.716
  194    HA   THR  29           HA       THR  29   9.005   6.908   2.490
  195    HB   THR  29           HB       THR  29  10.738   4.956   0.943
  196    HG1  THR  29           HG1      THR  29   9.575   4.363   3.052
  197   HG21  THR  29          HG21      THR  29  12.410   6.417   1.298
  198   HG22  THR  29          HG22      THR  29  12.028   6.503   3.018
  199   HG23  THR  29          HG23      THR  29  11.211   7.573   1.879
  200    H    LYS  30           H        LYS  30   9.216   5.369  -0.716
  201    HA   LYS  30           HA       LYS  30   9.981   7.781  -2.091
  202    HB2  LYS  30           HB3      LYS  30   8.730   5.193  -3.052
  203    HB3  LYS  30           HB2      LYS  30   9.276   6.475  -4.135
  204    HG2  LYS  30           HG3      LYS  30  11.469   5.970  -3.827
  205    HG3  LYS  30           HG2      LYS  30  11.256   5.702  -2.097
  206    HD2  LYS  30           HD3      LYS  30  10.560   3.476  -2.399
  207    HD3  LYS  30           HD2      LYS  30  10.182   3.730  -4.106
  208    HE2  LYS  30           HE3      LYS  30  12.530   3.913  -4.664
  209    HE3  LYS  30           HE2      LYS  30  12.983   3.894  -2.960
  210    HZ1  LYS  30           HZ1      LYS  30  12.928   1.725  -4.511
  211    HZ2  LYS  30           HZ2      LYS  30  11.369   1.657  -3.844
  212    HZ3  LYS  30           HZ3      LYS  30  12.728   1.683  -2.824
  213    H    ASN  31           H        ASN  31   6.888   6.191  -1.456
  214    HA   ASN  31           HA       ASN  31   5.228   7.855  -3.055
  215    HB2  ASN  31           HB3      ASN  31   4.594   5.710  -1.791
  216    HB3  ASN  31           HB2      ASN  31   4.424   6.733  -0.365
  217   HD21  ASN  31          HD22      ASN  31   2.050   5.850  -0.725
  218   HD22  ASN  31          HD21      ASN  31   1.045   6.818  -1.692
  219    H    GLY  32           H        GLY  32   6.681   8.346   0.103
  220    HA2  GLY  32           HA3      GLY  32   7.123  10.604   0.916
  221    HA3  GLY  32           HA2      GLY  32   5.697  11.157   0.034
  222    H    ALA  33           H        ALA  33   4.839   8.278   1.364
  223    HA   ALA  33           HA       ALA  33   3.071   9.452   3.292
  224    HB1  ALA  33           HB1      ALA  33   3.980   6.616   2.784
  225    HB2  ALA  33           HB2      ALA  33   2.419   7.344   2.407
  226    HB3  ALA  33           HB3      ALA  33   2.857   7.014   4.083
  227    H    LYS  34           H        LYS  34   3.204   9.415   5.595
  228    HA   LYS  34           HA       LYS  34   5.733  10.015   6.719
  229    HB2  LYS  34           HB3      LYS  34   3.524  10.617   7.723
  230    HB3  LYS  34           HB2      LYS  34   3.310   8.926   8.175
  231    HG2  LYS  34           HG3      LYS  34   5.842   9.491   9.142
  232    HG3  LYS  34           HG2      LYS  34   4.974  10.998   9.425
  233    HD2  LYS  34           HD3      LYS  34   3.938   8.269  10.246
  234    HD3  LYS  34           HD2      LYS  34   4.796   9.368  11.326
  235    HE2  LYS  34           HE3      LYS  34   2.258  10.096   9.837
  236    HE3  LYS  34           HE2      LYS  34   2.302   9.551  11.514
  237    HZ1  LYS  34           HZ1      LYS  34   2.686  12.128  10.559
  238    HZ2  LYS  34           HZ2      LYS  34   4.193  11.604  11.132
  239    HZ3  LYS  34           HZ3      LYS  34   2.841  11.580  12.160
  240    H    SER  35           H        SER  35   3.853   6.965   6.950
  241    HA   SER  35           HA       SER  35   6.430   5.545   7.337
  242    HB2  SER  35           HB3      SER  35   4.043   5.229   9.180
  243    HB3  SER  35           HB2      SER  35   5.521   4.271   9.244
  244    HG   SER  35           HG       SER  35   6.171   6.853   9.205
  245    H    GLY  36           H        GLY  36   6.169   3.167   7.076
  246    HA2  GLY  36           HA3      GLY  36   3.704   2.362   5.640
  247    HA3  GLY  36           HA2      GLY  36   5.240   2.182   4.803
  248    H    TYR  37           H        TYR  37   3.060   0.392   6.360
  249    HA   TYR  37           HA       TYR  37   5.137  -1.446   7.487
  250    HB2  TYR  37           HB3      TYR  37   2.319  -1.019   8.512
  251    HB3  TYR  37           HB2      TYR  37   3.496  -2.152   9.174
  252    HD1  TYR  37           HD2      TYR  37   5.520  -1.335  10.335
  253    HD2  TYR  37           HD1      TYR  37   2.497   1.364   8.911
  254    HE1  TYR  37           HE2      TYR  37   6.471   0.471  11.743
  255    HE2  TYR  37           HE1      TYR  37   3.447   3.170  10.320
  256    HH   TYR  37           HH       TYR  37   6.413   3.169  11.555
  257    H    CYS  38           H        CYS  38   5.030  -3.531   6.745
  258    HA   CYS  38           HA       CYS  38   2.757  -4.185   4.917
  259    HB2  CYS  38           HB3      CYS  38   4.336  -4.803   3.447
  260    HB3  CYS  38           HB2      CYS  38   5.598  -4.403   4.612
  261    H    GLN  39           H        GLN  39   1.456  -5.831   5.477
  262    HA   GLN  39           HA       GLN  39   2.432  -7.831   7.464
  263    HB2  GLN  39           HB3      GLN  39  -0.386  -6.754   7.516
  264    HB3  GLN  39           HB2      GLN  39   0.466  -7.655   8.770
  265    HG2  GLN  39           HG3      GLN  39   0.659  -5.512   9.624
  266    HG3  GLN  39           HG2      GLN  39   2.131  -5.594   8.657
  267   HE21  GLN  39          HE22      GLN  39  -1.220  -5.205   7.421
  268   HE22  GLN  39          HE21      GLN  39  -0.946  -3.683   6.722
  269    H    ILE  40           H        ILE  40   0.901  -9.800   7.450
  270    HA   ILE  40           HA       ILE  40   0.202 -10.352   4.615
  271    HB   ILE  40           HB       ILE  40   0.318 -12.698   5.200
  272   HG12  ILE  40          HG13      ILE  40   0.611 -11.715   8.059
  273   HG13  ILE  40          HG12      ILE  40  -0.759 -12.608   7.400
  274   HG21  ILE  40          HG21      ILE  40   2.568 -12.629   5.143
  275   HG22  ILE  40          HG22      ILE  40   2.642 -12.005   6.792
  276   HG23  ILE  40          HG23      ILE  40   2.458 -10.893   5.435
  277   HD11  ILE  40          HD11      ILE  40   0.664 -14.178   8.569
  278   HD12  ILE  40          HD12      ILE  40   2.082 -13.612   7.688
  279   HD13  ILE  40          HD13      ILE  40   0.808 -14.485   6.838
  280    H    LEU  41           H        LEU  41  -1.879 -10.652   3.989
  281    HA   LEU  41           HA       LEU  41  -4.043  -9.893   5.700
  282    HB2  LEU  41           HB3      LEU  41  -4.052  -9.755   3.185
  283    HB3  LEU  41           HB2      LEU  41  -4.211 -11.508   3.140
  284    HG   LEU  41           HG       LEU  41  -6.276 -11.272   4.576
  285   HD11  LEU  41          HD11      LEU  41  -5.395  -8.495   4.502
  286   HD12  LEU  41          HD12      LEU  41  -6.600  -9.258   5.538
  287   HD13  LEU  41          HD13      LEU  41  -7.059  -8.663   3.943
  288   HD21  LEU  41          HD21      LEU  41  -7.170 -11.571   2.525
  289   HD22  LEU  41          HD22      LEU  41  -5.901 -10.609   1.768
  290   HD23  LEU  41          HD23      LEU  41  -7.332  -9.817   2.428
  291    H    GLY  42           H        GLY  42  -2.594 -12.983   4.908
  292    HA2  GLY  42           HA3      GLY  42  -2.792 -14.872   6.452
  293    HA3  GLY  42           HA2      GLY  42  -4.391 -14.274   6.911
  294    H    THR  43           H        THR  43  -4.307 -13.740   3.742
  295    HA   THR  43           HA       THR  43  -5.256 -16.467   2.995
  296    HB   THR  43           HB       THR  43  -7.090 -15.531   1.785
  297    HG1  THR  43           HG1      THR  43  -6.767 -13.685   0.877
  298   HG21  THR  43          HG21      THR  43  -7.241 -13.619   4.039
  299   HG22  THR  43          HG22      THR  43  -6.917 -15.295   4.488
  300   HG23  THR  43          HG23      THR  43  -8.365 -14.892   3.564
  301    H    TYR  44           H        TYR  44  -5.342 -16.556   0.442
  302    HA   TYR  44           HA       TYR  44  -2.790 -16.419  -0.619
  303    HB2  TYR  44           HB3      TYR  44  -3.762 -16.591  -2.786
  304    HB3  TYR  44           HB2      TYR  44  -4.927 -17.354  -1.703
  305    HD1  TYR  44           HD2      TYR  44  -6.965 -16.108  -0.975
  306    HD2  TYR  44           HD1      TYR  44  -4.278 -14.549  -3.941
  307    HE1  TYR  44           HE2      TYR  44  -8.699 -14.486  -1.691
  308    HE2  TYR  44           HE1      TYR  44  -6.010 -12.925  -4.657
  309    HH   TYR  44           HH       TYR  44  -8.698 -12.923  -4.513
  310    H    GLY  45           H        GLY  45  -4.923 -13.767   0.039
  311    HA2  GLY  45           HA3      GLY  45  -3.433 -11.893  -1.681
  312    HA3  GLY  45           HA2      GLY  45  -4.799 -11.483  -0.642
  313    H    ASN  46           H        ASN  46  -3.084  -9.656  -0.255
  314    HA   ASN  46           HA       ASN  46  -1.619 -10.379   2.227
  315    HB2  ASN  46           HB3      ASN  46  -0.117 -10.215   0.111
  316    HB3  ASN  46           HB2      ASN  46  -0.416  -8.480   0.220
  317   HD21  ASN  46          HD22      ASN  46   0.915  -7.326   1.646
  318   HD22  ASN  46          HD21      ASN  46   1.890  -8.034   2.839
  319    H    GLY  47           H        GLY  47  -0.988  -8.245   3.417
  320    HA2  GLY  47           HA3      GLY  47  -2.915  -6.062   2.793
  321    HA3  GLY  47           HA2      GLY  47  -2.945  -6.779   4.402
  322    H    CYS  48           H        CYS  48  -1.893  -4.136   2.878
  323    HA   CYS  48           HA       CYS  48   0.372  -3.793   4.781
  324    HB2  CYS  48           HB3      CYS  48   1.272  -4.276   2.493
  325    HB3  CYS  48           HB2      CYS  48   0.393  -2.871   1.889
  326    H    TRP  49           H        TRP  49   0.106  -1.898   5.948
  327    HA   TRP  49           HA       TRP  49  -1.823   0.089   4.822
  328    HB2  TRP  49           HB3      TRP  49  -2.451   0.706   7.062
  329    HB3  TRP  49           HB2      TRP  49  -2.557  -1.043   6.946
  330    HD1  TRP  49           HD1      TRP  49   0.050   1.601   8.077
  331    HE1  TRP  49           HE1      TRP  49   1.307   0.640  10.110
  332    HE3  TRP  49           HE3      TRP  49  -2.132  -3.005   8.369
  333    HZ2  TRP  49           HZ2      TRP  49   1.376  -1.763  11.661
  334    HZ3  TRP  49           HZ3      TRP  49  -1.459  -4.607  10.133
  335    HH2  TRP  49           HH2      TRP  49   0.291  -3.992  11.781
  336    H    CYS  50           H        CYS  50  -1.243   2.223   4.756
  337    HA   CYS  50           HA       CYS  50   1.515   2.896   5.692
  338    HB2  CYS  50           HB3      CYS  50   1.095   2.650   3.123
  339    HB3  CYS  50           HB2      CYS  50   0.240   4.183   3.284
  340    H    ILE  51           H        ILE  51   1.767   5.125   6.387
  341    HA   ILE  51           HA       ILE  51  -0.832   6.366   7.172
  342    HB   ILE  51           HB       ILE  51   1.903   6.848   8.386
  343   HG12  ILE  51          HG13      ILE  51   1.362   4.535   8.799
  344   HG13  ILE  51          HG12      ILE  51   0.979   5.422  10.274
  345   HG21  ILE  51          HG21      ILE  51  -0.353   8.371   8.557
  346   HG22  ILE  51          HG22      ILE  51   0.858   8.263   9.835
  347   HG23  ILE  51          HG23      ILE  51  -0.596   7.268   9.912
  348   HD11  ILE  51          HD11      ILE  51  -1.408   5.629   9.258
  349   HD12  ILE  51          HD12      ILE  51  -0.927   4.083   9.955
  350   HD13  ILE  51          HD13      ILE  51  -0.905   4.306   8.207
  351    H    ALA  52           H        ALA  52  -1.334   8.275   6.205
  352    HA   ALA  52           HA       ALA  52   0.614  10.303   5.600
  353    HB1  ALA  52           HB1      ALA  52   0.755  10.158   3.229
  354    HB2  ALA  52           HB2      ALA  52  -0.528   8.950   3.152
  355    HB3  ALA  52           HB3      ALA  52   1.049   8.521   3.811
  356    H    LEU  53           H        LEU  53  -1.244  10.706   3.037
  357    HA   LEU  53           HA       LEU  53  -3.550  11.867   4.556
  358    HB2  LEU  53           HB3      LEU  53  -3.147  13.417   2.242
  359    HB3  LEU  53           HB2      LEU  53  -2.823  13.901   3.908
  360    HG   LEU  53           HG       LEU  53  -0.865  12.344   2.209
  361   HD11  LEU  53          HD11      LEU  53  -0.435  14.257   1.103
  362   HD12  LEU  53          HD12      LEU  53   0.066  14.974   2.634
  363   HD13  LEU  53          HD13      LEU  53  -1.604  15.137   2.090
  364   HD21  LEU  53          HD21      LEU  53  -0.997  13.059   4.981
  365   HD22  LEU  53          HD22      LEU  53   0.322  13.966   4.241
  366   HD23  LEU  53          HD23      LEU  53   0.296  12.206   4.138
  367    HA   PRO  54           HA       PRO  54  -6.222   9.992   1.601
  368    HB2  PRO  54           HB2      PRO  54  -7.994  12.009   0.984
  369    HB3  PRO  54           HB3      PRO  54  -8.046  11.054   2.477
  370    HG2  PRO  54           HG3      PRO  54  -7.025  13.797   2.018
  371    HG3  PRO  54           HG2      PRO  54  -7.825  13.108   3.439
  372    HD2  PRO  54           HD3      PRO  54  -5.118  13.551   3.284
  373    HD3  PRO  54           HD2      PRO  54  -5.851  12.321   4.329
  374    H    ASP  55           H        ASP  55  -4.992  13.155   0.595
  375    HA   ASP  55           HA       ASP  55  -5.650  13.028  -2.158
  376    HB2  ASP  55           HB3      ASP  55  -4.615  14.998  -0.943
  377    HB3  ASP  55           HB2      ASP  55  -3.072  14.147  -1.022
  378    H    ASN  56           H        ASN  56  -3.082  11.505  -0.309
  379    HA   ASN  56           HA       ASN  56  -1.931  10.325  -2.769
  380    HB2  ASN  56           HB3      ASN  56  -0.517  11.326  -0.881
  381    HB3  ASN  56           HB2      ASN  56  -0.989   9.920   0.074
  382   HD21  ASN  56          HD22      ASN  56   1.681  10.022  -0.354
  383   HD22  ASN  56          HD21      ASN  56   2.172   8.949  -1.574
  384    H    VAL  57           H        VAL  57  -2.707   8.372  -3.416
  385    HA   VAL  57           HA       VAL  57  -3.699   6.248  -3.326
  386    HB   VAL  57           HB       VAL  57  -2.734   6.151  -0.463
  387   HG11  VAL  57          HG11      VAL  57  -2.373   3.750  -1.094
  388   HG12  VAL  57          HG12      VAL  57  -3.109   4.092  -2.659
  389   HG13  VAL  57          HG13      VAL  57  -4.063   4.246  -1.184
  390   HG21  VAL  57          HG21      VAL  57  -0.681   6.652  -1.305
  391   HG22  VAL  57          HG22      VAL  57  -1.207   6.407  -2.970
  392   HG23  VAL  57          HG23      VAL  57  -0.734   5.025  -1.983
  393    HA   PRO  58           HA       PRO  58  -7.224   8.000  -0.807
  394    HB2  PRO  58           HB2      PRO  58  -8.873   8.643  -2.857
  395    HB3  PRO  58           HB3      PRO  58  -7.593   9.737  -2.294
  396    HG2  PRO  58           HG3      PRO  58  -7.643   7.942  -4.665
  397    HG3  PRO  58           HG2      PRO  58  -6.973   9.574  -4.496
  398    HD2  PRO  58           HD3      PRO  58  -5.457   7.255  -4.413
  399    HD3  PRO  58           HD2      PRO  58  -4.963   8.801  -3.688
  400    H    ILE  59           H        ILE  59  -6.534   5.248  -2.280
  401    HA   ILE  59           HA       ILE  59  -7.638   3.199  -2.597
  402    HB   ILE  59           HB       ILE  59  -9.600   4.515  -0.689
  403   HG12  ILE  59          HG13      ILE  59  -7.550   2.404  -0.028
