*HEADER    TRANSCRIPTION                           08-MAY-02   1LPV              
*TITLE     DROSOPHILA MELANOGASTER DOUBLESEX (DSX), NMR, 18 STRUCTURES           
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DOUBLESEX PROTEIN;                                         
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THE SEQUENCE NATURALLY OCCURS IN DROSOPHILA           
*SOURCE   4 MELANOGASTER (FRUIT FLY).                                            
*KEYWDS    TRANSCRIPTION, DROSOPHILA MELANOGASTER, DNA BINDING, GENE             
*KEYWDS   2 REGULATION, NMR                                                      
*EXPDTA    NMR, 18 STRUCTURES                                                    
*AUTHOR    L.ZHU, J.WILKEN, N.PHILLIPS, U.NARENDRA, G.CHAN, S.STRATTON,          
*AUTHOR   2 S.KENT, M.A.WEISS                                                    
*REVDAT   1   02-OCT-02 1LPV    0                                                

! XPLOR3.1 distance restraints file

!dihedral angles

assign (resid 26  and name C)
       (resid 27  and name N)  
       (resid 27  and name CA)   
       (resid 27  and name C)  1  -60.0 40.0 2
assign (resid 28  and name C)
       (resid 29  and name N)  
       (resid 29  and name CA)   
       (resid 29  and name C)  1  -60.0 40.0 2
assign (resid 36  and name C)  
       (resid 37  and name N)  
       (resid 37  and name CA)  
       (resid 37  and name C)  1  -60.0 40.0 2
assign (resid 38  and name C)  
       (resid 39  and name N)  
       (resid 39  and name CA)  
       (resid 39  and name C)  1  -60.0 40.0 2
assign (resid 39  and name C)
       (resid 40  and name N)  
       (resid 40  and name CA)  
       (resid 40  and name C)  1  -60.0 40.0 2
assign (resid 40  and name C) 
       (resid 41  and name N)  
       (resid 41  and name CA)  
       (resid 41  and name C)  1  -60.0 40.0 2
assign (resid 41  and name C) 
       (resid 42  and name N)  
       (resid 42  and name CA)  
       (resid 42  and name C)  1  -60.0 40.0 2
assign (resid 42  and name C)  
       (resid 43  and name N)  
       (resid 43  and name CA) 
       (resid 43  and name C)  1  -60.0 40.0 2
assign (resid 43  and name C)  
       (resid 44  and name N)  
       (resid 44  and name CA) 
       (resid 44  and name C)  1  -60.0 40.0 2
assign (resid 44  and name C)  
       (resid 45  and name N)  
       (resid 45  and name CA) 
       (resid 45  and name C)  1  -60.0 40.0 2
assign (resid 46  and name C)  
       (resid 47  and name N)  
       (resid 47  and name CA) 
       (resid 47  and name C)  1  -60.0 40.0 2
assign (resid 9 and name N )
       (resid 9 and name CA )
       (resid 9 and name CB )
       (resid 9 and name CG ) 1.0 60.0 40.0 2
assign (resid 10 and name N ) 
       (resid 10 and name CA ) 
       (resid 10 and name CB )
       (resid 10 and name SG ) 1.0 180.0 60.0 2
assign (resid 11 and name C)
       (resid 12 and name N)
       (resid 12 and name CA)
       (resid 12 and name C)  1  -60.0 40.0 2
assign (resid 12  and name C)
       (resid 13  and name N)
       (resid 13  and name CA)
       (resid 13  and name C)  1  -60.0 40.0 2
assign (resid 13  and name C)
       (resid 14  and name N)
       (resid 14  and name CA)
       (resid 14  and name C)  1  -60.0 40.0 2
assign (resid 14  and name C)
       (resid 15  and name N)
       (resid 15  and name CA)
       (resid 15  and name C)  1  -60.0 40.0 2
assign (resid 15  and name C)
       (resid 16  and name N)
       (resid 16  and name CA)
       (resid 16  and name C)  1  -60.0 40.0 2
assign (resid 12 and name N )
       (resid 12 and name CA )
       (resid 12 and name CB )
       (resid 12 and name CG ) 1.0 180.0 60.0 2
assign (resid 13 and name N )   
       (resid 13 and name CA )   
       (resid 13 and name CB )
       (resid 13 and name SG ) 1.0 60.0 40.0 2
assign (resid 15 and name N )
       (resid 15 and name CA )
       (resid 15 and name CB )
       (resid 15 and name CG ) 1.0 -60.0 40.0 2
assign (resid 16 and name N )   