  404   HG13  ILE  59          HG12      ILE  59  -7.109   4.113  -0.032
  405   HG21  ILE  59          HG21      ILE  59  -9.630   1.966  -2.107
  406   HG22  ILE  59          HG22      ILE  59 -10.897   2.726  -1.145
  407   HG23  ILE  59          HG23      ILE  59  -9.660   1.747  -0.357
  408   HD11  ILE  59          HD11      ILE  59  -8.884   4.596   1.588
  409   HD12  ILE  59          HD12      ILE  59  -7.815   3.346   2.221
  410   HD13  ILE  59          HD13      ILE  59  -9.390   2.907   1.561
  411    H    ARG  60           H        ARG  60  -8.018   4.821  -4.729
  412    HA   ARG  60           HA       ARG  60 -10.712   5.523  -5.349
  413    HB2  ARG  60           HB3      ARG  60  -9.978   5.626  -7.661
  414    HB3  ARG  60           HB2      ARG  60  -8.685   6.256  -6.638
  415    HG2  ARG  60           HG3      ARG  60  -7.650   3.958  -6.664
  416    HG3  ARG  60           HG2      ARG  60  -8.858   3.489  -7.861
  417    HD2  ARG  60           HD3      ARG  60  -6.836   5.729  -8.165
  418    HD3  ARG  60           HD2      ARG  60  -6.777   4.165  -8.974
  419    HE   ARG  60           HE       ARG  60  -8.570   4.861 -10.395
  420   HH11  ARG  60          HH22      ARG  60  -7.818   7.128  -7.897
  421   HH12  ARG  60          HH21      ARG  60  -8.731   8.412  -8.612
  422   HH21  ARG  60          HH11      ARG  60  -9.763   6.530 -11.332
  423   HH22  ARG  60          HH12      ARG  60  -9.832   8.075 -10.552
  424    H    ILE  61           H        ILE  61  -8.900   2.513  -5.803
  425    HA   ILE  61           HA       ILE  61 -11.062   1.184  -7.212
  426    HB   ILE  61           HB       ILE  61  -9.621  -0.895  -6.393
  427   HG12  ILE  61          HG13      ILE  61  -7.490   1.219  -6.297
  428   HG13  ILE  61          HG12      ILE  61  -8.396   0.848  -4.830
  429   HG21  ILE  61          HG21      ILE  61  -9.596  -0.448  -8.686
  430   HG22  ILE  61          HG22      ILE  61  -7.910  -0.162  -8.251
  431   HG23  ILE  61          HG23      ILE  61  -9.012   1.200  -8.459
  432   HD11  ILE  61          HD11      ILE  61  -7.571  -1.314  -4.698
  433   HD12  ILE  61          HD12      ILE  61  -6.188  -0.493  -5.425
  434   HD13  ILE  61          HD13      ILE  61  -7.292  -1.425  -6.437
  435    HA   PRO  62           HA       PRO  62 -13.670  -0.045  -3.877
  436    HB2  PRO  62           HB2      PRO  62 -14.111  -2.720  -4.556
  437    HB3  PRO  62           HB3      PRO  62 -15.011  -1.334  -5.199
  438    HG2  PRO  62           HG3      PRO  62 -12.793  -2.879  -6.416
  439    HG3  PRO  62           HG2      PRO  62 -14.193  -2.109  -7.181
  440    HD2  PRO  62           HD3      PRO  62 -11.705  -1.026  -7.306
  441    HD3  PRO  62           HD2      PRO  62 -13.174  -0.025  -7.269
  442    H    GLY  63           H        GLY  63 -10.644  -1.531  -4.404
  443    HA2  GLY  63           HA3      GLY  63  -9.194  -2.150  -2.569
  444    HA3  GLY  63           HA2      GLY  63 -10.625  -2.492  -1.597
  445    H    LYS  64           H        LYS  64 -11.162  -3.712  -4.639
  446    HA   LYS  64           HA       LYS  64 -11.171  -6.428  -3.829
  447    HB2  LYS  64           HB3      LYS  64 -12.375  -5.522  -5.825
  448    HB3  LYS  64           HB2      LYS  64 -10.823  -5.368  -6.650
  449    HG2  LYS  64           HG3      LYS  64 -10.444  -7.778  -6.455
  450    HG3  LYS  64           HG2      LYS  64 -11.946  -7.961  -5.549
  451    HD2  LYS  64           HD3      LYS  64 -12.388  -8.566  -7.852
  452    HD3  LYS  64           HD2      LYS  64 -13.176  -7.021  -7.533
  453    HE2  LYS  64           HE3      LYS  64 -11.589  -5.810  -8.760
  454    HE3  LYS  64           HE2      LYS  64 -10.375  -7.082  -8.629
  455    HZ1  LYS  64           HZ1      LYS  64 -11.939  -8.477  -9.998
  456    HZ2  LYS  64           HZ2      LYS  64 -11.193  -7.189 -10.811
  457    HZ3  LYS  64           HZ3      LYS  64 -12.811  -7.053 -10.312
  458    H    CYS  65           H        CYS  65  -8.652  -4.483  -5.374
  459    HA   CYS  65           HA       CYS  65  -6.387  -4.949  -5.774
  460    HB2  CYS  65           HB3      CYS  65  -6.842  -6.873  -3.472
  461    HB3  CYS  65           HB2      CYS  65  -5.271  -6.325  -4.056
  462    H    HIS  66           H        HIS  66  -7.229  -8.219  -4.670
  463    HA   HIS  66           HA       HIS  66  -7.566  -9.327  -7.305
  464    HB2  HIS  66           HB3      HIS  66  -5.129  -8.758  -7.398
  465    HB3  HIS  66           HB2      HIS  66  -4.866  -9.820  -6.015
  466    HD1  HIS  66           HD1      HIS  66  -6.526 -10.083  -9.451
  467    HD2  HIS  66           HD2      HIS  66  -4.271 -12.392  -6.808
  468    HE1  HIS  66           HE1      HIS  66  -6.126 -12.307 -10.602
  469    HE2  HIS  66           HE2      HIS  66  -4.755 -13.719  -9.002
  Start of MODEL   18
    1    H1   ALA   1           H1       ALA   1  -3.351  10.158   3.189
    2    H2   ALA   1           H2       ALA   1  -4.651  11.245   3.067
    3    H3   ALA   1           H3       ALA   1  -4.270  10.223   1.764
    4    HA   ALA   1           HA       ALA   1  -5.896   9.717   4.061
    5    HB1  ALA   1           HB1      ALA   1  -5.451   8.684   1.293
    6    HB2  ALA   1           HB2      ALA   1  -6.947   9.205   2.069
    7    HB3  ALA   1           HB3      ALA   1  -6.266   7.620   2.438
    8    H    ARG   2           H        ARG   2  -5.973   6.957   4.136
    9    HA   ARG   2           HA       ARG   2  -3.237   6.203   5.085
   10    HB2  ARG   2           HB3      ARG   2  -4.716   6.710   6.999
   11    HB3  ARG   2           HB2      ARG   2  -5.887   5.534   6.401
   12    HG2  ARG   2           HG3      ARG   2  -4.241   3.734   6.640
   13    HG3  ARG   2           HG2      ARG   2  -3.025   4.894   7.173
   14    HD2  ARG   2           HD3      ARG   2  -3.964   3.840   9.140
   15    HD3  ARG   2           HD2      ARG   2  -4.542   5.504   9.083
   16    HE   ARG   2           HE       ARG   2  -6.404   3.764   7.749
   17   HH11  ARG   2          HH22      ARG   2  -5.180   4.714  10.829
   18   HH12  ARG   2          HH21      ARG   2  -6.650   4.358  11.672
   19   HH21  ARG   2          HH11      ARG   2  -8.332   3.294   8.833
   20   HH22  ARG   2          HH12      ARG   2  -8.434   3.554  10.541
   21    H    ASP   3           H        ASP   3  -2.557   4.178   4.447
   22    HA   ASP   3           HA       ASP   3  -4.389   2.659   2.677
   23    HB2  ASP   3           HB3      ASP   3  -1.416   2.350   3.191
   24    HB3  ASP   3           HB2      ASP   3  -2.351   1.439   2.009
   25    H    ALA   4           H        ALA   4  -4.952   0.496   3.131
   26    HA   ALA   4           HA       ALA   4  -4.354  -0.385   5.915
   27    HB1  ALA   4           HB1      ALA   4  -6.637  -0.413   5.915
   28    HB2  ALA   4           HB2      ALA   4  -6.402  -1.984   5.148
   29    HB3  ALA   4           HB3      ALA   4  -6.733  -0.560   4.160
   30    H    TYR   5           H        TYR   5  -5.529  -2.363   3.229
   31    HA   TYR   5           HA       TYR   5  -3.248  -4.209   3.724
   32    HB2  TYR   5           HB3      TYR   5  -5.760  -4.670   2.089
   33    HB3  TYR   5           HB2      TYR   5  -4.593  -5.890   2.594
   34    HD1  TYR   5           HD1      TYR   5  -4.284  -6.356   5.067
   35    HD2  TYR   5           HD2      TYR   5  -7.503  -3.957   3.540
   36    HE1  TYR   5           HE1      TYR   5  -5.514  -6.649   7.199
   37    HE2  TYR   5           HE2      TYR   5  -8.733  -4.249   5.673
   38    HH   TYR   5           HH       TYR   5  -8.701  -6.106   7.570
   39    H    ILE   6           H        ILE   6  -3.537  -1.630   1.908
   40    HA   ILE   6           HA       ILE   6  -2.236  -2.887  -0.466
   41    HB   ILE   6           HB       ILE   6  -3.257  -1.166  -1.874
   42   HG12  ILE   6          HG13      ILE   6  -4.641  -0.258   0.670
   43   HG13  ILE   6          HG12      ILE   6  -3.354   0.624  -0.149
   44   HG21  ILE   6          HG21      ILE   6  -4.538  -3.331  -0.784
   45   HG22  ILE   6          HG22      ILE   6  -5.200  -2.330  -2.076
   46   HG23  ILE   6          HG23      ILE   6  -5.662  -2.027  -0.402
   47   HD11  ILE   6          HD11      ILE   6  -5.291   1.641  -0.995
   48   HD12  ILE   6          HD12      ILE   6  -6.169   0.114  -1.078
   49   HD13  ILE   6          HD13      ILE   6  -4.893   0.461  -2.244
   50    H    ALA   7           H        ALA   7  -0.791  -1.297  -1.636
   51    HA   ALA   7           HA       ALA   7   0.464   0.611   0.293
   52    HB1  ALA   7           HB1      ALA   7   2.434  -0.444  -0.012
   53    HB2  ALA   7           HB2      ALA   7   2.313  -0.183  -1.751
   54    HB3  ALA   7           HB3      ALA   7   1.624  -1.634  -1.028
   55    H    LYS   8           H        LYS   8  -1.323   0.352  -2.445
   56    HA   LYS   8           HA       LYS   8  -0.151   2.820  -3.641
   57    HB2  LYS   8           HB3      LYS   8  -1.996   1.424  -5.394
   58    HB3  LYS   8           HB2      LYS   8  -0.322   1.884  -5.689
   59    HG2  LYS   8           HG3      LYS   8  -1.093  -0.554  -4.058
   60    HG3  LYS   8           HG2      LYS   8  -0.779  -0.607  -5.787
   61    HD2  LYS   8           HD3      LYS   8   1.256   0.727  -4.059
   62    HD3  LYS   8           HD2      LYS   8   1.177  -1.036  -4.037
   63    HE2  LYS   8           HE3      LYS   8   1.553  -1.173  -6.395
   64    HE3  LYS   8           HE2      LYS   8   1.290   0.559  -6.605
   65    HZ1  LYS   8           HZ1      LYS   8   3.286   1.044  -5.468
   66    HZ2  LYS   8           HZ2      LYS   8   3.667  -0.170  -6.588
   67    HZ3  LYS   8           HZ3      LYS   8   3.477  -0.561  -4.945
   68    HA   PRO   9           HA       PRO   9  -4.066   4.741  -2.931
   69    HB2  PRO   9           HB2      PRO   9  -4.385   6.375  -5.069
   70    HB3  PRO   9           HB3      PRO   9  -3.123   6.639  -3.850
   71    HG2  PRO   9           HG3      PRO   9  -2.909   5.500  -6.580
   72    HG3  PRO   9           HG2      PRO   9  -1.769   6.516  -5.684
   73    HD2  PRO   9           HD3      PRO   9  -1.558   3.750  -5.975
   74    HD3  PRO   9           HD2      PRO   9  -0.738   4.713  -4.728
   75    H    HIS  10           H        HIS  10  -4.067   4.058  -6.457
   76    HA   HIS  10           HA       HIS  10  -6.886   3.136  -6.170
   77    HB2  HIS  10           HB3      HIS  10  -5.321   3.981  -8.627
   78    HB3  HIS  10           HB2      HIS  10  -7.005   3.454  -8.633
   79    HD1  HIS  10           HD1      HIS  10  -4.791   6.296  -7.550
   80    HD2  HIS  10           HD2      HIS  10  -8.854   5.353  -7.605
   81    HE1  HIS  10           HE1      HIS  10  -6.032   8.435  -6.998
   82    HE2  HIS  10           HE2      HIS  10  -8.505   7.873  -7.027
   83    H    ASN  11           H        ASN  11  -3.801   1.882  -6.343
   84    HA   ASN  11           HA       ASN  11  -4.775  -0.604  -7.699
   85    HB2  ASN  11           HB3      ASN  11  -1.936   0.428  -7.441
   86    HB3  ASN  11           HB2      ASN  11  -2.423  -1.058  -8.259
   87   HD21  ASN  11          HD22      ASN  11  -2.274   2.435  -8.545
   88   HD22  ASN  11          HD21      ASN  11  -2.867   2.522 -10.134
   89    H    CYS  12           H        CYS  12  -3.378  -2.572  -6.867
   90    HA   CYS  12           HA       CYS  12  -3.107  -2.358  -3.893
   91    HB2  CYS  12           HB3      CYS  12  -4.071  -4.644  -3.746
   92    HB3  CYS  12           HB2      CYS  12  -5.214  -3.491  -4.434
   93    H    VAL  13           H        VAL  13  -2.017  -4.605  -3.149
   94    HA   VAL  13           HA       VAL  13   0.445  -4.847  -4.815
   95    HB   VAL  13           HB       VAL  13  -0.020  -5.644  -1.923
   96   HG11  VAL  13          HG11      VAL  13   2.460  -5.510  -3.663
   97   HG12  VAL  13          HG12      VAL  13   1.754  -6.954  -2.936
   98   HG13  VAL  13          HG13      VAL  13   2.494  -5.722  -1.913
   99   HG21  VAL  13          HG21      VAL  13   1.870  -3.520  -2.282
  100   HG22  VAL  13          HG22      VAL  13   0.342  -3.484  -1.403
  101   HG23  VAL  13          HG23      VAL  13   0.380  -3.082  -3.119
  102    H    TYR  14           H        TYR  14   1.012  -6.815  -5.680
  103    HA   TYR  14           HA       TYR  14  -0.969  -8.882  -5.886
  104    HB2  TYR  14           HB3      TYR  14   0.658 -10.092  -7.162
  105    HB3  TYR  14           HB2      TYR  14   0.908  -8.387  -7.537
  106    HD1  TYR  14           HD1      TYR  14   2.783  -7.129  -6.469
  107    HD2  TYR  14           HD2      TYR  14   2.322 -11.373  -5.995
  108    HE1  TYR  14           HE1      TYR  14   5.130  -7.295  -5.685
  109    HE2  TYR  14           HE2      TYR  14   4.669 -11.540  -5.211
  110    HH   TYR  14           HH       TYR  14   6.907  -9.019  -5.567
  111    H    GLU  15           H        GLU  15   1.965  -8.544  -3.913
  112    HA   GLU  15           HA       GLU  15   0.918 -10.166  -1.795
  113    HB2  GLU  15           HB3      GLU  15   1.377 -11.959  -3.516
  114    HB3  GLU  15           HB2      GLU  15   3.082 -11.515  -3.435
  115    HG2  GLU  15           HG3      GLU  15   3.050 -11.966  -0.985
  116    HG3  GLU  15           HG2      GLU  15   1.378 -12.510  -1.134
  117    H    CYS  16           H        CYS  16   1.777  -8.580  -0.421
  118    HA   CYS  16           HA       CYS  16   4.474  -7.579  -0.689
  119    HB2  CYS  16           HB3      CYS  16   2.902  -6.214   0.504
  120    HB3  CYS  16           HB2      CYS  16   2.488  -7.533   1.598
  121    H    PHE  17           H        PHE  17   6.354  -8.297   0.351
  122    HA   PHE  17           HA       PHE  17   6.092 -10.879   1.844
  123    HB2  PHE  17           HB3      PHE  17   7.882 -11.760   0.690
  124    HB3  PHE  17           HB2      PHE  17   7.249 -10.685  -0.553
  125    HD1  PHE  17           HD2      PHE  17   8.166  -8.216  -0.510
  126    HD2  PHE  17           HD1      PHE  17  10.119 -11.568   1.337
  127    HE1  PHE  17           HE2      PHE  17  10.315  -6.979  -0.525
  128    HE2  PHE  17           HE1      PHE  17  12.266 -10.327   1.319
  129    HZ   PHE  17           HZ       PHE  17  12.362  -8.033   0.387
  130    H    ASP  18           H        ASP  18   8.939 -10.864   2.512
  131    HA   ASP  18           HA       ASP  18   8.833  -9.492   4.998
  132    HB2  ASP  18           HB3      ASP  18  11.224 -10.442   3.394
  133    HB3  ASP  18           HB2      ASP  18  11.308  -9.888   5.065
  134    H    ALA  19           H        ALA  19   9.625  -7.483   5.647
  135    HA   ALA  19           HA       ALA  19   9.857  -5.471   3.534
  136    HB1  ALA  19           HB1      ALA  19   9.944  -3.862   5.375
  137    HB2  ALA  19           HB2      ALA  19  10.151  -5.174   6.537
  138    HB3  ALA  19           HB3      ALA  19   8.635  -5.012   5.649
  139    H    PHE  20           H        PHE  20  12.037  -7.640   4.466
  140    HA   PHE  20           HA       PHE  20  14.338  -6.279   5.340
  141    HB2  PHE  20           HB3      PHE  20  14.169  -8.759   4.958
  142    HB3  PHE  20           HB2      PHE  20  14.282  -8.455   3.224
  143    HD1  PHE  20           HD2      PHE  20  16.075  -8.205   6.456
  144    HD2  PHE  20           HD1      PHE  20  16.367  -7.838   2.186
  145    HE1  PHE  20           HE2      PHE  20  18.547  -8.101   6.635
  146    HE2  PHE  20           HE1      PHE  20  18.838  -7.734   2.365
  147    HZ   PHE  20           HZ       PHE  20  19.928  -7.865   4.588
  148    H    SER  21           H        SER  21  13.038  -6.604   2.047
  149    HA   SER  21           HA       SER  21  15.133  -4.837   0.972
  150    HB2  SER  21           HB3      SER  21  14.157  -5.274  -1.177
  151    HB3  SER  21           HB2      SER  21  14.147  -6.804  -0.306
  152    HG   SER  21           HG       SER  21  12.127  -6.035  -1.409
  153    H    SER  22           H        SER  22  12.568  -4.288   2.837
  154    HA   SER  22           HA       SER  22  11.089  -2.500   3.167
  155    HB2  SER  22           HB3      SER  22  12.066  -0.263   2.394
  156    HB3  SER  22           HB2      SER  22  13.052  -1.199   3.511
  157    HG   SER  22           HG       SER  22  14.516  -1.274   2.018
  158    H    TYR  23           H        TYR  23  10.586  -4.117   0.810
  159    HA   TYR  23           HA       TYR  23  10.072  -2.534  -1.508
  160    HB2  TYR  23           HB3      TYR  23  10.018  -4.987  -1.563
  161    HB3  TYR  23           HB2      TYR  23   8.614  -4.996  -0.493
  162    HD1  TYR  23           HD2      TYR  23   9.833  -4.250  -3.891
  163    HD2  TYR  23           HD1      TYR  23   6.419  -4.288  -1.284
  164    HE1  TYR  23           HE2      TYR  23   8.334  -3.987  -5.851
  165    HE2  TYR  23           HE1      TYR  23   4.919  -4.027  -3.244
  166    HH   TYR  23           HH       TYR  23   4.853  -4.247  -5.548
  167    H    CYS  24           H        CYS  24   7.877  -3.496   1.139
  168    HA   CYS  24           HA       CYS  24   5.696  -1.851   0.212
  169    HB2  CYS  24           HB3      CYS  24   5.520  -3.814   1.808
  170    HB3  CYS  24           HB2      CYS  24   6.204  -2.770   3.052
  171    H    ASN  25           H        ASN  25   7.941  -1.457   2.957
  172    HA   ASN  25           HA       ASN  25   7.182   1.200   3.608
  173    HB2  ASN  25           HB3      ASN  25   9.915  -0.095   3.880
  174    HB3  ASN  25           HB2      ASN  25   9.367   1.345   4.741
  175   HD21  ASN  25          HD22      ASN  25   6.812  -0.882   4.287
  176   HD22  ASN  25          HD21      ASN  25   6.846  -1.596   5.827
  177    H    GLY  26           H        GLY  26   9.421  -0.100   1.220
  178    HA2  GLY  26           HA3      GLY  26  10.736   2.294   0.465
  179    HA3  GLY  26           HA2      GLY  26  10.447   0.932  -0.622
  180    H    VAL  27           H        VAL  27   7.629   0.913  -0.630
  181    HA   VAL  27           HA       VAL  27   7.061   2.936  -2.570
  182    HB   VAL  27           HB       VAL  27   5.217   1.225  -0.877
  183   HG11  VAL  27          HG11      VAL  27   3.679   1.882  -2.957
  184   HG12  VAL  27          HG12      VAL  27   4.683   3.332  -2.930
  185   HG13  VAL  27          HG13      VAL  27   3.738   2.885  -1.508
  186   HG21  VAL  27          HG21      VAL  27   4.928   0.130  -3.194
  187   HG22  VAL  27          HG22      VAL  27   6.456  -0.156  -2.363
  188   HG23  VAL  27          HG23      VAL  27   6.369   1.030  -3.665
  189    H    CYS  28           H        CYS  28   6.183   2.653   0.869
  190    HA   CYS  28           HA       CYS  28   4.905   5.250   0.983
  191    HB2  CYS  28           HB3      CYS  28   6.017   3.431   3.141
  192    HB3  CYS  28           HB2      CYS  28   5.150   4.927   3.481
  193    H    THR  29           H        THR  29   8.188   4.125   1.204
  194    HA   THR  29           HA       THR  29   9.363   6.281   2.645
  195    HB   THR  29           HB       THR  29  10.600   4.648   0.412
  196    HG1  THR  29           HG1      THR  29  11.393   3.502   2.365
  197   HG21  THR  29          HG21      THR  29  11.581   6.747   2.179
  198   HG22  THR  29          HG22      THR  29  12.360   6.005   0.781
  199   HG23  THR  29          HG23      THR  29  12.492   5.249   2.370
  200    H    LYS  30           H        LYS  30   8.409   6.034  -0.741
  201    HA   LYS  30           HA       LYS  30   9.896   8.135  -1.855
  202    HB2  LYS  30           HB3      LYS  30   7.120   7.105  -2.394
  203    HB3  LYS  30           HB2      LYS  30   7.742   8.497  -3.279
  204    HG2  LYS  30           HG3      LYS  30   8.241   6.514  -4.569
  205    HG3  LYS  30           HG2      LYS  30   9.755   7.116  -3.893
  206    HD2  LYS  30           HD3      LYS  30   9.737   5.459  -2.158
  207    HD3  LYS  30           HD2      LYS  30   8.087   4.976  -2.554
  208    HE2  LYS  30           HE3      LYS  30   8.781   3.613  -4.217
  209    HE3  LYS  30           HE2      LYS  30   9.882   4.833  -4.857
  210    HZ1  LYS  30           HZ1      LYS  30  11.219   4.215  -2.711
  211    HZ2  LYS  30           HZ2      LYS  30  11.363   3.286  -4.123
  212    HZ3  LYS  30           HZ3      LYS  30  10.367   2.751  -2.854
  213    H    ASN  31           H        ASN  31   7.054   8.310   0.229
  214    HA   ASN  31           HA       ASN  31   6.388  11.038  -0.137
  215    HB2  ASN  31           HB3      ASN  31   5.187   9.270   1.294
  216    HB3  ASN  31           HB2      ASN  31   6.364   9.667   2.549
  217   HD21  ASN  31          HD22      ASN  31   5.600  11.228   3.968
  218   HD22  ASN  31          HD21      ASN  31   4.531  12.483   3.561
  219    H    GLY  32           H        GLY  32   8.961   9.527   1.750
  220    HA2  GLY  32           HA3      GLY  32  11.040  10.696   2.212
  221    HA3  GLY  32           HA2      GLY  32  10.163  12.224   2.119
  222    H    ALA  33           H        ALA  33   8.280  10.047   3.790
  223    HA   ALA  33           HA       ALA  33   9.484  10.064   6.394
  224    HB1  ALA  33           HB1      ALA  33   8.042  11.759   7.470
  225    HB2  ALA  33           HB2      ALA  33   7.395  12.202   5.891
  226    HB3  ALA  33           HB3      ALA  33   9.096  12.490   6.259
  227    H    LYS  34           H        LYS  34   6.672   9.853   4.341
  228    HA   LYS  34           HA       LYS  34   4.721   8.868   6.099
  229    HB2  LYS  34           HB3      LYS  34   4.415   9.295   3.649
  230    HB3  LYS  34           HB2      LYS  34   5.314   7.816   3.318
  231    HG2  LYS  34           HG3      LYS  34   3.643   6.495   4.509
  232    HG3  LYS  34           HG2      LYS  34   2.760   7.960   4.931
  233    HD2  LYS  34           HD3      LYS  34   2.750   8.405   2.361
  234    HD3  LYS  34           HD2      LYS  34   3.109   6.686   2.230
  235    HE2  LYS  34           HE3      LYS  34   1.047   6.686   4.047
  236    HE3  LYS  34           HE2      LYS  34   0.602   8.032   3.000
  237    HZ1  LYS  34           HZ1      LYS  34   0.412   6.691   1.184
  238    HZ2  LYS  34           HZ2      LYS  34  -0.070   5.604   2.392
  239    HZ3  LYS  34           HZ3      LYS  34   1.507   5.532   1.766
  240    H    SER  35           H        SER  35   4.487   6.951   7.219
  241    HA   SER  35           HA       SER  35   6.618   4.900   6.778
  242    HB2  SER  35           HB3      SER  35   5.143   5.567   9.339
  243    HB3  SER  35           HB2      SER  35   6.394   4.340   9.161
  244    HG   SER  35           HG       SER  35   6.583   7.099   9.287
  245    H    GLY  36           H        GLY  36   5.939   2.763   6.541
  246    HA2  GLY  36           HA3      GLY  36   3.086   2.165   7.043
  247    HA3  GLY  36           HA2      GLY  36   3.712   1.889   5.418
  248    H    TYR  37           H        TYR  37   2.620  -0.117   7.150
  249    HA   TYR  37           HA       TYR  37   5.025  -1.865   7.455
  250    HB2  TYR  37           HB3      TYR  37   2.594  -1.955   9.261
  251    HB3  TYR  37           HB2      TYR  37   4.117  -2.819   9.469
  252    HD1  TYR  37           HD1      TYR  37   6.233  -1.502   9.928
  253    HD2  TYR  37           HD2      TYR  37   2.324   0.273  10.034
  254    HE1  TYR  37           HE1      TYR  37   7.140   0.418  11.211
  255    HE2  TYR  37           HE2      TYR  37   3.228   2.192  11.318
  256    HH   TYR  37           HH       TYR  37   5.006   2.975  12.443
  257    H    CYS  38           H        CYS  38   4.574  -4.135   7.001
  258    HA   CYS  38           HA       CYS  38   2.201  -4.456   5.240
  259    HB2  CYS  38           HB3      CYS  38   4.920  -5.585   5.319
  260    HB3  CYS  38           HB2      CYS  38   3.657  -6.770   4.982
  261    H    GLN  39           H        GLN  39   0.491  -5.585   5.959
  262    HA   GLN  39           HA       GLN  39   0.859  -7.340   8.352
  263    HB2  GLN  39           HB3      GLN  39  -1.591  -5.854   7.354
  264    HB3  GLN  39           HB2      GLN  39  -1.603  -6.993   8.701
  265    HG2  GLN  39           HG3      GLN  39   0.087  -5.613   9.871
  266    HG3  GLN  39           HG2      GLN  39   0.055  -4.460   8.537
  267   HE21  GLN  39          HE22      GLN  39  -0.899  -4.345  11.511
  268   HE22  GLN  39          HE21      GLN  39  -2.467  -3.708  11.389
  269    H    ILE  40           H        ILE  40  -1.602  -8.706   8.116
  270    HA   ILE  40           HA       ILE  40  -1.101 -10.303   5.636
  271    HB   ILE  40           HB       ILE  40  -1.863 -12.253   6.853
  272   HG12  ILE  40          HG13      ILE  40  -2.337 -10.341   9.168
  273   HG13  ILE  40          HG12      ILE  40  -3.597 -11.145   8.232
  274   HG21  ILE  40          HG21      ILE  40  -0.029 -12.489   8.339
  275   HG22  ILE  40          HG22      ILE  40  -0.041 -10.775   8.757
  276   HG23  ILE  40          HG23      ILE  40   0.514 -11.291   7.164
  277   HD11  ILE  40          HD11      ILE  40  -3.407 -12.598  10.033
  278   HD12  ILE  40          HD12      ILE  40  -1.674 -12.318  10.207
  279   HD13  ILE  40          HD13      ILE  40  -2.276 -13.330   8.894
  280    H    LEU  41           H        LEU  41  -3.008 -11.268   4.635
  281    HA   LEU  41           HA       LEU  41  -5.307  -9.449   4.733
  282    HB2  LEU  41           HB3      LEU  41  -4.827 -11.904   3.022
  283    HB3  LEU  41           HB2      LEU  41  -6.068 -10.682   2.772
  284    HG   LEU  41           HG       LEU  41  -3.076 -10.234   2.655
  285   HD11  LEU  41          HD11      LEU  41  -4.675  -9.499   0.334
  286   HD12  LEU  41          HD12      LEU  41  -4.844 -11.212   0.722
  287   HD13  LEU  41          HD13      LEU  41  -3.245 -10.528   0.423
  288   HD21  LEU  41          HD21      LEU  41  -5.442  -8.383   2.661
  289   HD22  LEU  41          HD22      LEU  41  -4.019  -7.958   1.710
  290   HD23  LEU  41          HD23      LEU  41  -3.878  -8.191   3.453
  291    H    GLY  42           H        GLY  42  -7.424 -10.100   5.332
  292    HA2  GLY  42           HA3      GLY  42  -7.722 -11.903   7.468
  293    HA3  GLY  42           HA2      GLY  42  -9.054 -11.408   6.420
  294    H    THR  43           H        THR  43  -7.828 -12.483   3.997
  295    HA   THR  43           HA       THR  43  -8.468 -15.342   4.460
  296    HB   THR  43           HB       THR  43  -8.661 -15.452   1.987
  297    HG1  THR  43           HG1      THR  43  -8.231 -12.657   2.063
  298   HG21  THR  43          HG21      THR  43 -10.166 -13.059   3.066
  299   HG22  THR  43          HG22      THR  43 -10.576 -14.724   3.477
  300   HG23  THR  43          HG23      THR  43 -10.688 -14.175   1.805
  301    H    TYR  44           H        TYR  44  -6.812 -15.273   1.655
  302    HA   TYR  44           HA       TYR  44  -4.234 -15.958   3.015
  303    HB2  TYR  44           HB3      TYR  44  -5.300 -16.905   0.336
  304    HB3  TYR  44           HB2      TYR  44  -3.793 -17.422   1.093
  305    HD1  TYR  44           HD1      TYR  44  -3.841 -18.735   3.217
  306    HD2  TYR  44           HD2      TYR  44  -7.422 -17.777   1.047
  307    HE1  TYR  44           HE1      TYR  44  -5.075 -20.472   4.486
  308    HE2  TYR  44           HE2      TYR  44  -8.656 -19.513   2.316
  309    HH   TYR  44           HH       TYR  44  -8.443 -21.267   3.714
  310    H    GLY  45           H        GLY  45  -2.457 -14.760   2.459
  311    HA2  GLY  45           HA3      GLY  45  -1.326 -13.732   0.359
  312    HA3  GLY  45           HA2      GLY  45  -2.798 -12.766   0.262
  313    H    ASN  46           H        ASN  46  -1.221 -10.930   0.494
  314    HA   ASN  46           HA       ASN  46  -0.864 -10.306   3.372
  315    HB2  ASN  46           HB3      ASN  46   1.298 -11.147   2.104
  316    HB3  ASN  46           HB2      ASN  46   1.298  -9.507   1.455
  317   HD21  ASN  46          HD22      ASN  46   1.489  -7.705   3.026
  318   HD22  ASN  46          HD21      ASN  46   2.125  -7.985   4.575
  319    H    GLY  47           H        GLY  47  -0.457  -7.892   3.657
  320    HA2  GLY  47           HA3      GLY  47  -1.491  -6.286   1.372
  321    HA3  GLY  47           HA2      GLY  47  -2.305  -6.165   2.932
  322    H    CYS  48           H        CYS  48  -1.093  -3.933   1.711
  323    HA   CYS  48           HA       CYS  48   1.368  -3.513   3.338
  324    HB2  CYS  48           HB3      CYS  48   0.469  -2.578   0.693
  325    HB3  CYS  48           HB2      CYS  48   1.197  -1.327   1.698
  326    H    TRP  49           H        TRP  49   1.345  -1.974   4.941
  327    HA   TRP  49           HA       TRP  49  -1.191  -0.438   5.298
  328    HB2  TRP  49           HB3      TRP  49  -0.277  -2.205   7.037
  329    HB3  TRP  49           HB2      TRP  49   0.800  -0.888   7.500
  330    HD1  TRP  49           HD1      TRP  49  -0.306   1.315   8.520
  331    HE1  TRP  49           HE1      TRP  49  -2.593   1.714   9.642
  332    HE3  TRP  49           HE3      TRP  49  -2.757  -2.907   7.038
  333    HZ2  TRP  49           HZ2      TRP  49  -5.133   0.406   9.879
  334    HZ3  TRP  49           HZ3      TRP  49  -5.103  -3.311   7.723
  335    HH2  TRP  49           HH2      TRP  49  -6.292  -1.662   9.141
  336    H    CYS  50           H        CYS  50  -0.964   1.740   4.928
  337    HA   CYS  50           HA       CYS  50   1.717   2.956   5.467
  338    HB2  CYS  50           HB3      CYS  50   0.857   2.669   2.966
  339    HB3  CYS  50           HB2      CYS  50  -0.033   4.140   3.365
  340    H    ILE  51           H        ILE  51   1.661   4.659   6.839
  341    HA   ILE  51           HA       ILE  51  -0.996   5.906   7.389
  342    HB   ILE  51           HB       ILE  51   1.290   5.450   9.322
  343   HG12  ILE  51          HG13      ILE  51  -1.324   4.183   9.802
  344   HG13  ILE  51          HG12      ILE  51  -0.501   3.587   8.361
  345   HG21  ILE  51          HG21      ILE  51   0.265   7.069  10.513
  346   HG22  ILE  51          HG22      ILE  51  -1.105   5.971  10.680
  347   HG23  ILE  51          HG23      ILE  51  -1.072   7.146   9.366
  348   HD11  ILE  51          HD11      ILE  51   0.013   2.448  10.651
  349   HD12  ILE  51          HD12      ILE  51   1.001   3.877  10.954
  350   HD13  ILE  51          HD13      ILE  51   1.359   2.833   9.577
  351    H    ALA  52           H        ALA  52  -1.095   8.121   7.425
  352    HA   ALA  52           HA       ALA  52   1.190   9.841   7.792
  353    HB1  ALA  52           HB1      ALA  52   0.447  10.605   5.178
  354    HB2  ALA  52           HB2      ALA  52   0.709   8.864   5.119
  355    HB3  ALA  52           HB3      ALA  52   1.993   9.933   5.691