       (resid 16 and name CA )   
       (resid 16 and name CB )
       (resid 16 and name CG ) 1.0 -60.0 40.0 2
assign (resid 18 and name N )
       (resid 18 and name CA )
       (resid 18 and name CB )
       (resid 18 and name CG ) 1.0 180.0 40.0 2
assign (resid 25 and name N )   
       (resid 25 and name CA )   
       (resid 25 and name CB )
       (resid 25 and name CG ) 1.0 180.0 40.0 2
assign (resid 28 and name N )   
       (resid 28 and name CA )   
       (resid 28 and name CB )
       (resid 28 and name CG ) 1.0 -60.0 40.0 2
assign (resid 29 and name N )   
       (resid 29 and name CA )   
       (resid 29 and name CB )
       (resid 29 and name SG ) 1.0 180.0 40.0 2
assign (resid 31 and name N )   
       (resid 31 and name CA )   
       (resid 31 and name CB )
       (resid 31 and name CG ) 1.0 -60.0 40.0 2
assign (resid 33 and name N )   
       (resid 33 and name CA )   
       (resid 33 and name CB )
       (resid 33 and name CG ) 1.0 -60.0 40.0 2
assign (resid 34 and name N )   
       (resid 34 and name CA )   
       (resid 34 and name CB )
       (resid 34 and name SG ) 1.0 180.0 40.0 2
assign (resid 36 and name N )   
       (resid 36 and name CA )   
       (resid 36 and name CB )
       (resid 36 and name SG ) 1.0 60.0 40.0 2
assign (resid 39 and name N )   
       (resid 39 and name CA )   
       (resid 39 and name CB )
       (resid 39 and name SG ) 1.0 -60.0 40.0 2
assign ( resid 2 and name C ) 
       ( resid 3 and name N ) 
       ( resid 3 and name CA )
       ( resid 3 and name C ) 1.0 -120 40.0 2
assign ( resid 4 and name C ) 
       ( resid 5 and name N ) 
       ( resid 5 and name CA )
       ( resid 5 and name C ) 1.0 -120 40.0 2
assign ( resid 5 and name C )
       ( resid 6 and name N )
       ( resid 6 and name CA )
       ( resid 6 and name C ) 1.0 -120 40.0 2
assign ( resid 47 and name C ) 
       ( resid 48 and name N ) 
       ( resid 48 and name CA )
       ( resid 48 and name C ) 1.0 -120 40.0 2
assign ( resid 48 and name C ) 
       ( resid 49 and name N ) 
       ( resid 49 and name CA )
       ( resid 49 and name C ) 1.0 -120 40.0 2
assign ( resid 49 and name C ) 
       ( resid 50 and name N ) 
       ( resid 50 and name CA )
       ( resid 50 and name C ) 1.0 -120 40.0 2
assign ( resid 50 and name C ) 
       ( resid 51 and name N ) 
       ( resid 51 and name CA )
       ( resid 51 and name C ) 1.0 -120 40.0 2
assign ( resid 51 and name C )  
       ( resid 52 and name N )  
       ( resid 52 and name CA )
       ( resid 52 and name C ) 1.0 -120 40.0 2


! Bonds from Zn binding sites
assign ( resid 10 and name SG ) ( resid 13 and name SG ) 3.900 0.300 0
assign ( resid 10 and name SG ) ( resid 29 and name SG ) 3.900 0.300 0
assign ( resid 10 and name SG ) ( resid 25 and name NE2 ) 3.800 0.400 0
assign ( resid 13 and name SG ) ( resid 29 and name SG ) 3.900 0.300 0
assign ( resid 13 and name SG ) ( resid 25 and name NE2 ) 3.800 0.400 0
assign ( resid 29 and name SG ) ( resid 25 and name NE2 ) 3.800 0.400 0
assign ( resid 54 and name ZN2 ) ( resid 10 and name SG ) 2.400 0.200 0
assign ( resid 54 and name ZN2 ) ( resid 13 and name SG ) 2.400 0.200 0
assign ( resid 54 and name ZN2 ) ( resid 29 and name SG ) 2.400 0.200 0
assign ( resid 54 and name ZN2 ) ( resid 25 and name NE2 ) 2.100 0.200 0
!
assign ( resid 34 and name SG ) ( resid 36 and name SG ) 3.900 0.300 0
assign ( resid 34 and name SG ) ( resid 39 and name SG ) 3.900 0.300 0
assign ( resid 34 and name SG ) ( resid 16 and name NE2 ) 3.800 0.400 0
assign ( resid 36 and name SG ) ( resid 39 and name SG ) 3.900 0.300 0
assign ( resid 36 and name SG ) ( resid 16 and name NE2 ) 3.800 0.400 0
assign ( resid 39 and name SG ) ( resid 16 and name NE2 ) 3.800 0.400 0
assign ( resid 53 and name ZN1 ) ( resid 34 and name SG ) 2.400 0.200 0
assign ( resid 53 and name ZN1 ) ( resid 36 and name SG ) 2.400 0.200 0
assign ( resid 53 and name ZN1 ) ( resid 39 and name SG ) 2.400 0.200 0
assign ( resid 53 and name ZN1 ) ( resid 16 and name NE2 ) 2.100 0.200 0
!