  356    H    LEU  53           H        LEU  53  -1.915   9.683   6.035
  357    HA   LEU  53           HA       LEU  53  -2.757  12.130   7.537
  358    HB2  LEU  53           HB3      LEU  53  -2.241  12.594   5.125
  359    HB3  LEU  53           HB2      LEU  53  -3.498  11.441   4.682
  360    HG   LEU  53           HG       LEU  53  -5.117  12.804   6.062
  361   HD11  LEU  53          HD11      LEU  53  -2.640  14.227   6.639
  362   HD12  LEU  53          HD12      LEU  53  -4.206  14.344   7.437
  363   HD13  LEU  53          HD13      LEU  53  -3.876  15.310   6.000
  364   HD21  LEU  53          HD21      LEU  53  -5.356  13.162   3.769
  365   HD22  LEU  53          HD22      LEU  53  -3.728  13.819   3.600
  366   HD23  LEU  53          HD23      LEU  53  -4.999  14.792   4.339
  367    HA   PRO  54           HA       PRO  54  -5.609   8.546   8.463
  368    HB2  PRO  54           HB2      PRO  54  -5.969  10.285  10.845
  369    HB3  PRO  54           HB3      PRO  54  -5.699   8.535  10.756
  370    HG2  PRO  54           HG3      PRO  54  -3.780  10.229  11.534
  371    HG3  PRO  54           HG2      PRO  54  -3.425   8.756  10.616
  372    HD2  PRO  54           HD3      PRO  54  -3.416  11.594   9.696
  373    HD3  PRO  54           HD2      PRO  54  -2.442  10.219   9.130
  374    H    ASP  55           H        ASP  55  -7.979   8.711   9.122
  375    HA   ASP  55           HA       ASP  55 -10.115   9.562   8.677
  376    HB2  ASP  55           HB3      ASP  55  -9.239  11.347  10.275
  377    HB3  ASP  55           HB2      ASP  55  -8.825  12.297   8.849
  378    H    ASN  56           H        ASN  56 -11.307  10.217   6.849
  379    HA   ASN  56           HA       ASN  56 -11.654  10.718   4.583
  380    HB2  ASN  56           HB3      ASN  56 -10.294  12.809   5.452
  381    HB3  ASN  56           HB2      ASN  56  -8.999  12.107   4.479
  382   HD21  ASN  56          HD22      ASN  56 -10.392  14.606   3.853
  383   HD22  ASN  56          HD21      ASN  56 -11.184  14.371   2.373
  384    H    VAL  57           H        VAL  57 -10.624   8.242   5.130
  385    HA   VAL  57           HA       VAL  57  -8.417   7.848   3.176
  386    HB   VAL  57           HB       VAL  57  -7.730   6.832   5.150
  387   HG11  VAL  57          HG11      VAL  57 -10.632   6.041   5.530
  388   HG12  VAL  57          HG12      VAL  57  -9.730   7.243   6.454
  389   HG13  VAL  57          HG13      VAL  57  -9.324   5.532   6.599
  390   HG21  VAL  57          HG21      VAL  57  -8.108   5.202   3.109
  391   HG22  VAL  57          HG22      VAL  57  -9.346   4.503   4.154
  392   HG23  VAL  57          HG23      VAL  57  -7.667   4.546   4.686
  393    HA   PRO  58           HA       PRO  58 -11.924   5.984   0.910
  394    HB2  PRO  58           HB2      PRO  58 -11.268   6.791  -1.553
  395    HB3  PRO  58           HB3      PRO  58 -11.888   7.957  -0.365
  396    HG2  PRO  58           HG3      PRO  58  -9.111   7.509  -1.303
  397    HG3  PRO  58           HG2      PRO  58  -9.920   9.017  -0.847
  398    HD2  PRO  58           HD3      PRO  58  -8.200   7.475   0.794
  399    HD3  PRO  58           HD2      PRO  58  -9.244   8.816   1.324
  400    H    ILE  59           H        ILE  59 -11.868   3.850   0.268
  401    HA   ILE  59           HA       ILE  59  -9.400   2.444   0.000
  402    HB   ILE  59           HB       ILE  59 -12.189   1.646  -0.868
  403   HG12  ILE  59          HG13      ILE  59 -11.132   0.306   1.448
  404   HG13  ILE  59          HG12      ILE  59 -11.011   2.049   1.688
  405   HG21  ILE  59          HG21      ILE  59 -10.778  -0.624  -0.244
  406   HG22  ILE  59          HG22      ILE  59  -9.543   0.374  -1.012
  407   HG23  ILE  59          HG23      ILE  59 -11.028  -0.018  -1.882
  408   HD11  ILE  59          HD11      ILE  59 -13.534   0.662   0.748
  409   HD12  ILE  59          HD12      ILE  59 -13.365   2.346   1.244
  410   HD13  ILE  59          HD13      ILE  59 -13.209   1.057   2.436
  411    H    ARG  60           H        ARG  60 -11.530   3.927  -2.396
  412    HA   ARG  60           HA       ARG  60 -11.252   4.209  -4.720
  413    HB2  ARG  60           HB3      ARG  60  -8.338   3.752  -4.002
  414    HB3  ARG  60           HB2      ARG  60  -8.934   4.462  -5.498
  415    HG2  ARG  60           HG3      ARG  60  -9.886   6.343  -4.271
  416    HG3  ARG  60           HG2      ARG  60  -9.399   5.616  -2.736
  417    HD2  ARG  60           HD3      ARG  60  -7.031   5.670  -3.504
  418    HD3  ARG  60           HD2      ARG  60  -7.552   6.514  -4.963
  419    HE   ARG  60           HE       ARG  60  -8.561   8.081  -2.918
  420   HH11  ARG  60          HH22      ARG  60  -5.494   6.734  -3.738
  421   HH12  ARG  60          HH21      ARG  60  -4.587   8.025  -3.023
  422   HH21  ARG  60          HH11      ARG  60  -7.394   9.775  -1.981
  423   HH22  ARG  60          HH12      ARG  60  -5.663   9.747  -2.030
  424    H    ILE  61           H        ILE  61 -10.787   1.361  -3.165
  425    HA   ILE  61           HA       ILE  61 -10.406  -0.118  -5.728
  426    HB   ILE  61           HB       ILE  61  -9.162  -0.582  -3.027
  427   HG12  ILE  61          HG13      ILE  61  -7.653  -0.937  -5.531
  428   HG13  ILE  61          HG12      ILE  61  -8.258   0.697  -5.261
  429   HG21  ILE  61          HG21      ILE  61  -9.667  -2.787  -3.392
  430   HG22  ILE  61          HG22      ILE  61  -8.289  -2.689  -4.487
  431   HG23  ILE  61          HG23      ILE  61  -9.929  -2.542  -5.119
  432   HD11  ILE  61          HD11      ILE  61  -7.243   0.699  -3.008
  433   HD12  ILE  61          HD12      ILE  61  -6.027   0.436  -4.258
  434   HD13  ILE  61          HD13      ILE  61  -6.612  -0.923  -3.297
  435    HA   PRO  62           HA       PRO  62 -14.256  -1.545  -3.622
  436    HB2  PRO  62           HB2      PRO  62 -15.948  -1.192  -5.694
  437    HB3  PRO  62           HB3      PRO  62 -15.444   0.158  -4.659
  438    HG2  PRO  62           HG3      PRO  62 -14.526  -0.576  -7.389
  439    HG3  PRO  62           HG2      PRO  62 -14.785   1.024  -6.674
  440    HD2  PRO  62           HD3      PRO  62 -12.306  -0.237  -6.942
  441    HD3  PRO  62           HD2      PRO  62 -12.652   1.119  -5.847
  442    H    GLY  63           H        GLY  63 -12.392  -3.393  -4.402
  443    HA2  GLY  63           HA3      GLY  63 -12.564  -5.737  -4.879
  444    HA3  GLY  63           HA2      GLY  63 -14.055  -5.417  -5.770
  445    H    LYS  64           H        LYS  64 -11.974  -3.067  -6.673
  446    HA   LYS  64           HA       LYS  64 -11.643  -3.965  -9.341
  447    HB2  LYS  64           HB3      LYS  64 -11.463  -1.599  -8.609
  448    HB3  LYS  64           HB2      LYS  64  -9.941  -1.981  -7.805
  449    HG2  LYS  64           HG3      LYS  64  -9.009  -2.722  -9.990
  450    HG3  LYS  64           HG2      LYS  64 -10.512  -2.226 -10.770
  451    HD2  LYS  64           HD3      LYS  64 -10.162   0.084  -9.906
  452    HD3  LYS  64           HD2      LYS  64  -8.613  -0.429  -9.236
  453    HE2  LYS  64           HE3      LYS  64  -7.907  -1.125 -11.529
  454    HE3  LYS  64           HE2      LYS  64  -9.412  -0.450 -12.156
  455    HZ1  LYS  64           HZ1      LYS  64  -8.660   1.630 -11.940
  456    HZ2  LYS  64           HZ2      LYS  64  -7.119   0.926 -11.873
  457    HZ3  LYS  64           HZ3      LYS  64  -7.929   1.330 -10.436
  458    H    CYS  65           H        CYS  65  -9.463  -4.156  -6.549
  459    HA   CYS  65           HA       CYS  65  -7.183  -5.177  -7.906
  460    HB2  CYS  65           HB3      CYS  65  -7.189  -4.386  -5.548
  461    HB3  CYS  65           HB2      CYS  65  -8.113  -5.817  -5.091
  462    H    HIS  66           H        HIS  66 -10.118  -6.757  -6.756
  463    HA   HIS  66           HA       HIS  66  -9.299  -9.187  -8.255
  464    HB2  HIS  66           HB3      HIS  66 -10.376  -9.240  -5.419
  465    HB3  HIS  66           HB2      HIS  66 -10.001 -10.649  -6.411
  466    HD1  HIS  66           HD1      HIS  66  -7.372 -10.700  -7.276
  467    HD2  HIS  66           HD2      HIS  66  -8.220  -8.387  -3.910
  468    HE1  HIS  66           HE1      HIS  66  -5.161 -10.301  -6.105
  469    HE2  HIS  66           HE2      HIS  66  -5.666  -8.895  -4.054
  Start of MODEL   19
    1    H1   ALA   1           H1       ALA   1  -2.521  11.828   3.122
    2    H2   ALA   1           H2       ALA   1  -2.943  12.157   1.510
    3    H3   ALA   1           H3       ALA   1  -1.670  11.086   1.857
    4    HA   ALA   1           HA       ALA   1  -4.494  10.611   2.635
    5    HB1  ALA   1           HB1      ALA   1  -3.214  10.388   0.071
    6    HB2  ALA   1           HB2      ALA   1  -4.868   9.966   0.512
    7    HB3  ALA   1           HB3      ALA   1  -3.582   8.771   0.668
    8    H    ARG   2           H        ARG   2  -4.744   8.241   3.142
    9    HA   ARG   2           HA       ARG   2  -2.216   7.076   4.239
   10    HB2  ARG   2           HB3      ARG   2  -3.689   8.074   6.016
   11    HB3  ARG   2           HB2      ARG   2  -4.951   6.935   5.542
   12    HG2  ARG   2           HG3      ARG   2  -3.371   5.056   6.001
   13    HG3  ARG   2           HG2      ARG   2  -2.193   6.233   6.581
   14    HD2  ARG   2           HD3      ARG   2  -3.410   5.308   8.483
   15    HD3  ARG   2           HD2      ARG   2  -3.843   7.004   8.278
   16    HE   ARG   2           HE       ARG   2  -5.743   5.559   6.808
   17   HH11  ARG   2          HH22      ARG   2  -4.568   5.749  10.044
   18   HH12  ARG   2          HH21      ARG   2  -6.083   5.311  10.761
   19   HH21  ARG   2          HH11      ARG   2  -7.727   4.985   7.724
   20   HH22  ARG   2          HH12      ARG   2  -7.873   4.879   9.446
   21    H    ASP   3           H        ASP   3  -1.965   4.867   3.835
   22    HA   ASP   3           HA       ASP   3  -4.077   3.630   2.142
   23    HB2  ASP   3           HB3      ASP   3  -1.206   2.804   2.639
   24    HB3  ASP   3           HB2      ASP   3  -2.326   1.979   1.564
   25    H    ALA   4           H        ALA   4  -4.935   1.557   2.678
   26    HA   ALA   4           HA       ALA   4  -4.616   0.849   5.552
   27    HB1  ALA   4           HB1      ALA   4  -6.807  -0.331   5.241
   28    HB2  ALA   4           HB2      ALA   4  -6.856   0.298   3.595
   29    HB3  ALA   4           HB3      ALA   4  -6.895   1.408   4.964
   30    H    TYR   5           H        TYR   5  -5.857  -1.195   2.943
   31    HA   TYR   5           HA       TYR   5  -3.911  -3.284   3.781
   32    HB2  TYR   5           HB3      TYR   5  -6.311  -3.522   1.941
   33    HB3  TYR   5           HB2      TYR   5  -5.382  -4.849   2.637
   34    HD1  TYR   5           HD1      TYR   5  -7.833  -2.185   3.316
   35    HD2  TYR   5           HD2      TYR   5  -5.598  -5.444   4.999
   36    HE1  TYR   5           HE1      TYR   5  -9.290  -2.149   5.321
   37    HE2  TYR   5           HE2      TYR   5  -7.056  -5.407   7.006
   38    HH   TYR   5           HH       TYR   5  -8.517  -3.791   8.185
   39    H    ILE   6           H        ILE   6  -3.883  -0.854   1.634
   40    HA   ILE   6           HA       ILE   6  -2.555  -2.474  -0.494
   41    HB   ILE   6           HB       ILE   6  -3.161  -0.682  -2.053
   42   HG12  ILE   6          HG13      ILE   6  -4.520   0.580   0.349
   43   HG13  ILE   6          HG12      ILE   6  -3.064   1.191  -0.438
   44   HG21  ILE   6          HG21      ILE   6  -5.096  -1.790  -2.346
   45   HG22  ILE   6          HG22      ILE   6  -5.819  -0.899  -1.007
   46   HG23  ILE   6          HG23      ILE   6  -4.976  -2.418  -0.703
   47   HD11  ILE   6          HD11      ILE   6  -4.354   2.320  -1.887
   48   HD12  ILE   6          HD12      ILE   6  -5.809   1.619  -1.179
   49   HD13  ILE   6          HD13      ILE   6  -4.975   0.783  -2.489
   50    H    ALA   7           H        ALA   7  -0.724  -1.377  -1.577
   51    HA   ALA   7           HA       ALA   7   0.718   0.454   0.294
   52    HB1  ALA   7           HB1      ALA   7   1.606  -1.974  -0.252
   53    HB2  ALA   7           HB2      ALA   7   2.728  -0.616  -0.193
   54    HB3  ALA   7           HB3      ALA   7   2.149  -1.212  -1.747
   55    H    LYS   8           H        LYS   8  -0.835   0.241  -2.645
   56    HA   LYS   8           HA       LYS   8   0.859   2.361  -3.874
   57    HB2  LYS   8           HB3      LYS   8  -1.287   1.282  -5.540
   58    HB3  LYS   8           HB2      LYS   8   0.431   1.435  -5.897
   59    HG2  LYS   8           HG3      LYS   8  -0.769  -0.756  -4.172
   60    HG3  LYS   8           HG2      LYS   8  -0.350  -0.939  -5.872
   61    HD2  LYS   8           HD3      LYS   8   1.768   0.139  -4.070
   62    HD3  LYS   8           HD2      LYS   8   1.375  -1.575  -3.923
   63    HE2  LYS   8           HE3      LYS   8   1.941  -2.018  -6.175
   64    HE3  LYS   8           HE2      LYS   8   1.875  -0.311  -6.616
   65    HZ1  LYS   8           HZ1      LYS   8   3.875   0.125  -5.578
   66    HZ2  LYS   8           HZ2      LYS   8   4.153  -1.406  -6.255
   67    HZ3  LYS   8           HZ3      LYS   8   3.802  -1.262  -4.599
   68    HA   PRO   9           HA       PRO   9  -2.322   5.319  -3.148
   69    HB2  PRO   9           HB2      PRO   9  -2.173   6.862  -5.417
   70    HB3  PRO   9           HB3      PRO   9  -1.008   6.946  -4.082
   71    HG2  PRO   9           HG3      PRO   9  -0.779   5.587  -6.713
   72    HG3  PRO   9           HG2      PRO   9   0.453   6.437  -5.765
   73    HD2  PRO   9           HD3      PRO   9   0.266   3.704  -5.869
   74    HD3  PRO   9           HD2      PRO   9   0.935   4.583  -4.477
   75    H    HIS  10           H        HIS  10  -2.432   4.275  -6.581
   76    HA   HIS  10           HA       HIS  10  -5.408   4.199  -6.337
   77    HB2  HIS  10           HB3      HIS  10  -3.692   4.604  -8.801
   78    HB3  HIS  10           HB2      HIS  10  -5.454   4.531  -8.788
   79    HD1  HIS  10           HD1      HIS  10  -2.569   6.727  -7.813
   80    HD2  HIS  10           HD2      HIS  10  -6.738   6.835  -7.695
   81    HE1  HIS  10           HE1      HIS  10  -3.210   9.114  -7.248
   82    HE2  HIS  10           HE2      HIS  10  -5.745   9.190  -7.174
   83    H    ASN  11           H        ASN  11  -2.807   2.186  -6.318
   84    HA   ASN  11           HA       ASN  11  -4.358   0.009  -7.669
   85    HB2  ASN  11           HB3      ASN  11  -1.338   0.248  -7.555
   86    HB3  ASN  11           HB2      ASN  11  -2.267  -0.983  -8.405
   87   HD21  ASN  11          HD22      ASN  11  -1.055   2.287  -8.595
   88   HD22  ASN  11          HD21      ASN  11  -1.687   2.644 -10.130
   89    H    CYS  12           H        CYS  12  -3.595  -2.210  -6.840
   90    HA   CYS  12           HA       CYS  12  -3.265  -2.040  -3.876
   91    HB2  CYS  12           HB3      CYS  12  -4.393  -4.352  -5.478
   92    HB3  CYS  12           HB2      CYS  12  -4.461  -4.130  -3.730
   93    H    VAL  13           H        VAL  13  -2.288  -4.306  -3.072
   94    HA   VAL  13           HA       VAL  13   0.246  -4.628  -4.607
   95    HB   VAL  13           HB       VAL  13  -0.420  -5.539  -1.786
   96   HG11  VAL  13          HG11      VAL  13   1.602  -6.533  -1.811
   97   HG12  VAL  13          HG12      VAL  13   2.367  -5.054  -2.391
   98   HG13  VAL  13          HG13      VAL  13   1.690  -6.207  -3.541
   99   HG21  VAL  13          HG21      VAL  13   0.056  -3.454  -1.058
  100   HG22  VAL  13          HG22      VAL  13  -0.057  -2.922  -2.735
  101   HG23  VAL  13          HG23      VAL  13   1.507  -3.375  -2.059
  102    H    TYR  14           H        TYR  14   0.572  -6.475  -5.741
  103    HA   TYR  14           HA       TYR  14  -1.423  -8.592  -5.722
  104    HB2  TYR  14           HB3      TYR  14  -0.162  -9.566  -7.494
  105    HB3  TYR  14           HB2      TYR  14  -0.009  -7.825  -7.724
  106    HD1  TYR  14           HD1      TYR  14   2.070  -6.643  -6.971
  107    HD2  TYR  14           HD2      TYR  14   1.734 -10.925  -6.959
  108    HE1  TYR  14           HE1      TYR  14   4.537  -6.836  -6.810
  109    HE2  TYR  14           HE2      TYR  14   4.200 -11.118  -6.796
  110    HH   TYR  14           HH       TYR  14   6.275  -8.223  -6.828
  111    H    GLU  15           H        GLU  15   1.762  -8.092  -4.321
  112    HA   GLU  15           HA       GLU  15   1.352 -10.146  -2.344
  113    HB2  GLU  15           HB3      GLU  15   1.895 -11.521  -4.420
  114    HB3  GLU  15           HB2      GLU  15   3.493 -10.773  -4.391
  115    HG2  GLU  15           HG3      GLU  15   3.806 -11.598  -2.063
  116    HG3  GLU  15           HG2      GLU  15   2.253 -12.428  -2.175
  117    H    CYS  16           H        CYS  16   2.101  -8.614  -0.848
  118    HA   CYS  16           HA       CYS  16   4.517  -7.075  -1.325
  119    HB2  CYS  16           HB3      CYS  16   2.862  -6.146   0.173
  120    HB3  CYS  16           HB2      CYS  16   2.902  -7.588   1.189
  121    H    PHE  17           H        PHE  17   6.419  -8.180  -1.476
  122    HA   PHE  17           HA       PHE  17   7.030 -10.709  -0.468
  123    HB2  PHE  17           HB3      PHE  17   8.795 -10.076  -1.741
  124    HB3  PHE  17           HB2      PHE  17   8.545  -8.370  -1.391
  125    HD1  PHE  17           HD1      PHE  17   9.886 -11.537   0.074
  126    HD2  PHE  17           HD2      PHE  17   9.934  -7.243   0.144
  127    HE1  PHE  17           HE1      PHE  17  11.812 -11.584   1.638
  128    HE2  PHE  17           HE2      PHE  17  11.857  -7.289   1.709
  129    HZ   PHE  17           HZ       PHE  17  12.797  -9.458   2.455
  130    H    ASP  18           H        ASP  18   7.967 -11.448   1.500
  131    HA   ASP  18           HA       ASP  18   7.067 -10.023   3.850
  132    HB2  ASP  18           HB3      ASP  18   7.153 -12.509   3.686
  133    HB3  ASP  18           HB2      ASP  18   8.915 -12.419   3.676
  134    H    ALA  19           H        ALA  19   8.121  -8.331   4.720
  135    HA   ALA  19           HA       ALA  19  11.081  -8.466   4.943
  136    HB1  ALA  19           HB1      ALA  19   9.953  -5.786   4.340
  137    HB2  ALA  19           HB2      ALA  19   9.981  -6.926   2.996
  138    HB3  ALA  19           HB3      ALA  19  11.480  -6.505   3.825
  139    H    PHE  20           H        PHE  20  11.876  -7.364   6.803
  140    HA   PHE  20           HA       PHE  20  10.140  -7.248   9.050
  141    HB2  PHE  20           HB3      PHE  20  12.652  -7.422   9.136
  142    HB3  PHE  20           HB2      PHE  20  12.735  -5.715   8.702
  143    HD1  PHE  20           HD1      PHE  20  11.469  -8.102  11.262
  144    HD2  PHE  20           HD2      PHE  20  12.353  -4.006  10.318
  145    HE1  PHE  20           HE1      PHE  20  11.130  -7.480  13.640
  146    HE2  PHE  20           HE2      PHE  20  12.011  -3.384  12.694
  147    HZ   PHE  20           HZ       PHE  20  11.399  -5.122  14.355
  148    H    SER  21           H        SER  21  11.357  -4.656   6.932
  149    HA   SER  21           HA       SER  21   9.022  -3.094   6.967
  150    HB2  SER  21           HB3      SER  21   9.141  -2.604   9.253
  151    HB3  SER  21           HB2      SER  21  10.903  -2.593   9.254
  152    HG   SER  21           HG       SER  21   9.785  -0.743   7.574
  153    H    SER  22           H        SER  22  10.209  -3.231   4.800
  154    HA   SER  22           HA       SER  22  11.742  -0.743   4.440
  155    HB2  SER  22           HB3      SER  22  13.742  -1.667   3.783
  156    HB3  SER  22           HB2      SER  22  13.239  -2.921   4.913
  157    HG   SER  22           HG       SER  22  13.310  -2.918   2.130
  158    H    TYR  23           H        TYR  23  10.683  -3.744   2.777
  159    HA   TYR  23           HA       TYR  23  10.552  -2.628   0.175
  160    HB2  TYR  23           HB3      TYR  23  10.334  -5.055   0.649
  161    HB3  TYR  23           HB2      TYR  23   8.748  -4.758   1.361
  162    HD1  TYR  23           HD2      TYR  23  10.701  -4.794  -1.767
  163    HD2  TYR  23           HD1      TYR  23   6.831  -4.170  -0.012
  164    HE1  TYR  23           HE2      TYR  23   9.667  -4.886  -4.019
  165    HE2  TYR  23           HE1      TYR  23   5.795  -4.262  -2.266
  166    HH   TYR  23           HH       TYR  23   7.329  -3.827  -5.010
  167    H    CYS  24           H        CYS  24   7.927  -2.954   2.585
  168    HA   CYS  24           HA       CYS  24   6.021  -1.480   1.013
  169    HB2  CYS  24           HB3      CYS  24   5.628  -3.008   3.095
  170    HB3  CYS  24           HB2      CYS  24   5.960  -1.545   4.023
  171    H    ASN  25           H        ASN  25   8.227  -0.561   3.643
  172    HA   ASN  25           HA       ASN  25   7.464   2.167   3.834
  173    HB2  ASN  25           HB3      ASN  25  10.232   0.972   4.192
  174    HB3  ASN  25           HB2      ASN  25   9.690   2.531   4.814
  175   HD21  ASN  25          HD22      ASN  25   7.181   0.205   4.879
  176   HD22  ASN  25          HD21      ASN  25   7.302  -0.222   6.518
  177    H    GLY  26           H        GLY  26   9.678   0.492   1.642
  178    HA2  GLY  26           HA3      GLY  26  10.802   2.794   0.389
  179    HA3  GLY  26           HA2      GLY  26  10.649   1.210  -0.374
  180    H    VAL  27           H        VAL  27   7.842   0.934  -0.302
  181    HA   VAL  27           HA       VAL  27   7.083   2.417  -2.634
  182    HB   VAL  27           HB       VAL  27   5.404   0.928  -0.597
  183   HG11  VAL  27          HG11      VAL  27   4.704   2.207  -3.247
  184   HG12  VAL  27          HG12      VAL  27   3.914   2.437  -1.686
  185   HG13  VAL  27          HG13      VAL  27   3.738   0.908  -2.547
  186   HG21  VAL  27          HG21      VAL  27   5.846  -0.028  -3.382
  187   HG22  VAL  27          HG22      VAL  27   5.737  -0.949  -1.881
  188   HG23  VAL  27          HG23      VAL  27   7.232  -0.107  -2.294
  189    H    CYS  28           H        CYS  28   6.314   2.844   0.813
  190    HA   CYS  28           HA       CYS  28   4.588   5.104   0.465
  191    HB2  CYS  28           HB3      CYS  28   6.278   4.156   2.786
  192    HB3  CYS  28           HB2      CYS  28   5.264   5.595   2.890
  193    H    THR  29           H        THR  29   8.082   4.767   0.593
  194    HA   THR  29           HA       THR  29   8.798   7.455   1.123
  195    HB   THR  29           HB       THR  29  10.222   5.573  -0.778
  196    HG1  THR  29           HG1      THR  29  11.195   5.692   1.727
  197   HG21  THR  29          HG21      THR  29  12.184   6.845  -0.238
  198   HG22  THR  29          HG22      THR  29  11.336   7.727   1.032
  199   HG23  THR  29          HG23      THR  29  10.928   8.007  -0.660
  200    H    LYS  30           H        LYS  30   7.996   5.874  -1.965
  201    HA   LYS  30           HA       LYS  30   8.528   8.136  -3.628
  202    HB2  LYS  30           HB3      LYS  30   6.398   6.019  -4.054
  203    HB3  LYS  30           HB2      LYS  30   7.150   7.020  -5.294
  204    HG2  LYS  30           HG3      LYS  30   8.620   5.017  -3.555
  205    HG3  LYS  30           HG2      LYS  30   8.125   4.736  -5.224
  206    HD2  LYS  30           HD3      LYS  30   9.458   6.875  -5.786
  207    HD3  LYS  30           HD2      LYS  30  10.179   6.687  -4.185
  208    HE2  LYS  30           HE3      LYS  30  10.834   4.356  -4.801
  209    HE3  LYS  30           HE2      LYS  30  10.228   4.652  -6.431
  210    HZ1  LYS  30           HZ1      LYS  30  12.650   5.593  -5.159
  211    HZ2  LYS  30           HZ2      LYS  30  11.816   6.772  -6.050
  212    HZ3  LYS  30           HZ3      LYS  30  12.313   5.333  -6.804
  213    H    ASN  31           H        ASN  31   5.559   7.051  -2.007
  214    HA   ASN  31           HA       ASN  31   3.918   9.222  -2.931
  215    HB2  ASN  31           HB3      ASN  31   3.656   7.526  -0.429
  216    HB3  ASN  31           HB2      ASN  31   2.392   8.554  -1.104
  217   HD21  ASN  31          HD22      ASN  31   2.644   8.011  -3.857
  218   HD22  ASN  31          HD21      ASN  31   2.305   6.373  -4.142
  219    H    GLY  32           H        GLY  32   6.180   8.858  -0.283
  220    HA2  GLY  32           HA3      GLY  32   7.244  10.777   0.756
  221    HA3  GLY  32           HA2      GLY  32   5.831  11.749   0.333
  222    H    ALA  33           H        ALA  33   4.854   8.748   1.447
  223    HA   ALA  33           HA       ALA  33   3.683   9.846   3.845
  224    HB1  ALA  33           HB1      ALA  33   3.732   7.238   2.454
  225    HB2  ALA  33           HB2      ALA  33   2.387   8.074   3.229
  226    HB3  ALA  33           HB3      ALA  33   3.525   7.142   4.202
  227    H    LYS  34           H        LYS  34   4.058   8.515   6.000
  228    HA   LYS  34           HA       LYS  34   6.866   8.899   6.702
  229    HB2  LYS  34           HB3      LYS  34   4.926   9.401   8.238
  230    HB3  LYS  34           HB2      LYS  34   4.666   7.663   8.379
  231    HG2  LYS  34           HG3      LYS  34   7.257   7.660   8.967
  232    HG3  LYS  34           HG2      LYS  34   6.926   9.332   9.417
  233    HD2  LYS  34           HD3      LYS  34   5.334   6.959  10.431
  234    HD3  LYS  34           HD2      LYS  34   6.660   7.710  11.317
  235    HE2  LYS  34           HE3      LYS  34   4.095   9.070  10.443
  236    HE3  LYS  34           HE2      LYS  34   4.544   8.647  12.095
  237    HZ1  LYS  34           HZ1      LYS  34   6.499  10.105  11.843
  238    HZ2  LYS  34           HZ2      LYS  34   5.030  10.944  11.719
  239    HZ3  LYS  34           HZ3      LYS  34   5.923  10.585  10.318
  240    H    SER  35           H        SER  35   4.869   6.084   7.581
  241    HA   SER  35           HA       SER  35   6.875   4.297   6.329
  242    HB2  SER  35           HB3      SER  35   7.210   3.038   8.368
  243    HB3  SER  35           HB2      SER  35   7.552   4.730   8.714
  244    HG   SER  35           HG       SER  35   5.592   3.089   9.682
  245    H    GLY  36           H        GLY  36   6.108   1.984   6.429
  246    HA2  GLY  36           HA3      GLY  36   3.172   1.711   6.723
  247    HA3  GLY  36           HA2      GLY  36   3.885   1.304   5.161
  248    H    TYR  37           H        TYR  37   2.520  -0.542   6.967
  249    HA   TYR  37           HA       TYR  37   4.810  -2.371   7.599
  250    HB2  TYR  37           HB3      TYR  37   2.118  -2.261   8.990
  251    HB3  TYR  37           HB2      TYR  37   3.482  -3.290   9.421
  252    HD1  TYR  37           HD2      TYR  37   2.286   0.222   9.260
  253    HD2  TYR  37           HD1      TYR  37   5.350  -2.444  10.664
  254    HE1  TYR  37           HE2      TYR  37   3.215   2.035  10.675
  255    HE2  TYR  37           HE1      TYR  37   6.280  -0.629  12.077
  256    HH   TYR  37           HH       TYR  37   4.782   2.612  12.128
  257    H    CYS  38           H        CYS  38   4.722  -4.366   6.629
  258    HA   CYS  38           HA       CYS  38   2.335  -4.947   4.942
  259    HB2  CYS  38           HB3      CYS  38   5.225  -5.582   4.791
  260    HB3  CYS  38           HB2      CYS  38   4.145  -6.890   4.315
  261    H    GLN  39           H        GLN  39   0.889  -6.400   5.734
  262    HA   GLN  39           HA       GLN  39   1.919  -8.666   7.348
  263    HB2  GLN  39           HB3      GLN  39  -0.348  -6.840   8.199
  264    HB3  GLN  39           HB2      GLN  39   0.082  -8.354   9.000
  265    HG2  GLN  39           HG3      GLN  39   2.393  -7.453   9.349
  266    HG3  GLN  39           HG2      GLN  39   1.851  -5.912   8.688
  267   HE21  GLN  39          HE22      GLN  39  -0.822  -7.088  10.242
  268   HE22  GLN  39          HE21      GLN  39  -0.595  -6.389  11.771
  269    H    ILE  40           H        ILE  40  -1.147  -9.049   7.909
  270    HA   ILE  40           HA       ILE  40  -1.570 -10.576   5.403
  271    HB   ILE  40           HB       ILE  40  -3.184 -10.615   7.962
  272   HG12  ILE  40          HG13      ILE  40  -1.044 -12.551   7.024
  273   HG13  ILE  40          HG12      ILE  40  -0.775 -11.300   8.239
  274   HG21  ILE  40          HG21      ILE  40  -3.353 -11.987   5.352
  275   HG22  ILE  40          HG22      ILE  40  -4.604 -11.709   6.561
  276   HG23  ILE  40          HG23      ILE  40  -3.475 -13.049   6.754
  277   HD11  ILE  40          HD11      ILE  40  -1.338 -13.599   9.166
  278   HD12  ILE  40          HD12      ILE  40  -2.952 -13.389   8.484
  279   HD13  ILE  40          HD13      ILE  40  -2.372 -12.288   9.735
  280    H    LEU  41           H        LEU  41  -3.250 -10.164   4.015
  281    HA   LEU  41           HA       LEU  41  -4.386  -7.583   3.826
  282    HB2  LEU  41           HB3      LEU  41  -4.254  -9.370   2.027
  283    HB3  LEU  41           HB2      LEU  41  -5.640 -10.140   2.795
  284    HG   LEU  41           HG       LEU  41  -6.656  -7.691   2.622
  285   HD11  LEU  41          HD11      LEU  41  -4.423  -6.911   1.612
  286   HD12  LEU  41          HD12      LEU  41  -5.890  -6.434   0.760
  287   HD13  LEU  41          HD13      LEU  41  -4.916  -7.774   0.156
  288   HD21  LEU  41          HD21      LEU  41  -7.355  -8.422   0.177
  289   HD22  LEU  41          HD22      LEU  41  -7.881  -9.368   1.570
  290   HD23  LEU  41          HD23      LEU  41  -6.505  -9.907   0.607
  291    H    GLY  42           H        GLY  42  -5.567 -10.527   5.368
  292    HA2  GLY  42           HA3      GLY  42  -7.001  -9.490   7.454
  293    HA3  GLY  42           HA2      GLY  42  -8.140  -9.348   6.109
  294    H    THR  43           H        THR  43  -8.310 -11.422   4.756
  295    HA   THR  43           HA       THR  43  -8.467 -13.744   6.615
  296    HB   THR  43           HB       THR  43 -10.144 -14.651   5.063
  297    HG1  THR  43           HG1      THR  43 -10.723 -12.716   3.494
  298   HG21  THR  43          HG21      THR  43 -10.978 -13.184   6.810
  299   HG22  THR  43          HG22      THR  43 -11.878 -12.866   5.327
  300   HG23  THR  43          HG23      THR  43 -10.604 -11.760   5.840
  301    H    TYR  44           H        TYR  44  -8.023 -13.193   3.119
  302    HA   TYR  44           HA       TYR  44  -5.743 -15.128   3.198
  303    HB2  TYR  44           HB3      TYR  44  -7.834 -14.838   1.017
  304    HB3  TYR  44           HB2      TYR  44  -6.437 -15.913   0.958
  305    HD1  TYR  44           HD1      TYR  44  -6.237 -17.800   2.587
  306    HD2  TYR  44           HD2      TYR  44  -9.787 -15.400   2.292
  307    HE1  TYR  44           HE1      TYR  44  -7.511 -19.532   3.823