!  Hbonds
! see the slow exchange from 1D deturated spectrum
!
assign ( resid 10 and name SG ) ( resid 13 and name HN ) 2.800 0.600 0
assign ( resid 10 and name SG ) ( resid 13 and name N ) 3.700 0.600 0
assign ( resid 10 and name SG ) ( resid 12 and name HN ) 2.800 0.600 0
assign ( resid 10 and name SG ) ( resid 12 and name N ) 3.700 0.600 0
assign ( resid 34 and name SG ) ( resid 36 and name HN ) 2.800 0.600 0
assign ( resid 34 and name SG ) ( resid 36 and name N ) 3.700 0.600 0
assign ( resid 36 and name SG ) ( resid 38 and name HN ) 2.800 0.600 0
assign ( resid 36 and name SG ) ( resid 38 and name N ) 3.700 0.600 0
assign ( resid 36 and name SG ) ( resid 39 and name HN ) 2.800 0.600 0
assign ( resid 36 and name SG ) ( resid 39 and name N ) 3.700 0.600 0
assign ( resid 40 and name HN ) ( resid 36 and name O ) 2.600 1.900 0
assign ( resid 40 and name N ) ( resid 36 and name O ) 3.300 2.700 0
assign ( resid 29 and name SG ) ( resid 31 and name HN ) 2.800 0.600 0
assign ( resid 29 and name SG ) ( resid 31 and name N ) 3.700 0.600 0
!
! Hbonds
!
assign ( resid 10 and name O ) ( resid 14 and name HN ) 2.600 2.300 0
assign ( resid 10 and name O ) ( resid 14 and name N ) 3.300 2.700 0
assign ( resid 13 and name O ) ( resid 17 and name HN ) 2.600 2.300 0
assign ( resid 13 and name O ) ( resid 17 and name N ) 3.300 2.700 0
!
assign ( resid 39 and name O ) ( resid 43 and name HN ) 2.600 1.900 0
assign ( resid 39 and name O ) ( resid 43 and name N ) 3.300 2.700 0
assign ( resid 11 and name O ) ( resid 14 and name HN ) 2.600 1.900 0
assign ( resid 11 and name O ) ( resid 14 and name N ) 3.300 2.700 0
assign ( resid 37 and name O ) ( resid 41 and name HN ) 2.600 1.900 0
assign ( resid 37 and name O ) ( resid 41 and name N ) 3.300 2.700 0
assign ( resid 38 and name O ) ( resid 42 and name HN ) 2.600 1.900 0
assign ( resid 38 and name O ) ( resid 42 and name N ) 3.300 2.700 0
assign ( resid 40 and name O ) ( resid 44 and name HN ) 2.600 1.900 0
assign ( resid 40 and name O ) ( resid 44 and name N ) 3.300 2.700 0
assign ( resid 41 and name O ) ( resid 45 and name HN ) 2.600 1.900 0
assign ( resid 41 and name O ) ( resid 45 and name N ) 3.300 2.700 0
assign ( resid 42 and name O ) ( resid 46 and name HN ) 2.600 2.300 0
assign ( resid 42 and name O ) ( resid 46 and name N ) 3.300 2.700 0
!
!! below are the allowing hydrogen bonds, but do not constrain.
assign ( resid 10 and name HN ) ( resid 9 and name O ) 15.00 13.10 0
assign ( resid 10 and name N ) ( resid 9 and name O ) 15.00 12.80 0

! NOEs

assign ( resid 2 and name HA ) ( resid 3 and name HN ) 5.000 5.000 0
assign ( resid 5 and name HA ) ( resid 6 and name HN ) 3.400 3.400 0
assign ( resid 5 and name HN ) ( resid 6 and name HN ) 5.500 5.500 0
assign ( resid 6 and name HA ) ( resid 7 and name HD* ) 2.700 2.700 1
assign ( resid 6 and name HA ) ( resid 7 and name HG* ) 5.000 5.000 1
assign ( resid 6 and name HG* ) ( resid 7 and name HD* ) 3.400 3.400 1
assign ( resid 6 and name HB ) ( resid 7 and name HD* ) 5.000 5.000 1
assign ( resid 7 and name HB* ) ( resid 8 and name HD* ) 5.000 5.000 2
assign ( resid 7 and name HG* ) ( resid 8 and name HD* ) 5.000 5.000 2
assign ( resid 8 and name HA ) ( resid 9 and name HN ) 2.700 2.700 0
assign ( resid 8 and name HB* ) ( resid 9 and name HN ) 3.400 3.400 1
assign ( resid 9 and name HD22 ) ( resid 9 and name HB1 ) 5.000 5.000 0
assign ( resid 9 and name HD22 ) ( resid 9 and name HB2 ) 5.000 5.000 0
assign ( resid 9 and name HA ) ( resid 10 and name HN ) 2.700 2.700 0
assign ( resid 9 and name HA ) ( resid 20 and name HG2* ) 5.000 5.000 1
assign ( resid 9 and name HA ) ( resid 21 and name HA ) 2.700 2.700 0
assign ( resid 9 and name HA ) ( resid 21 and name HB ) 5.000 5.000 0
assign ( resid 9 and name HA ) ( resid 21 and name HG* ) 5.000 5.000 1
assign ( resid 9 and name HA ) ( resid 22 and name HN ) 2.700 2.700 0
assign ( resid 9 and name HB2 ) ( resid 10 and name HN ) 2.700 2.700 0
assign ( resid 9 and name HB1 ) ( resid 20 and name HN ) 5.000 5.000 0
assign ( resid 9 and name HB2 ) ( resid 20 and name HN ) 3.400 3.400 0
assign ( resid 9 and name HB1 ) ( resid 21 and name HA ) 5.000 5.000 0
assign ( resid 9 and name HB2 ) ( resid 21 and name HA ) 3.400 3.400 0
assign ( resid 10 and name HA ) ( resid 11 and name HN ) 3.400 3.400 0
assign ( resid 10 and name HA ) ( resid 25 and name HD2 ) 5.000 5.000 0
assign ( resid 10 and name HB1 ) ( resid 13 and name HB2 ) 5.500 5.500 0
assign ( resid 10 and name HB1 ) ( resid 13 and name HB1 ) 5.000 5.000 0
assign ( resid 10 and name HB2 ) ( resid 13 and name HB1 ) 5.000 5.000 0
assign ( resid 10 and name HB2 ) ( resid 13 and name HN ) 5.000 5.000 0
assign ( resid 10 and name HB1 ) ( resid 13 and name HN ) 3.400 3.400 0
assign ( resid 10 and name HB1 ) ( resid 20 and name HB ) 5.000 5.000 0
assign ( resid 10 and name HB2 ) ( resid 20 and name HB ) 5.000 5.000 0
assign ( resid 10 and name HB1 ) ( resid 20 and name HD1* ) 3.400 3.400 1
assign ( resid 10 and name HB2 ) ( resid 20 and name HD1* ) 3.400 3.400 1
assign ( resid 10 and name HB2 ) ( resid 22 and name HA ) 5.000 5.000 0
assign ( resid 10 and name HB1 ) ( resid 22 and name HD* ) 3.400 3.400 2.4
assign ( resid 10 and name HB2 ) ( resid 22 and name HD* ) 2.700 2.700 2.4
assign ( resid 10 and name HB1 ) ( resid 25 and name HE1 ) 5.000 5.000 0
assign ( resid 10 and name HB2 ) ( resid 25 and name HE1 ) 5.000 5.000 0
assign ( resid 10 and name HN ) ( resid 20 and name HD1* ) 5.000 5.000 1
assign ( resid 10 and name HN ) ( resid 20 and name HG2* ) 5.000 5.000 1
assign ( resid 10 and name HB2 ) ( resid 12 and name HB1 ) 5.000 5.000 0
assign ( resid 11 and name HA ) ( resid 12 and name HN ) 5.000 5.000 0
assign ( resid 11 and name HA ) ( resid 14 and name HB* ) 2.700 2.700 1
assign ( resid 11 and name HA ) ( resid 14 and name HN ) 2.700 2.700 0
assign ( resid 11 and name HA ) ( resid 15 and name HN ) 5.500 5.500 0
assign ( resid 11 and name HA ) ( resid 19 and name HD* ) 5.000 5.000 1
assign ( resid 11 and name HB* ) ( resid 15 and name HA ) 5.000 5.000 2
assign ( resid 11 and name HN ) ( resid 12 and name HN ) 5.000 5.000 0
assign ( resid 12 and name HA ) ( resid 13 and name HN ) 5.000 5.000 0
assign ( resid 12 and name HA ) ( resid 13 and name HN ) 5.000 5.000 0
assign ( resid 12 and name HA ) ( resid 15 and name HN ) 5.000 5.000 0
assign ( resid 12 and name HA ) ( resid 15 and name HD22 ) 2.700 2.700 0
assign ( resid 12 and name HA ) ( resid 16 and name HD2 ) 5.000 5.000 0
assign ( resid 12 and name HB1 ) ( resid 13 and name HN ) 3.400 3.400 0
assign ( resid 12 and name HB2 ) ( resid 13 and name HN ) 3.400 3.400 0
assign ( resid 12 and name HB2 ) ( resid 31 and name HB2 ) 5.000 5.000 0
assign ( resid 12 and name HG* ) ( resid 31 and name HB2 ) 5.000 5.000 0
assign ( resid 12 and name HB2 ) ( resid 31 and name HD* ) 5.000 5.000 2
assign ( resid 12 and name HD* ) ( resid 32 and name HA ) 2.700 2.700 1
assign ( resid 12 and name HG* ) ( resid 13 and name HN ) 2.700 2.700 1
assign ( resid 12 and name HG* ) ( resid 16 and name HD2 ) 5.000 5.000 1
assign ( resid 12 and name HG* ) ( resid 31 and name HB1 ) 5.000 5.000 1
assign ( resid 12 and name HG* ) ( resid 31 and name HB2 ) 5.000 5.000 1
assign ( resid 12 and name HN ) ( resid 13 and name HN ) 2.700 2.700 0
assign ( resid 12 and name HN ) ( resid 15 and name HD22 ) 5.500 5.500 0
assign ( resid 13 and name HA ) ( resid 14 and name HN ) 5.500 5.500 0