  308    HE2  TYR  44           HE2      TYR  44 -11.061 -17.132   3.527
  309    HH   TYR  44           HH       TYR  44  -9.464 -20.100   4.699
  310    H    GLY  45           H        GLY  45  -3.997 -14.607   1.778
  311    HA2  GLY  45           HA3      GLY  45  -2.877 -13.268   0.125
  312    HA3  GLY  45           HA2      GLY  45  -4.216 -12.123   0.180
  313    H    ASN  46           H        ASN  46  -1.988 -10.808   0.275
  314    HA   ASN  46           HA       ASN  46  -1.418 -10.275   3.149
  315    HB2  ASN  46           HB3      ASN  46   0.410 -10.167   0.743
  316    HB3  ASN  46           HB2      ASN  46   0.825  -9.472   2.304
  317   HD21  ASN  46          HD22      ASN  46  -0.107 -11.377   4.106
  318   HD22  ASN  46          HD21      ASN  46   0.676 -12.861   3.848
  319    H    GLY  47           H        GLY  47  -1.161  -8.038   3.710
  320    HA2  GLY  47           HA3      GLY  47  -1.823  -6.066   1.583
  321    HA3  GLY  47           HA2      GLY  47  -2.834  -6.113   3.027
  322    H    CYS  48           H        CYS  48  -1.376  -3.813   2.324
  323    HA   CYS  48           HA       CYS  48   0.439  -3.651   4.666
  324    HB2  CYS  48           HB3      CYS  48   1.637  -3.937   2.341
  325    HB3  CYS  48           HB2      CYS  48   1.210  -2.239   2.133
  326    H    TRP  49           H        TRP  49   0.169  -1.752   5.808
  327    HA   TRP  49           HA       TRP  49  -1.682   0.253   4.604
  328    HB2  TRP  49           HB3      TRP  49  -1.414   0.863   7.313
  329    HB3  TRP  49           HB2      TRP  49  -2.779   0.043   6.565
  330    HD1  TRP  49           HD1      TRP  49   0.634  -0.794   8.106
  331    HE1  TRP  49           HE1      TRP  49   0.488  -3.129   9.193
  332    HE3  TRP  49           HE3      TRP  49  -4.118  -2.073   6.777
  333    HZ2  TRP  49           HZ2      TRP  49  -1.408  -5.252   9.459
  334    HZ3  TRP  49           HZ3      TRP  49  -5.071  -4.256   7.462
  335    HH2  TRP  49           HH2      TRP  49  -3.723  -5.845   8.801
  336    H    CYS  50           H        CYS  50  -0.958   2.306   4.278
  337    HA   CYS  50           HA       CYS  50   1.863   2.868   5.062
  338    HB2  CYS  50           HB3      CYS  50   1.041   3.133   2.631
  339    HB3  CYS  50           HB2      CYS  50   0.146   4.539   3.210
  340    H    ILE  51           H        ILE  51   2.182   4.227   6.760
  341    HA   ILE  51           HA       ILE  51  -0.170   5.692   7.816
  342    HB   ILE  51           HB       ILE  51   2.532   5.339   9.131
  343   HG12  ILE  51          HG13      ILE  51   1.770   3.107   8.659
  344   HG13  ILE  51          HG12      ILE  51   1.371   3.428  10.347
  345   HG21  ILE  51          HG21      ILE  51   1.058   5.547  11.185
  346   HG22  ILE  51          HG22      ILE  51  -0.261   5.986  10.100
  347   HG23  ILE  51          HG23      ILE  51   1.172   7.008  10.203
  348   HD11  ILE  51          HD11      ILE  51  -0.613   2.497   9.481
  349   HD12  ILE  51          HD12      ILE  51  -0.469   3.377   7.962
  350   HD13  ILE  51          HD13      ILE  51  -0.918   4.233   9.436
  351    H    ALA  52           H        ALA  52  -0.272   7.903   7.694
  352    HA   ALA  52           HA       ALA  52   2.074   9.585   7.657
  353    HB1  ALA  52           HB1      ALA  52   0.638   9.077   5.041
  354    HB2  ALA  52           HB2      ALA  52   2.348   8.826   5.391
  355    HB3  ALA  52           HB3      ALA  52   1.695  10.463   5.316
  356    H    LEU  53           H        LEU  53  -0.375  10.673   5.528
  357    HA   LEU  53           HA       LEU  53  -1.627  12.229   7.757
  358    HB2  LEU  53           HB3      LEU  53  -0.222  13.632   6.312
  359    HB3  LEU  53           HB2      LEU  53  -1.120  13.081   4.897
  360    HG   LEU  53           HG       LEU  53  -2.989  14.004   6.870
  361   HD11  LEU  53          HD11      LEU  53  -1.151  15.351   7.766
  362   HD12  LEU  53          HD12      LEU  53  -2.299  16.392   6.924
  363   HD13  LEU  53          HD13      LEU  53  -0.777  15.950   6.150
  364   HD21  LEU  53          HD21      LEU  53  -3.513  15.622   5.004
  365   HD22  LEU  53          HD22      LEU  53  -3.476  13.934   4.497
  366   HD23  LEU  53          HD23      LEU  53  -2.112  14.992   4.140
  367    HA   PRO  54           HA       PRO  54  -5.081   9.961   5.736
  368    HB2  PRO  54           HB2      PRO  54  -6.592   9.685   8.011
  369    HB3  PRO  54           HB3      PRO  54  -5.336   8.541   7.515
  370    HG2  PRO  54           HG3      PRO  54  -5.301  10.568   9.643
  371    HG3  PRO  54           HG2      PRO  54  -4.392   9.057   9.501
  372    HD2  PRO  54           HD3      PRO  54  -3.394  11.647   9.020
  373    HD3  PRO  54           HD2      PRO  54  -2.599  10.122   8.576
  374    H    ASP  55           H        ASP  55  -4.847  12.958   7.328
  375    HA   ASP  55           HA       ASP  55  -7.529  13.827   7.517
  376    HB2  ASP  55           HB3      ASP  55  -5.025  15.376   6.794
  377    HB3  ASP  55           HB2      ASP  55  -6.575  16.130   7.169
  378    H    ASN  56           H        ASN  56  -5.394  13.648   4.693
  379    HA   ASN  56           HA       ASN  56  -7.300  15.024   2.966
  380    HB2  ASN  56           HB3      ASN  56  -4.831  13.384   2.333
  381    HB3  ASN  56           HB2      ASN  56  -5.760  14.291   1.139
  382   HD21  ASN  56          HD22      ASN  56  -5.997  16.060   3.946
  383   HD22  ASN  56          HD21      ASN  56  -4.683  17.112   3.727
  384    H    VAL  57           H        VAL  57  -8.738  14.094   1.519
  385    HA   VAL  57           HA       VAL  57 -10.144  11.810   2.061
  386    HB   VAL  57           HB       VAL  57 -10.716  13.400   0.253
  387   HG11  VAL  57          HG11      VAL  57  -8.165  13.078  -0.593
  388   HG12  VAL  57          HG12      VAL  57  -9.457  13.660  -1.642
  389   HG13  VAL  57          HG13      VAL  57  -8.985  11.963  -1.686
  390   HG21  VAL  57          HG21      VAL  57 -10.482  10.600  -0.873
  391   HG22  VAL  57          HG22      VAL  57 -11.747  11.790  -1.185
  392   HG23  VAL  57          HG23      VAL  57 -11.635  11.016   0.396
  393    HA   PRO  58           HA       PRO  58  -6.778   8.866   1.129
  394    HB2  PRO  58           HB2      PRO  58  -7.210   7.135   3.110
  395    HB3  PRO  58           HB3      PRO  58  -6.553   8.750   3.460
  396    HG2  PRO  58           HG3      PRO  58  -9.321   7.718   3.815
  397    HG3  PRO  58           HG2      PRO  58  -8.382   8.815   4.844
  398    HD2  PRO  58           HD3      PRO  58 -10.304   9.588   2.933
  399    HD3  PRO  58           HD2      PRO  58  -9.110  10.657   3.702
  400    H    ILE  59           H        ILE  59  -6.805   6.634   0.338
  401    HA   ILE  59           HA       ILE  59  -7.794   5.084  -1.134
  402    HB   ILE  59           HB       ILE  59  -9.515   4.913   1.346
  403   HG12  ILE  59          HG13      ILE  59  -7.221   3.193   0.357
  404   HG13  ILE  59          HG12      ILE  59  -7.052   4.473   1.560
  405   HG21  ILE  59          HG21      ILE  59  -9.683   3.537  -1.246
  406   HG22  ILE  59          HG22      ILE  59 -10.862   3.611   0.063
  407   HG23  ILE  59          HG23      ILE  59  -9.550   2.435   0.125
  408   HD11  ILE  59          HD11      ILE  59  -9.052   3.159   2.727
  409   HD12  ILE  59          HD12      ILE  59  -7.378   2.657   2.961
  410   HD13  ILE  59          HD13      ILE  59  -8.398   1.811   1.798
  411    H    ARG  60           H        ARG  60  -8.541   7.293  -2.268
  412    HA   ARG  60           HA       ARG  60 -11.212   8.174  -2.239
  413    HB2  ARG  60           HB3      ARG  60  -9.486   7.742  -4.702
  414    HB3  ARG  60           HB2      ARG  60 -10.851   8.849  -4.567
  415    HG2  ARG  60           HG3      ARG  60  -9.688  10.228  -2.994
  416    HG3  ARG  60           HG2      ARG  60  -8.401   9.034  -2.807
  417    HD2  ARG  60           HD3      ARG  60  -7.565  10.736  -4.290
  418    HD3  ARG  60           HD2      ARG  60  -7.916   9.311  -5.271
  419    HE   ARG  60           HE       ARG  60 -10.133  11.218  -5.117
  420   HH11  ARG  60          HH22      ARG  60  -7.238  10.210  -6.693
  421   HH12  ARG  60          HH21      ARG  60  -7.636  10.964  -8.200
  422   HH21  ARG  60          HH11      ARG  60 -10.673  12.207  -7.078
  423   HH22  ARG  60          HH12      ARG  60  -9.583  12.093  -8.419
  424    H    ILE  61           H        ILE  61  -9.734   5.350  -3.678
  425    HA   ILE  61           HA       ILE  61 -11.865   4.439  -5.298
  426    HB   ILE  61           HB       ILE  61  -9.506   3.216  -3.944
  427   HG12  ILE  61          HG13      ILE  61  -8.847   2.739  -6.214
  428   HG13  ILE  61          HG12      ILE  61 -10.456   3.131  -6.819
  429   HG21  ILE  61          HG21      ILE  61 -11.015   1.431  -3.576
  430   HG22  ILE  61          HG22      ILE  61 -10.230   1.021  -5.100
  431   HG23  ILE  61          HG23      ILE  61 -11.852   1.710  -5.103
  432   HD11  ILE  61          HD11      ILE  61 -10.171   5.431  -6.464
  433   HD12  ILE  61          HD12      ILE  61  -8.564   4.932  -6.991
  434   HD13  ILE  61          HD13      ILE  61  -8.889   5.185  -5.278
  435    HA   PRO  62           HA       PRO  62 -14.997   3.502  -2.182
  436    HB2  PRO  62           HB2      PRO  62 -15.642   1.242  -4.015
  437    HB3  PRO  62           HB3      PRO  62 -16.712   2.477  -3.328
  438    HG2  PRO  62           HG3      PRO  62 -15.889   2.517  -5.887
  439    HG3  PRO  62           HG2      PRO  62 -16.243   3.984  -4.964
  440    HD2  PRO  62           HD3      PRO  62 -13.629   2.930  -5.855
  441    HD3  PRO  62           HD2      PRO  62 -14.088   4.582  -5.390
  442    H    GLY  63           H        GLY  63 -12.746   1.146  -3.474
  443    HA2  GLY  63           HA3      GLY  63 -11.610  -0.022  -1.420
  444    HA3  GLY  63           HA2      GLY  63 -13.236  -0.652  -1.161
  445    H    LYS  64           H        LYS  64 -12.823  -0.281  -4.436
  446    HA   LYS  64           HA       LYS  64 -12.126  -3.157  -4.733
  447    HB2  LYS  64           HB3      LYS  64 -13.571  -1.289  -6.639
  448    HB3  LYS  64           HB2      LYS  64 -13.269  -3.003  -6.922
  449    HG2  LYS  64           HG3      LYS  64 -14.790  -1.972  -4.514
  450    HG3  LYS  64           HG2      LYS  64 -15.582  -2.442  -6.018
  451    HD2  LYS  64           HD3      LYS  64 -15.563  -4.580  -5.317
  452    HD3  LYS  64           HD2      LYS  64 -13.801  -4.552  -5.363
  453    HE2  LYS  64           HE3      LYS  64 -13.683  -3.795  -3.074
  454    HE3  LYS  64           HE2      LYS  64 -15.430  -3.558  -3.009
  455    HZ1  LYS  64           HZ1      LYS  64 -15.535  -6.030  -3.596
  456    HZ2  LYS  64           HZ2      LYS  64 -15.115  -5.607  -2.008
  457    HZ3  LYS  64           HZ3      LYS  64 -13.910  -6.085  -3.106
  458    H    CYS  65           H        CYS  65 -10.239  -3.653  -5.734
  459    HA   CYS  65           HA       CYS  65  -8.289  -1.693  -6.374
  460    HB2  CYS  65           HB3      CYS  65  -8.591  -4.566  -7.270
  461    HB3  CYS  65           HB2      CYS  65  -7.147  -3.597  -7.564
  462    H    HIS  66           H        HIS  66 -10.860  -3.106  -8.291
  463    HA   HIS  66           HA       HIS  66 -10.409  -1.095 -10.378
  464    HB2  HIS  66           HB3      HIS  66 -10.217  -4.055 -11.015
  465    HB3  HIS  66           HB2      HIS  66 -10.248  -2.754 -12.205
  466    HD1  HIS  66           HD1      HIS  66  -8.216  -0.963 -11.986
  467    HD2  HIS  66           HD2      HIS  66  -7.682  -4.594 -10.005
  468    HE1  HIS  66           HE1      HIS  66  -5.739  -1.145 -11.476
  469    HE2  HIS  66           HE2      HIS  66  -5.405  -3.352 -10.270
  Start of MODEL   20
    1    H1   ALA   1           H1       ALA   1  -7.031   8.306   7.163
    2    H2   ALA   1           H2       ALA   1  -8.315   8.968   6.267
    3    H3   ALA   1           H3       ALA   1  -7.600   9.864   7.521
    4    HA   ALA   1           HA       ALA   1  -6.891   9.778   4.803
    5    HB1  ALA   1           HB1      ALA   1  -5.558  11.157   7.153
    6    HB2  ALA   1           HB2      ALA   1  -6.997  11.763   6.333
    7    HB3  ALA   1           HB3      ALA   1  -5.469  11.641   5.460
    8    H    ARG   2           H        ARG   2  -6.232   7.219   5.680
    9    HA   ARG   2           HA       ARG   2  -3.267   7.295   5.396
   10    HB2  ARG   2           HB3      ARG   2  -2.997   5.556   7.079
   11    HB3  ARG   2           HB2      ARG   2  -3.871   6.907   7.802
   12    HG2  ARG   2           HG3      ARG   2  -6.021   5.695   7.223
   13    HG3  ARG   2           HG2      ARG   2  -5.031   4.299   6.791
   14    HD2  ARG   2           HD3      ARG   2  -4.040   4.350   9.085
   15    HD3  ARG   2           HD2      ARG   2  -5.152   5.653   9.502
   16    HE   ARG   2           HE       ARG   2  -6.878   3.742   8.624
   17   HH11  ARG   2          HH22      ARG   2  -4.139   3.674  10.716
   18   HH12  ARG   2          HH21      ARG   2  -4.740   2.366  11.680
   19   HH21  ARG   2          HH11      ARG   2  -7.679   2.034   9.870
   20   HH22  ARG   2          HH12      ARG   2  -6.746   1.438  11.200
   21    H    ASP   3           H        ASP   3  -2.461   5.015   4.762
   22    HA   ASP   3           HA       ASP   3  -4.327   3.936   2.725
   23    HB2  ASP   3           HB3      ASP   3  -1.377   3.434   3.226
   24    HB3  ASP   3           HB2      ASP   3  -2.307   2.697   1.922
   25    H    ALA   4           H        ALA   4  -5.056   1.777   2.807
   26    HA   ALA   4           HA       ALA   4  -4.593   0.425   5.416
   27    HB1  ALA   4           HB1      ALA   4  -6.865   0.426   3.454
   28    HB2  ALA   4           HB2      ALA   4  -6.896   0.743   5.189
   29    HB3  ALA   4           HB3      ALA   4  -6.682  -0.905   4.598
   30    H    TYR   5           H        TYR   5  -5.760  -1.095   2.443
   31    HA   TYR   5           HA       TYR   5  -3.622  -3.131   2.791
   32    HB2  TYR   5           HB3      TYR   5  -5.906  -3.313   0.836
   33    HB3  TYR   5           HB2      TYR   5  -5.018  -4.620   1.619
   34    HD1  TYR   5           HD2      TYR   5  -5.238  -4.882   4.161
   35    HD2  TYR   5           HD1      TYR   5  -7.862  -2.428   1.806
   36    HE1  TYR   5           HE2      TYR   5  -6.911  -4.914   5.993
   37    HE2  TYR   5           HE1      TYR   5  -9.535  -2.460   3.637
   38    HH   TYR   5           HH       TYR   5  -9.563  -2.807   6.095
   39    H    ILE   6           H        ILE   6  -4.524  -0.537   0.694
   40    HA   ILE   6           HA       ILE   6  -2.676  -1.549  -1.410
   41    HB   ILE   6           HB       ILE   6  -4.670   0.727  -1.539
   42   HG12  ILE   6          HG13      ILE   6  -4.833  -2.093  -2.651
   43   HG13  ILE   6          HG12      ILE   6  -5.732  -1.507  -1.251
   44   HG21  ILE   6          HG21      ILE   6  -2.469   0.055  -3.179
   45   HG22  ILE   6          HG22      ILE   6  -3.754   1.208  -3.536
   46   HG23  ILE   6          HG23      ILE   6  -3.908  -0.473  -4.051
   47   HD11  ILE   6          HD11      ILE   6  -6.576   0.360  -2.830
   48   HD12  ILE   6          HD12      ILE   6  -7.256  -1.254  -3.035
   49   HD13  ILE   6          HD13      ILE   6  -6.004  -0.679  -4.135
   50    H    ALA   7           H        ALA   7  -0.769  -0.532  -1.759
   51    HA   ALA   7           HA       ALA   7  -0.285   2.050  -0.337
   52    HB1  ALA   7           HB1      ALA   7   1.221  -0.470  -0.405
   53    HB2  ALA   7           HB2      ALA   7   1.307   0.857   0.753
   54    HB3  ALA   7           HB3      ALA   7   2.208   0.948  -0.760
   55    H    LYS   8           H        LYS   8  -1.119   1.192  -3.198
   56    HA   LYS   8           HA       LYS   8   0.974   2.785  -4.609
   57    HB2  LYS   8           HB3      LYS   8  -0.615   1.030  -6.325
   58    HB3  LYS   8           HB2      LYS   8   1.134   1.216  -6.237
   59    HG2  LYS   8           HG3      LYS   8  -0.514  -0.399  -4.264
   60    HG3  LYS   8           HG2      LYS   8   0.370  -1.082  -5.623
   61    HD2  LYS   8           HD3      LYS   8   2.073   0.690  -4.085
   62    HD3  LYS   8           HD2      LYS   8   1.386  -0.571  -3.059
   63    HE2  LYS   8           HE3      LYS   8   2.111  -2.269  -4.754
   64    HE3  LYS   8           HE2      LYS   8   2.914  -0.978  -5.646
   65    HZ1  LYS   8           HZ1      LYS   8   4.108  -2.427  -3.767
   66    HZ2  LYS   8           HZ2      LYS   8   3.533  -1.147  -2.814
   67    HZ3  LYS   8           HZ3      LYS   8   4.553  -0.829  -4.134
   68    HA   PRO   9           HA       PRO   9  -2.240   5.568  -5.770
   69    HB2  PRO   9           HB2      PRO   9  -1.552   6.108  -8.401
   70    HB3  PRO   9           HB3      PRO   9  -0.802   6.862  -6.984
   71    HG2  PRO   9           HG3      PRO   9   0.177   4.639  -8.687
   72    HG3  PRO   9           HG2      PRO   9   1.081   5.932  -7.880
   73    HD2  PRO   9           HD3      PRO   9   1.003   3.377  -6.927
   74    HD3  PRO   9           HD2      PRO   9   1.180   4.793  -5.866
   75    H    HIS  10           H        HIS  10  -1.608   2.945  -8.082
   76    HA   HIS  10           HA       HIS  10  -4.540   2.679  -8.448
   77    HB2  HIS  10           HB3      HIS  10  -2.536   2.784 -10.723
   78    HB3  HIS  10           HB2      HIS  10  -4.250   2.402 -10.892
   79    HD1  HIS  10           HD1      HIS  10  -1.892   5.246 -10.290
   80    HD2  HIS  10           HD2      HIS  10  -6.012   4.636 -10.525
   81    HE1  HIS  10           HE1      HIS  10  -2.951   7.545 -10.429
   82    HE2  HIS  10           HE2      HIS  10  -5.457   7.184 -10.573
   83    H    ASN  11           H        ASN  11  -1.597   1.307  -7.759
   84    HA   ASN  11           HA       ASN  11  -2.452  -1.394  -8.710
   85    HB2  ASN  11           HB3      ASN  11   0.285  -0.448  -7.809
   86    HB3  ASN  11           HB2      ASN  11  -0.103  -2.050  -8.437
   87   HD21  ASN  11          HD22      ASN  11   0.708   1.200  -9.333
   88   HD22  ASN  11          HD21      ASN  11   0.533   1.006 -11.010
   89    H    CYS  12           H        CYS  12  -1.670  -3.176  -7.112
   90    HA   CYS  12           HA       CYS  12  -2.247  -2.279  -4.313
   91    HB2  CYS  12           HB3      CYS  12  -2.921  -5.015  -5.391
   92    HB3  CYS  12           HB2      CYS  12  -3.562  -4.211  -3.957
   93    H    VAL  13           H        VAL  13  -1.529  -4.192  -2.757
   94    HA   VAL  13           HA       VAL  13   1.291  -4.811  -3.490
   95    HB   VAL  13           HB       VAL  13  -0.079  -4.929  -0.784
   96   HG11  VAL  13          HG11      VAL  13   1.854  -6.402  -0.895
   97   HG12  VAL  13          HG12      VAL  13   2.295  -4.966   0.031
   98   HG13  VAL  13          HG13      VAL  13   2.823  -5.131  -1.643
   99   HG21  VAL  13          HG21      VAL  13   1.063  -2.730  -2.348
  100   HG22  VAL  13          HG22      VAL  13   1.819  -2.899  -0.764
  101   HG23  VAL  13          HG23      VAL  13   0.074  -2.670  -0.889
  102    H    TYR  14           H        TYR  14   1.979  -6.940  -3.632
  103    HA   TYR  14           HA       TYR  14  -0.153  -8.993  -3.619
  104    HB2  TYR  14           HB3      TYR  14   2.513  -9.979  -4.223
  105    HB3  TYR  14           HB2      TYR  14   1.076  -9.959  -5.247
  106    HD1  TYR  14           HD2      TYR  14   0.418  -7.658  -6.292
  107    HD2  TYR  14           HD1      TYR  14   4.310  -8.557  -4.712
  108    HE1  TYR  14           HE2      TYR  14   1.384  -5.794  -7.611
  109    HE2  TYR  14           HE1      TYR  14   5.277  -6.693  -6.032
  110    HH   TYR  14           HH       TYR  14   4.879  -5.077  -7.492
  111    H    GLU  15           H        GLU  15   3.207  -8.836  -2.392
  112    HA   GLU  15           HA       GLU  15   2.491  -9.623   0.273
  113    HB2  GLU  15           HB3      GLU  15   2.013 -11.772  -0.941
  114    HB3  GLU  15           HB2      GLU  15   3.708 -11.819  -1.429
  115    HG2  GLU  15           HG3      GLU  15   4.367 -11.761   0.974
  116    HG3  GLU  15           HG2      GLU  15   2.660 -11.831   1.417
  117    H    CYS  16           H        CYS  16   4.020  -8.108   0.940
  118    HA   CYS  16           HA       CYS  16   6.553  -7.625  -0.154
  119    HB2  CYS  16           HB3      CYS  16   7.175  -6.730   2.045
  120    HB3  CYS  16           HB2      CYS  16   5.518  -6.272   1.653
  121    H    PHE  17           H        PHE  17   7.832  -9.333  -0.727
  122    HA   PHE  17           HA       PHE  17   8.041 -11.809   0.643
  123    HB2  PHE  17           HB3      PHE  17   9.889 -12.277  -0.780
  124    HB3  PHE  17           HB2      PHE  17   8.833 -11.227  -1.723
  125    HD1  PHE  17           HD2      PHE  17   9.345  -8.745  -1.845
  126    HD2  PHE  17           HD1      PHE  17  12.095 -11.605  -0.195
  127    HE1  PHE  17           HE2      PHE  17  11.192  -7.111  -2.088
  128    HE2  PHE  17           HE1      PHE  17  13.941  -9.968  -0.437
  129    HZ   PHE  17           HZ       PHE  17  13.490  -7.721  -1.383
  130    H    ASP  18           H        ASP  18   9.945  -8.831   0.964
  131    HA   ASP  18           HA       ASP  18  10.885  -9.840   3.587
  132    HB2  ASP  18           HB3      ASP  18  12.640 -10.360   1.853
  133    HB3  ASP  18           HB2      ASP  18  12.773  -8.627   1.553
  134    H    ALA  19           H        ALA  19   9.541  -8.252   4.558
  135    HA   ALA  19           HA       ALA  19   9.478  -5.503   3.775
  136    HB1  ALA  19           HB1      ALA  19   9.104  -6.480   6.609
  137    HB2  ALA  19           HB2      ALA  19   7.883  -6.744   5.363
  138    HB3  ALA  19           HB3      ALA  19   8.337  -5.101   5.820
  139    H    PHE  20           H        PHE  20  11.764  -7.378   5.615
  140    HA   PHE  20           HA       PHE  20  13.059  -5.379   7.124
  141    HB2  PHE  20           HB3      PHE  20  13.613  -7.823   7.187
  142    HB3  PHE  20           HB2      PHE  20  14.411  -7.643   5.624
  143    HD1  PHE  20           HD1      PHE  20  14.495  -6.626   9.189
  144    HD2  PHE  20           HD2      PHE  20  16.564  -6.592   5.425
  145    HE1  PHE  20           HE1      PHE  20  16.553  -5.839  10.328
  146    HE2  PHE  20           HE2      PHE  20  18.622  -5.805   6.564
  147    HZ   PHE  20           HZ       PHE  20  18.616  -5.429   9.015
  148    H    SER  21           H        SER  21  13.359  -6.202   3.692
  149    HA   SER  21           HA       SER  21  15.465  -4.236   3.222
  150    HB2  SER  21           HB3      SER  21  13.664  -5.761   1.315
  151    HB3  SER  21           HB2      SER  21  14.999  -4.729   0.810
  152    HG   SER  21           HG       SER  21  15.118  -7.052   2.443
  153    H    SER  22           H        SER  22  12.441  -3.797   4.171
  154    HA   SER  22           HA       SER  22  10.932  -2.014   4.043
  155    HB2  SER  22           HB3      SER  22  11.837   0.113   3.657
  156    HB3  SER  22           HB2      SER  22  13.247  -0.814   4.160
  157    HG   SER  22           HG       SER  22  13.242   0.537   2.089
  158    H    TYR  23           H        TYR  23  10.870  -4.033   1.941
  159    HA   TYR  23           HA       TYR  23  10.644  -2.856  -0.656
  160    HB2  TYR  23           HB3      TYR  23  10.706  -5.310  -0.263
  161    HB3  TYR  23           HB2      TYR  23   9.105  -5.214   0.474
  162    HD1  TYR  23           HD2      TYR  23  11.010  -4.908  -2.675
  163    HD2  TYR  23           HD1      TYR  23   7.118  -4.818  -0.860
  164    HE1  TYR  23           HE2      TYR  23   9.960  -5.040  -4.918
  165    HE2  TYR  23           HE1      TYR  23   6.068  -4.949  -3.103
  166    HH   TYR  23           HH       TYR  23   7.955  -5.564  -5.980
  167    H    CYS  24           H        CYS  24   8.095  -3.651   1.718
  168    HA   CYS  24           HA       CYS  24   6.050  -2.193   0.282
  169    HB2  CYS  24           HB3      CYS  24   5.456  -3.994   1.846
  170    HB3  CYS  24           HB2      CYS  24   6.171  -3.087   3.179
  171    H    ASN  25           H        ASN  25   7.865  -1.522   3.272
  172    HA   ASN  25           HA       ASN  25   6.877   1.103   3.695
  173    HB2  ASN  25           HB3      ASN  25   9.646   0.035   4.329
  174    HB3  ASN  25           HB2      ASN  25   8.881   1.440   5.073
  175   HD21  ASN  25          HD22      ASN  25   6.584  -0.999   4.409
  176   HD22  ASN  25          HD21      ASN  25   6.505  -1.678   5.962
  177    H    GLY  26           H        GLY  26   9.505  -0.118   1.685
  178    HA2  GLY  26           HA3      GLY  26  10.663   2.382   0.969
  179    HA3  GLY  26           HA2      GLY  26  10.727   0.924  -0.025
  180    H    VAL  27           H        VAL  27   7.970   0.543  -0.490
  181    HA   VAL  27           HA       VAL  27   7.529   2.307  -2.686
  182    HB   VAL  27           HB       VAL  27   5.618   0.535  -1.144
  183   HG11  VAL  27          HG11      VAL  27   4.187   0.803  -3.226
  184   HG12  VAL  27          HG12      VAL  27   5.229   2.151  -3.675
  185   HG13  VAL  27          HG13      VAL  27   4.275   2.230  -2.194
  186   HG21  VAL  27          HG21      VAL  27   7.588  -0.423  -2.504
  187   HG22  VAL  27          HG22      VAL  27   6.735   0.170  -3.929
  188   HG23  VAL  27          HG23      VAL  27   5.981  -1.039  -2.890
  189    H    CYS  28           H        CYS  28   6.092   2.275   0.582
  190    HA   CYS  28           HA       CYS  28   4.531   4.664   0.120
  191    HB2  CYS  28           HB3      CYS  28   5.273   3.029   2.517
  192    HB3  CYS  28           HB2      CYS  28   4.639   4.656   2.774
  193    H    THR  29           H        THR  29   7.782   4.031   1.324
  194    HA   THR  29           HA       THR  29   8.373   6.570   2.433
  195    HB   THR  29           HB       THR  29  10.260   4.820   0.825
  196    HG1  THR  29           HG1      THR  29  10.280   4.634   3.553
  197   HG21  THR  29          HG21      THR  29  10.601   7.011   2.868
  198   HG22  THR  29          HG22      THR  29  11.362   6.852   1.285
  199   HG23  THR  29          HG23      THR  29  11.861   5.803   2.612
  200    H    LYS  30           H        LYS  30   8.855   5.415  -0.906
  201    HA   LYS  30           HA       LYS  30   9.751   7.944  -1.926
  202    HB2  LYS  30           HB3      LYS  30   8.550   5.499  -3.238
  203    HB3  LYS  30           HB2      LYS  30   9.080   6.906  -4.162
  204    HG2  LYS  30           HG3      LYS  30  11.280   6.426  -3.862
  205    HG3  LYS  30           HG2      LYS  30  11.043   5.973  -2.175
  206    HD2  LYS  30           HD3      LYS  30  10.476   3.770  -2.704
  207    HD3  LYS  30           HD2      LYS  30  10.032   4.177  -4.364
  208    HE2  LYS  30           HE3      LYS  30  12.177   4.012  -5.110
  209    HE3  LYS  30           HE2      LYS  30  12.841   4.763  -3.658
  210    HZ1  LYS  30           HZ1      LYS  30  12.738   2.046  -4.303
  211    HZ2  LYS  30           HZ2      LYS  30  11.735   2.287  -2.957
  212    HZ3  LYS  30           HZ3      LYS  30  13.364   2.769  -2.899
  213    H    ASN  31           H        ASN  31   6.569   6.439  -1.639
  214    HA   ASN  31           HA       ASN  31   5.076   8.327  -3.153
  215    HB2  ASN  31           HB3      ASN  31   4.243   6.794  -0.668
  216    HB3  ASN  31           HB2      ASN  31   3.141   7.589  -1.795
  217   HD21  ASN  31          HD22      ASN  31   4.349   6.889  -4.267
  218   HD22  ASN  31          HD21      ASN  31   4.264   5.206  -4.465
  219    H    GLY  32           H        GLY  32   6.537   8.510  -0.003
  220    HA2  GLY  32           HA3      GLY  32   7.017  10.704   0.973
  221    HA3  GLY  32           HA2      GLY  32   5.526  11.306   0.245
  222    H    ALA  33           H        ALA  33   4.883   8.264   1.372
  223    HA   ALA  33           HA       ALA  33   3.169   9.183   3.470
  224    HB1  ALA  33           HB1      ALA  33   3.822   6.454   3.932
  225    HB2  ALA  33           HB2      ALA  33   3.775   6.690   2.185
  226    HB3  ALA  33           HB3      ALA  33   2.371   7.100   3.169
  227    H    LYS  34           H        LYS  34   3.466   9.128   5.740
  228    HA   LYS  34           HA       LYS  34   6.072   9.689   6.724
  229    HB2  LYS  34           HB3      LYS  34   3.916  10.280   7.874
  230    HB3  LYS  34           HB2      LYS  34   3.747   8.583   8.322
  231    HG2  LYS  34           HG3      LYS  34   6.322   9.109   9.123
  232    HG3  LYS  34           HG2      LYS  34   5.527  10.651   9.438
  233    HD2  LYS  34           HD3      LYS  34   4.477   7.967  10.382
  234    HD3  LYS  34           HD2      LYS  34   5.413   9.079  11.381
  235    HE2  LYS  34           HE3      LYS  34   3.316  10.579  10.164
  236    HE3  LYS  34           HE2      LYS  34   2.601   9.122  10.855
  237    HZ1  LYS  34           HZ1      LYS  34   3.905   9.649  12.913
  238    HZ2  LYS  34           HZ2      LYS  34   2.642  10.724  12.562
  239    HZ3  LYS  34           HZ3      LYS  34   4.248  11.166  12.228
  240    H    SER  35           H        SER  35   4.132   6.691   7.086
  241    HA   SER  35           HA       SER  35   6.682   5.179   7.172
  242    HB2  SER  35           HB3      SER  35   6.084   3.996   9.193
  243    HB3  SER  35           HB2      SER  35   5.992   5.722   9.532
  244    HG   SER  35           HG       SER  35   3.810   4.062   8.778
  245    H    GLY  36           H        GLY  36   6.236   2.775   7.055
  246    HA2  GLY  36           HA3      GLY  36   3.622   2.119   5.832
  247    HA3  GLY  36           HA2      GLY  36   5.066   1.813   4.877
  248    H    TYR  37           H        TYR  37   2.939   0.084   6.397
  249    HA   TYR  37           HA       TYR  37   4.962  -1.767   7.595
  250    HB2  TYR  37           HB3      TYR  37   2.140  -1.280   8.591
  251    HB3  TYR  37           HB2      TYR  37   3.292  -2.428   9.272
  252    HD1  TYR  37           HD1      TYR  37   5.434  -1.582  10.294
  253    HD2  TYR  37           HD2      TYR  37   2.244   1.045   9.124
  254    HE1  TYR  37           HE1      TYR  37   6.403   0.221  11.697
  255    HE2  TYR  37           HE2      TYR  37   3.212   2.847  10.526
  256    HH   TYR  37           HH       TYR  37   6.366   2.571  11.951
  257    H    CYS  38           H        CYS  38   4.796  -3.877   6.910
  258    HA   CYS  38           HA       CYS  38   2.562  -4.487   5.019
  259    HB2  CYS  38           HB3      CYS  38   4.680  -4.654   3.902