assign ( resid 13 and name HA ) ( resid 16 and name HD2 ) 3.400 3.400 0
assign ( resid 13 and name HA ) ( resid 16 and name HN ) 5.000 5.000 0
assign ( resid 13 and name HA ) ( resid 18 and name HD2* ) 5.000 5.000 1.0
assign ( resid 13 and name HA ) ( resid 31 and name HD* ) 2.700 2.700 2
assign ( resid 13 and name HA ) ( resid 31 and name HE* ) 3.400 3.400 2
assign ( resid 13 and name HA ) ( resid 31 and name HZ ) 5.000 5.000 0
assign ( resid 13 and name HB1 ) ( resid 14 and name HN ) 5.000 5.000 0
assign ( resid 13 and name HB1 ) ( resid 18 and name HB1 ) 3.400 3.400 0
assign ( resid 13 and name HB1 ) ( resid 18 and name HB2 ) 5.000 5.000 0
assign ( resid 13 and name HB2 ) ( resid 18 and name HB1 ) 2.700 2.700 0
assign ( resid 13 and name HB2 ) ( resid 18 and name HB2 ) 3.400 3.400 0
assign ( resid 13 and name HB1 ) ( resid 18 and name HD2* ) 5.500 5.500 1
assign ( resid 13 and name HB2 ) ( resid 18 and name HD2* ) 3.400 3.400 1
assign ( resid 13 and name HB1 ) ( resid 20 and name HD1* ) 5.000 5.000 1
assign ( resid 13 and name HB2 ) ( resid 20 and name HD1* ) 5.000 5.000 1
assign ( resid 13 and name HB1 ) ( resid 20 and name HG2* ) 5.000 5.000 1
assign ( resid 13 and name HB2 ) ( resid 20 and name HG2* ) 3.400 3.400 1
assign ( resid 13 and name HB2 ) ( resid 25 and name HD2 ) 6.000 6.000 0
assign ( resid 13 and name HB1 ) ( resid 25 and name HD2 ) 5.000 5.000 0
assign ( resid 13 and name HB2 ) ( resid 25 and name HE1 ) 5.000 5.000 0
assign ( resid 13 and name HB2 ) ( resid 31 and name HD* ) 3.400 3.400 2
assign ( resid 13 and name HB1 ) ( resid 31 and name HD* ) 5.500 5.500 2
assign ( resid 13 and name HB2 ) ( resid 31 and name HE* ) 3.400 3.400 2
assign ( resid 13 and name HN ) ( resid 14 and name HN ) 2.700 2.700 0
assign ( resid 14 and name HA ) ( resid 15 and name HN ) 3.400 3.400 0
assign ( resid 14 and name HA ) ( resid 16 and name HN ) 5.000 5.000 0
assign ( resid 14 and name HA ) ( resid 17 and name HN ) 5.000 5.000 0
assign ( resid 14 and name HB* ) ( resid 15 and name HN ) 3.400 3.400 1
assign ( resid 14 and name HG* ) ( resid 15 and name HD22 ) 3.400 3.400 1
assign ( resid 14 and name HG* ) ( resid 15 and name HN ) 5.000 5.000 1
assign ( resid 14 and name HD* ) ( resid 31 and name HB1 ) 5.000 5.000 2
assign ( resid 34 and name HB1 ) ( resid 31 and name HB1 ) 5.000 5.000 0
assign ( resid 14 and name HG* ) ( resid 17 and name HN ) 5.000 5.000 1
assign ( resid 14 and name HN ) ( resid 15 and name HN ) 3.400 3.400 0
assign ( resid 15 and name HA ) ( resid 16 and name HN ) 5.000 5.000 0
assign ( resid 15 and name HB2 ) ( resid 15 and name HD21 ) 5.000 5.000 0
assign ( resid 15 and name HB1 ) ( resid 15 and name HD21 ) 3.400 3.400 0
assign ( resid 15 and name HB2 ) ( resid 15 and name HD22 ) 3.400 3.400 0
assign ( resid 15 and name HB1 ) ( resid 16 and name HD2 ) 2.700 2.700 0
assign ( resid 15 and name HB2 ) ( resid 16 and name HD2 ) 2.700 2.700 0
assign ( resid 15 and name HB2 ) ( resid 16 and name HN ) 5.000 5.000 0
assign ( resid 15 and name HB1 ) ( resid 16 and name HN ) 3.400 3.400 0
assign ( resid 15 and name HD21 ) ( resid 39 and name HA ) 2.700 2.700 0
assign ( resid 15 and name HD21 ) ( resid 16 and name HD2 ) 3.400 3.400 0
assign ( resid 15 and name HD22 ) ( resid 16 and name HD2 ) 5.000 5.000 0
assign ( resid 15 and name HD22 ) ( resid 38 and name HB* ) 5.000 5.000 1
assign ( resid 15 and name HN ) ( resid 15 and name HD21 ) 5.000 5.000 0
assign ( resid 15 and name HN ) ( resid 15 and name HD22 ) 3.400 3.400 0
assign ( resid 16 and name HB1 ) ( resid 16 and name HD2 ) 3.400 3.400 0
assign ( resid 16 and name HB2 ) ( resid 16 and name HD2 ) 5.000 5.000 0
assign ( resid 16 and name HB1 ) ( resid 17 and name HN ) 5.500 5.500 0