  260    HB3  CYS  38           HB2      CYS  38   5.372  -5.592   5.226
  261    H    GLN  39           H        GLN  39   1.138  -6.025   5.616
  262    HA   GLN  39           HA       GLN  39   1.967  -8.009   7.683
  263    HB2  GLN  39           HB3      GLN  39   0.204  -5.877   8.139
  264    HB3  GLN  39           HB2      GLN  39  -0.837  -7.280   7.912
  265    HG2  GLN  39           HG3      GLN  39  -0.339  -7.304  10.225
  266    HG3  GLN  39           HG2      GLN  39   0.766  -8.494   9.538
  267   HE21  GLN  39          HE22      GLN  39   1.072  -4.921   9.366
  268   HE22  GLN  39          HE21      GLN  39   2.534  -4.851  10.222
  269    H    ILE  40           H        ILE  40   0.226  -9.833   7.757
  270    HA   ILE  40           HA       ILE  40  -0.375 -10.523   4.936
  271    HB   ILE  40           HB       ILE  40  -0.577 -12.822   5.724
  272   HG12  ILE  40          HG13      ILE  40  -0.180 -11.607   8.478
  273   HG13  ILE  40          HG12      ILE  40  -1.650 -12.380   7.885
  274   HG21  ILE  40          HG21      ILE  40   1.683 -13.163   6.067
  275   HG22  ILE  40          HG22      ILE  40   1.814 -11.843   7.229
  276   HG23  ILE  40          HG23      ILE  40   1.721 -11.493   5.503
  277   HD11  ILE  40          HD11      ILE  40   0.164 -14.338   7.375
  278   HD12  ILE  40          HD12      ILE  40  -0.770 -14.239   8.869
  279   HD13  ILE  40          HD13      ILE  40   0.876 -13.608   8.814
  280    H    LEU  41           H        LEU  41  -2.474 -10.701   4.204
  281    HA   LEU  41           HA       LEU  41  -4.648 -10.573   6.239
  282    HB2  LEU  41           HB3      LEU  41  -4.221  -8.354   5.068
  283    HB3  LEU  41           HB2      LEU  41  -4.745  -9.144   3.581
  284    HG   LEU  41           HG       LEU  41  -6.886  -9.761   4.718
  285   HD11  LEU  41          HD11      LEU  41  -6.632  -9.726   7.002
  286   HD12  LEU  41          HD12      LEU  41  -7.211  -8.073   6.791
  287   HD13  LEU  41          HD13      LEU  41  -5.484  -8.387   6.960
  288   HD21  LEU  41          HD21      LEU  41  -6.577  -7.679   3.310
  289   HD22  LEU  41          HD22      LEU  41  -6.330  -6.783   4.808
  290   HD23  LEU  41          HD23      LEU  41  -7.877  -7.570   4.497
  291    H    GLY  42           H        GLY  42  -6.057 -12.224   5.999
  292    HA2  GLY  42           HA3      GLY  42  -5.825 -14.126   3.862
  293    HA3  GLY  42           HA2      GLY  42  -7.130 -14.078   5.046
  294    H    THR  43           H        THR  43  -7.778 -11.239   4.282
  295    HA   THR  43           HA       THR  43  -9.830 -11.787   2.397
  296    HB   THR  43           HB       THR  43  -8.531  -9.103   2.932
  297    HG1  THR  43           HG1      THR  43  -9.434 -10.529   4.726
  298   HG21  THR  43          HG21      THR  43 -11.346  -9.814   2.068
  299   HG22  THR  43          HG22      THR  43 -10.084  -9.239   0.978
  300   HG23  THR  43          HG23      THR  43 -10.684  -8.192   2.265
  301    H    TYR  44           H        TYR  44  -6.648 -10.264   1.906
  302    HA   TYR  44           HA       TYR  44  -6.930 -10.887  -1.009
  303    HB2  TYR  44           HB3      TYR  44  -5.604  -8.472   0.264
  304    HB3  TYR  44           HB2      TYR  44  -5.564  -8.856  -1.457
  305    HD1  TYR  44           HD2      TYR  44  -7.753  -9.006  -2.735
  306    HD2  TYR  44           HD1      TYR  44  -7.483  -7.391   1.235
  307    HE1  TYR  44           HE2      TYR  44  -9.950  -7.896  -3.038
  308    HE2  TYR  44           HE1      TYR  44  -9.681  -6.282   0.934
  309    HH   TYR  44           HH       TYR  44 -11.217  -6.055  -2.134
  310    H    GLY  45           H        GLY  45  -5.564 -12.106   1.519
  311    HA2  GLY  45           HA3      GLY  45  -3.692 -13.569   1.618
  312    HA3  GLY  45           HA2      GLY  45  -3.123 -12.897   0.088
  313    H    ASN  46           H        ASN  46  -2.756 -10.304   0.459
  314    HA   ASN  46           HA       ASN  46  -1.331  -9.913   3.021
  315    HB2  ASN  46           HB3      ASN  46   0.167 -10.712   0.988
  316    HB3  ASN  46           HB2      ASN  46   0.035  -9.015   0.518
  317   HD21  ASN  46          HD22      ASN  46   1.215  -7.460   1.747
  318   HD22  ASN  46          HD21      ASN  46   2.204  -7.873   3.064
  319    H    GLY  47           H        GLY  47  -1.233  -7.726   3.676
  320    HA2  GLY  47           HA3      GLY  47  -2.412  -5.724   1.817
  321    HA3  GLY  47           HA2      GLY  47  -3.142  -5.930   3.410
  322    H    CYS  48           H        CYS  48  -1.324  -3.804   1.922
  323    HA   CYS  48           HA       CYS  48   0.609  -3.432   4.167
  324    HB2  CYS  48           HB3      CYS  48   0.764  -3.031   1.262
  325    HB3  CYS  48           HB2      CYS  48   1.327  -1.640   2.186
  326    H    TRP  49           H        TRP  49   0.167  -1.735   5.538
  327    HA   TRP  49           HA       TRP  49  -1.664   0.396   4.522
  328    HB2  TRP  49           HB3      TRP  49  -2.564   0.654   6.745
  329    HB3  TRP  49           HB2      TRP  49  -2.641  -1.056   6.341
  330    HD1  TRP  49           HD1      TRP  49  -0.229   1.359   8.183
  331    HE1  TRP  49           HE1      TRP  49   0.820   0.077  10.154
  332    HE3  TRP  49           HE3      TRP  49  -2.314  -3.245   7.449
  333    HZ2  TRP  49           HZ2      TRP  49   0.777  -2.552  11.278
  334    HZ3  TRP  49           HZ3      TRP  49  -1.799  -5.116   8.989
  335    HH2  TRP  49           HH2      TRP  49  -0.258  -4.775  10.902
  336    H    CYS  50           H        CYS  50  -1.001   2.503   4.801
  337    HA   CYS  50           HA       CYS  50   1.566   2.917   6.280
  338    HB2  CYS  50           HB3      CYS  50   0.722   4.188   3.656
  339    HB3  CYS  50           HB2      CYS  50   2.163   4.627   4.571
  340    H    ILE  51           H        ILE  51   1.796   5.075   7.198
  341    HA   ILE  51           HA       ILE  51  -0.859   6.331   7.723
  342    HB   ILE  51           HB       ILE  51   1.665   6.575   9.379
  343   HG12  ILE  51          HG13      ILE  51   1.032   4.247   9.427
  344   HG13  ILE  51          HG12      ILE  51   0.455   4.972  10.927
  345   HG21  ILE  51          HG21      ILE  51  -0.153   8.336   9.557
  346   HG22  ILE  51          HG22      ILE  51   0.208   7.487  11.060
  347   HG23  ILE  51          HG23      ILE  51  -1.228   7.061  10.130
  348   HD11  ILE  51          HD11      ILE  51  -1.125   4.133   8.508
  349   HD12  ILE  51          HD12      ILE  51  -1.755   5.377   9.589
  350   HD13  ILE  51          HD13      ILE  51  -1.415   3.760  10.204
  351    H    ALA  52           H        ALA  52  -1.161   8.281   6.801
  352    HA   ALA  52           HA       ALA  52   0.716  10.418   6.842
  353    HB1  ALA  52           HB1      ALA  52   1.557   8.631   4.987
  354    HB2  ALA  52           HB2      ALA  52   1.789  10.370   4.818
  355    HB3  ALA  52           HB3      ALA  52   0.442   9.577   4.004
  356    H    LEU  53           H        LEU  53  -0.173  11.358   4.110
  357    HA   LEU  53           HA       LEU  53  -3.088  11.711   4.649
  358    HB2  LEU  53           HB3      LEU  53  -1.736  13.686   5.448
  359    HB3  LEU  53           HB2      LEU  53  -1.228  13.936   3.777
  360    HG   LEU  53           HG       LEU  53  -3.814  13.846   3.285
  361   HD11  LEU  53          HD11      LEU  53  -3.947  13.386   5.961
  362   HD12  LEU  53          HD12      LEU  53  -5.248  14.142   5.040
  363   HD13  LEU  53          HD13      LEU  53  -4.104  15.142   5.936
  364   HD21  LEU  53          HD21      LEU  53  -2.829  15.871   2.741
  365   HD22  LEU  53          HD22      LEU  53  -2.106  16.066   4.338
  366   HD23  LEU  53          HD23      LEU  53  -3.824  16.387   4.103
  367    HA   PRO  54           HA       PRO  54  -2.368  10.719   0.212
  368    HB2  PRO  54           HB2      PRO  54  -3.849   8.439   0.129
  369    HB3  PRO  54           HB3      PRO  54  -2.156   8.465   0.651
  370    HG2  PRO  54           HG3      PRO  54  -4.598   8.114   2.238
  371    HG3  PRO  54           HG2      PRO  54  -2.935   7.629   2.596
  372    HD2  PRO  54           HD3      PRO  54  -4.340   9.925   3.599
  373    HD3  PRO  54           HD2      PRO  54  -2.653   9.464   3.914
  374    H    ASP  55           H        ASP  55  -4.596  12.268   1.736
  375    HA   ASP  55           HA       ASP  55  -7.144  11.688   0.712
  376    HB2  ASP  55           HB3      ASP  55  -5.844  14.371   1.253
  377    HB3  ASP  55           HB2      ASP  55  -7.560  14.170   0.900
  378    H    ASN  56           H        ASN  56  -4.424  13.319  -0.859
  379    HA   ASN  56           HA       ASN  56  -5.767  14.337  -3.131
  380    HB2  ASN  56           HB3      ASN  56  -2.974  13.173  -2.913
  381    HB3  ASN  56           HB2      ASN  56  -3.562  14.120  -4.281
  382   HD21  ASN  56          HD22      ASN  56  -1.364  15.040  -2.696
  383   HD22  ASN  56          HD21      ASN  56  -1.856  16.425  -1.848
  384    H    VAL  57           H        VAL  57  -4.644  11.065  -2.415
  385    HA   VAL  57           HA       VAL  57  -6.125  10.130  -4.829
  386    HB   VAL  57           HB       VAL  57  -3.655  10.056  -5.205
  387   HG11  VAL  57          HG11      VAL  57  -3.276   7.772  -3.393
  388   HG12  VAL  57          HG12      VAL  57  -3.561   9.297  -2.554
  389   HG13  VAL  57          HG13      VAL  57  -2.224   9.156  -3.695
  390   HG21  VAL  57          HG21      VAL  57  -4.989   8.449  -6.402
  391   HG22  VAL  57          HG22      VAL  57  -5.158   7.434  -4.970
  392   HG23  VAL  57          HG23      VAL  57  -3.593   7.580  -5.767
  393    HA   PRO  58           HA       PRO  58  -7.485   7.704  -1.171
  394    HB2  PRO  58           HB2      PRO  58 -10.018   8.644  -0.997
  395    HB3  PRO  58           HB3      PRO  58  -8.636   9.523  -0.317
  396    HG2  PRO  58           HG3      PRO  58 -10.274  10.153  -2.658
  397    HG3  PRO  58           HG2      PRO  58  -9.220  11.204  -1.700
  398    HD2  PRO  58           HD3      PRO  58  -8.638   9.898  -4.231
  399    HD3  PRO  58           HD2      PRO  58  -7.638  11.059  -3.334
  400    H    ILE  59           H        ILE  59  -7.381   5.836  -2.678
  401    HA   ILE  59           HA       ILE  59  -8.328   4.197  -4.103
  402    HB   ILE  59           HB       ILE  59 -10.775   4.915  -2.453
  403   HG12  ILE  59          HG13      ILE  59  -8.694   2.824  -1.786
  404   HG13  ILE  59          HG12      ILE  59  -8.569   4.478  -1.185
  405   HG21  ILE  59          HG21      ILE  59  -9.933   2.543  -4.101
  406   HG22  ILE  59          HG22      ILE  59 -11.490   3.369  -4.067
  407   HG23  ILE  59          HG23      ILE  59 -11.017   2.322  -2.730
  408   HD11  ILE  59          HD11      ILE  59 -10.724   4.302  -0.087
  409   HD12  ILE  59          HD12      ILE  59  -9.728   2.934   0.411
  410   HD13  ILE  59          HD13      ILE  59 -10.996   2.709  -0.794
  411    H    ARG  60           H        ARG  60  -8.176   6.408  -5.595
  412    HA   ARG  60           HA       ARG  60 -10.592   7.628  -6.458
  413    HB2  ARG  60           HB3      ARG  60  -9.057   7.587  -8.743
  414    HB3  ARG  60           HB2      ARG  60  -8.931   8.797  -7.468
  415    HG2  ARG  60           HG3      ARG  60  -7.125   7.631  -6.413
  416    HG3  ARG  60           HG2      ARG  60  -7.374   6.203  -7.421
  417    HD2  ARG  60           HD3      ARG  60  -5.500   7.371  -8.355
  418    HD3  ARG  60           HD2      ARG  60  -6.864   7.677  -9.429
  419    HE   ARG  60           HE       ARG  60  -6.928   9.796  -7.637
  420   HH11  ARG  60          HH22      ARG  60  -4.619   8.348  -9.746
  421   HH12  ARG  60          HH21      ARG  60  -3.773   9.827 -10.053
  422   HH21  ARG  60          HH11      ARG  60  -5.836  11.738  -8.024
  423   HH22  ARG  60          HH12      ARG  60  -4.461  11.746  -9.079
  424    H    ILE  61           H        ILE  61  -8.974   4.676  -7.598
  425    HA   ILE  61           HA       ILE  61 -10.738   4.186  -9.779
  426    HB   ILE  61           HB       ILE  61  -9.840   1.974  -9.850
  427   HG12  ILE  61          HG13      ILE  61 -10.263   1.302  -7.518
  428   HG13  ILE  61          HG12      ILE  61  -8.588   0.987  -7.950
  429   HG21  ILE  61          HG21      ILE  61  -7.695   3.709  -8.604
  430   HG22  ILE  61          HG22      ILE  61  -8.255   3.877 -10.268
  431   HG23  ILE  61          HG23      ILE  61  -7.465   2.388  -9.750
  432   HD11  ILE  61          HD11      ILE  61  -9.668   3.244  -6.254
  433   HD12  ILE  61          HD12      ILE  61  -8.037   3.268  -6.926
  434   HD13  ILE  61          HD13      ILE  61  -8.507   1.999  -5.799
  435    HA   PRO  62           HA       PRO  62 -14.641   3.053  -8.032
  436    HB2  PRO  62           HB2      PRO  62 -14.411   0.468  -9.498
  437    HB3  PRO  62           HB3      PRO  62 -15.721   1.662  -9.515
  438    HG2  PRO  62           HG3      PRO  62 -13.937   1.382 -11.525
  439    HG3  PRO  62           HG2      PRO  62 -14.743   2.907 -11.135
  440    HD2  PRO  62           HD3      PRO  62 -11.919   2.160 -10.767
  441    HD3  PRO  62           HD2      PRO  62 -12.673   3.770 -10.779
  442    H    GLY  63           H        GLY  63 -11.929   0.849  -7.859
  443    HA2  GLY  63           HA3      GLY  63 -11.669   0.171  -5.342
  444    HA3  GLY  63           HA2      GLY  63 -13.217  -0.625  -5.623
  445    H    LYS  64           H        LYS  64 -11.539  -0.724  -8.484
  446    HA   LYS  64           HA       LYS  64 -10.794  -3.543  -8.004
  447    HB2  LYS  64           HB3      LYS  64 -10.842  -1.928 -10.571
  448    HB3  LYS  64           HB2      LYS  64 -10.552  -3.664 -10.454
  449    HG2  LYS  64           HG3      LYS  64 -12.810  -3.856  -9.311
  450    HG3  LYS  64           HG2      LYS  64 -13.092  -2.173  -9.758
  451    HD2  LYS  64           HD3      LYS  64 -12.477  -4.433 -11.687
  452    HD3  LYS  64           HD2      LYS  64 -14.059  -3.689 -11.443
  453    HE2  LYS  64           HE3      LYS  64 -12.859  -1.457 -12.002
  454    HE3  LYS  64           HE2      LYS  64 -11.583  -2.480 -12.664
  455    HZ1  LYS  64           HZ1      LYS  64 -14.081  -1.808 -13.798
  456    HZ2  LYS  64           HZ2      LYS  64 -13.986  -3.490 -13.603
  457    HZ3  LYS  64           HZ3      LYS  64 -12.791  -2.671 -14.491
  458    H    CYS  65           H        CYS  65  -8.670  -4.301  -8.298
  459    HA   CYS  65           HA       CYS  65  -6.536  -2.587  -7.557
  460    HB2  CYS  65           HB3      CYS  65  -6.667  -5.167  -7.531
  461    HB3  CYS  65           HB2      CYS  65  -6.161  -5.074  -9.219
  462    H    HIS  66           H        HIS  66  -7.461  -3.817 -10.775
  463    HA   HIS  66           HA       HIS  66  -6.666  -3.179 -12.904
  464    HB2  HIS  66           HB3      HIS  66  -8.316  -1.388 -12.202
  465    HB3  HIS  66           HB2      HIS  66  -6.933  -0.416 -11.693
  466    HD1  HIS  66           HD1      HIS  66  -7.634  -2.505 -14.816
  467    HD2  HIS  66           HD2      HIS  66  -6.333   1.315 -13.757
  468    HE1  HIS  66           HE1      HIS  66  -7.134  -1.289 -16.985
  469    HE2  HIS  66           HE2      HIS  66  -6.340   1.036 -16.351
</PRE>