assign ( resid 16 and name HB2 ) ( resid 17 and name HN ) 5.500 5.500 0
assign ( resid 16 and name HB1 ) ( resid 31 and name HD* ) 5.000 5.000 2
assign ( resid 16 and name HB2 ) ( resid 31 and name HD* ) 5.000 5.000 2
assign ( resid 16 and name HB1 ) ( resid 31 and name HE* ) 2.700 2.700 2
assign ( resid 16 and name HB2 ) ( resid 31 and name HE* ) 2.700 2.700 2
assign ( resid 16 and name HB1 ) ( resid 31 and name HZ ) 3.400 3.400 0
assign ( resid 16 and name HB2 ) ( resid 31 and name HZ ) 5.000 5.000 0
assign ( resid 16 and name HD2 ) ( resid 31 and name HB1 ) 5.000 5.000 0
assign ( resid 16 and name HD2 ) ( resid 31 and name HB2 ) 5.000 5.000 0
assign ( resid 16 and name HD2 ) ( resid 31 and name HD* ) 5.500 5.500 2
assign ( resid 16 and name HD2 ) ( resid 31 and name HE* ) 5.500 5.500 2
assign ( resid 16 and name HD2 ) ( resid 31 and name HZ ) 5.500 5.500 0
assign ( resid 16 and name HD2 ) ( resid 39 and name HA ) 5.500 5.500 0
assign ( resid 16 and name HE1 ) ( resid 31 and name HD* ) 5.000 5.000 2
assign ( resid 16 and name HE1 ) ( resid 31 and name HE* ) 5.000 5.000 2
assign ( resid 16 and name HE1 ) ( resid 36 and name HB1 ) 3.400 3.400 0
assign ( resid 16 and name HE1 ) ( resid 36 and name HB2 ) 5.000 5.000 0
assign ( resid 16 and name HE1 ) ( resid 36 and name HA ) 5.000 5.000 0
assign ( resid 16 and name HN ) ( resid 15 and name HN ) 2.700 2.700 0
assign ( resid 16 and name HN ) ( resid 17 and name HN ) 2.700 2.700 0
assign ( resid 16 and name HN ) ( resid 18 and name HN ) 3.400 3.400 0
assign ( resid 17 and name HA* ) ( resid 18 and name HN ) 3.400 3.400 1
assign ( resid 17 and name HN ) ( resid 18 and name HN ) 2.700 2.700 0
assign ( resid 18 and name HA ) ( resid 19 and name HN ) 2.700 2.700 0
assign ( resid 18 and name HB2 ) ( resid 19 and name HN ) 5.000 5.000 0
assign ( resid 18 and name HB1 ) ( resid 19 and name HN ) 3.400 3.400 0
assign ( resid 18 and name HD1* ) ( resid 19 and name HA ) 3.400 3.400 1.0
assign ( resid 18 and name HD1* ) ( resid 19 and name HN ) 3.400 3.400 1.0
assign ( resid 18 and name HD2* ) ( resid 19 and name HN ) 5.000 5.000 1.0
assign ( resid 18 and name HD1* ) ( resid 21 and name HN ) 5.000 5.000 1.0
assign ( resid 18 and name HD2* ) ( resid 31 and name HD* ) 3.400 3.400 3.0
assign ( resid 18 and name HD2* ) ( resid 31 and name HE* ) 2.700 2.700 3.0
assign ( resid 18 and name HD1* ) ( resid 31 and name HE* ) 3.400 3.400 3.0
assign ( resid 18 and name HD2* ) ( resid 31 and name HZ ) 3.400 3.400 1
assign ( resid 18 and name HG ) ( resid 31 and name HE* ) 3.400 3.400 2
assign ( resid 18 and name HG ) ( resid 31 and name HD* ) 3.400 3.400 2
assign ( resid 18 and name HN ) ( resid 19 and name HN ) 5.500 5.500 0
assign ( resid 19 and name HA ) ( resid 20 and name HN ) 2.700 2.700 0
assign ( resid 19 and name HD* ) ( resid 20 and name HN ) 3.400 3.400 1
assign ( resid 19 and name HN ) ( resid 20 and name HN ) 3.400 3.400 0
assign ( resid 20 and name HA ) ( resid 21 and name HN ) 3.400 3.400 0
assign ( resid 20 and name HA ) ( resid 25 and name HE1 ) 5.500 5.500 0
assign ( resid 20 and name HB ) ( resid 25 and name HE1 ) 3.400 3.400 0
assign ( resid 20 and name HD1* ) ( resid 21 and name HA ) 6.000 6.000 1
assign ( resid 20 and name HD1* ) ( resid 21 and name HN ) 2.700 2.700 1
assign ( resid 20 and name HD1* ) ( resid 23 and name HA ) 6.000 6.000 1
assign ( resid 20 and name HD1* ) ( resid 25 and name HD2 ) 3.400 3.400 1
assign ( resid 20 and name HD1* ) ( resid 25 and name HE1 ) 2.700 2.700 1
assign ( resid 20 and name HG1* ) ( resid 21 and name HA ) 5.500 5.500 1
assign ( resid 20 and name HG1* ) ( resid 25 and name HE1 ) 3.400 3.400 1
assign ( resid 20 and name HG2* ) ( resid 21 and name HN ) 3.400 3.400 1
assign ( resid 20 and name HG2* ) ( resid 25 and name HE1 ) 2.700 2.700 1
assign ( resid 20 and name HD1* ) ( resid 29 and name HA ) 5.000 5.000 1
assign ( resid 20 and name HG2* ) ( resid 29 and name HA ) 5.000 5.000 1
assign ( resid 21 and name HA ) ( resid 22 and name HN ) 3.400 3.400 0
assign ( resid 21 and name HB ) ( resid 22 and name HN ) 3.400 3.400 0
assign ( resid 21 and name HG* ) ( resid 23 and name HN ) 3.400 3.400 1
assign ( resid 22 and name HA ) ( resid 23 and name HN ) 5.000 5.000 0
assign ( resid 22 and name HA ) ( resid 25 and name HA ) 5.500 5.500 0
assign ( resid 22 and name HA ) ( resid 25 and name HB1 ) 2.700 2.700 0
assign ( resid 22 and name HA ) ( resid 25 and name HB2 ) 2.700 2.700 0
assign ( resid 22 and name HA ) ( resid 25 and name HD2 ) 2.700 2.700 0
assign ( resid 22 and name HB* ) ( resid 25 and name HD2 ) 3.400 3.400 1
assign ( resid 22 and name HD* ) ( resid 23 and name HA ) 3.400 3.400 2.4
assign ( resid 22 and name HD* ) ( resid 23 and name HN ) 5.000 5.000 2.4
assign ( resid 22 and name HD* ) ( resid 25 and name HB1 ) 3.400 3.400 2.4
assign ( resid 22 and name HD* ) ( resid 25 and name HB2 ) 5.000 5.000 2.4
assign ( resid 22 and name HD* ) ( resid 25 and name HD2 ) 2.700 2.700 2.4
assign ( resid 24 and name HA* ) ( resid 25 and name HN ) 5.000 5.000 1
assign ( resid 25 and name HA ) ( resid 28 and name HB1 ) 5.000 5.000 0
assign ( resid 25 and name HD2 ) ( resid 28 and name HB2 ) 5.000 5.000 0
assign ( resid 25 and name HE1 ) ( resid 28 and name HD* ) 5.000 5.000 1
assign ( resid 25 and name HD2 ) ( resid 29 and name HA ) 5.000 5.000 0
assign ( resid 25 and name HD2 ) ( resid 29 and name HB2 ) 5.000 5.000 0
assign ( resid 25 and name HD2 ) ( resid 26 and name HA ) 3.400 3.400 0
assign ( resid 25 and name HE1 ) ( resid 26 and name HA ) 6.000 6.000 0
assign ( resid 25 and name HE1 ) ( resid 28 and name HB1 ) 5.000 5.000 0
assign ( resid 25 and name HE1 ) ( resid 28 and name HB2 ) 5.000 5.000 0
assign ( resid 25 and name HE1 ) ( resid 29 and name HA ) 2.700 2.700 0
assign ( resid 25 and name HE1 ) ( resid 29 and name HB1 ) 5.000 5.000 0
assign ( resid 25 and name HE1 ) ( resid 29 and name HB2 ) 5.000 5.000 0
assign ( resid 25 and name HE1 ) ( resid 29 and name HN ) 5.000 5.000 0
assign ( resid 25 and name HE1 ) ( resid 30 and name HN ) 3.400 3.400 0
assign ( resid 26 and name HA ) ( resid 29 and name HN ) 5.000 5.000 0
assign ( resid 27 and name HA ) ( resid 28 and name HN ) 5.000 5.000 0
assign ( resid 27 and name HB* ) ( resid 28 and name HD* ) 5.000 5.000 3
assign ( resid 27 and name HB* ) ( resid 28 and name HE* ) 3.400 3.400 3
assign ( resid 27 and name HB* ) ( resid 28 and name HN ) 5.000 5.000 1
assign ( resid 27 and name HG* ) ( resid 28 and name HA ) 5.500 5.500 1
assign ( resid 27 and name HG* ) ( resid 28 and name HD* ) 5.000 5.000 3
assign ( resid 27 and name HG* ) ( resid 28 and name HE* ) 3.400 3.400 3
assign ( resid 27 and name HN ) ( resid 28 and name HN ) 5.000 5.000 0
assign ( resid 28 and name HA ) ( resid 28 and name HD*) 2.700 2.700 2
assign ( resid 28 and name HB1 ) ( resid 28 and name HD*) 2.700 2.700 2
assign ( resid 28 and name HB2 ) ( resid 28 and name HD*) 2.700 2.700 2
assign ( resid 28 and name HA ) ( resid 28 and name HE*) 5.000 5.000 2
assign ( resid 28 and name HB1 ) ( resid 28 and name HE*) 5.000 5.000 2
assign ( resid 28 and name HB2 ) ( resid 28 and name HDE) 5.000 5.000 2
assign ( resid 28 and name HA ) ( resid 29 and name HN ) 3.400 3.400 0
assign ( resid 29 and name HA ) ( resid 30 and name HN ) 2.700 2.700 0
assign ( resid 29 and name HB1 ) ( resid 30 and name HN ) 5.000 5.000 0
assign ( resid 29 and name HA ) ( resid 31 and name HN ) 5.000 5.000 0
assign ( resid 29 and name HB2 ) ( resid 32 and name HA ) 3.400 3.400 0
assign ( resid 29 and name HB1 ) ( resid 32 and name HB* ) 2.700 2.700 1
assign ( resid 29 and name HB2 ) ( resid 32 and name HB* ) 3.400 3.400 1
assign ( resid 29 and name HN ) ( resid 31 and name HN ) 5.500 5.500 0
assign ( resid 30 and name HA ) ( resid 31 and name HN ) 3.400 3.400 0
assign ( resid 30 and name HB* ) ( resid 31 and name HD* ) 3.400 3.400 3
assign ( resid 30 and name HB* ) ( resid 31 and name HN ) 5.000 5.000 1
assign ( resid 30 and name HD* ) ( resid 31 and name HZ ) 3.400 3.400 1
assign ( resid 30 and name HN ) ( resid 31 and name HN ) 2.700 2.700 0
assign ( resid 30 and name HE* ) ( resid 31 and name HE* ) 5.000 5.000 2
assign ( resid 30 and name HE* ) ( resid 31 and name HZ ) 5.000 5.000 1
assign ( resid 31 and name HA ) ( resid 32 and name HN ) 3.400 3.400 0
assign ( resid 31 and name HA ) ( resid 34 and name HB1 ) 3.400 3.400 0
assign ( resid 31 and name HA ) ( resid 34 and name HB2 ) 3.400 3.400 0
assign ( resid 31 and name HA ) ( resid 34 and name HN ) 5.000 5.000 0
assign ( resid 31 and name HD* ) ( resid 31 and name HN ) 2.700 2.700 2
assign ( resid 31 and name HD* ) ( resid 34 and name HB1 ) 2.700 2.700 2
assign ( resid 31 and name HD* ) ( resid 34 and name HB2 ) 2.700 2.700 2
assign ( resid 31 and name HE* ) ( resid 30 and name HB* ) 5.000 5.000 3
assign ( resid 31 and name HE* ) ( resid 32 and name HD* ) 5.000 5.000 3
assign ( resid 31 and name HE* ) ( resid 34 and name HB1 ) 5.000 5.000 2
assign ( resid 31 and name HE* ) ( resid 34 and name HB2 ) 3.400 3.400 2
assign ( resid 30 and name HN ) ( resid 32 and name HN ) 5.500 5.500 0
assign ( resid 32 and name HA ) ( resid 33 and name HN ) 3.400 3.400 0
assign ( resid 32 and name HA ) ( resid 33 and name HE* ) 5.000 5.000 1
assign ( resid 32 and name HA ) ( resid 33 and name HD* ) 5.000 5.000 1
assign ( resid 32 and name HB* ) ( resid 33 and name HD* ) 3.400 3.400 3
assign ( resid 32 and name HB* ) ( resid 33 and name HE* ) 5.000 5.000 3
assign ( resid 32 and name HB* ) ( resid 29 and name HA ) 5.000 5.000 1
assign ( resid 32 and name HB* ) ( resid 33 and name HN ) 5.000 5.000 1
assign ( resid 32 and name HD* ) ( resid 33 and name HE* ) 3.400 3.400 3
assign ( resid 32 and name HG* ) ( resid 33 and name HD* ) 3.400 3.400 3
assign ( resid 32 and name HG* ) ( resid 33 and name HE* ) 3.400 3.400 3
assign ( resid 32 and name HN ) ( resid 33 and name HN ) 2.700 2.700 0
assign ( resid 33 and name HD* ) ( resid 33 and name HB1 ) 2.700 2.700 2
assign ( resid 33 and name HD* ) ( resid 33 and name HB2 ) 2.700 2.700 2
assign ( resid 33 and name HE* ) ( resid 33 and name HB1 ) 5.000 5.000 2
assign ( resid 33 and name HE* ) ( resid 33 and name HB2 ) 5.000 5.000 2
assign ( resid 33 and name HA ) ( resid 34 and name HN ) 5.000 5.000 0
assign ( resid 33 and name HA ) ( resid 35 and name HG* ) 5.000 5.000 1
assign ( resid 33 and name HD* ) ( resid 32 and name HD* ) 5.000 5.000 3
assign ( resid 33 and name HN ) ( resid 34 and name HN ) 2.700 2.700 0
assign ( resid 34 and name HA ) ( resid 35 and name HN ) 2.700 2.700 0
assign ( resid 34 and name HA ) ( resid 36 and name HN ) 5.000 5.000 0
assign ( resid 34 and name HB2 ) ( resid 35 and name HN ) 5.000 5.000 0
assign ( resid 34 and name HB1 ) ( resid 35 and name HN ) 3.400 3.400 0
assign ( resid 34 and name HB2 ) ( resid 39 and name HB1 ) 5.000 5.000 0
assign ( resid 34 and name HB2 ) ( resid 39 and name HB2 ) 5.000 5.000 0
assign ( resid 34 and name HB1 ) ( resid 39 and name HB1 ) 5.500 5.500 0
assign ( resid 34 and name HB1 ) ( resid 39 and name HB2 ) 5.500 5.500 0
assign ( resid 34 and name HN ) ( resid 35 and name HN ) 5.500 5.500 0
assign ( resid 35 and name HA ) ( resid 36 and name HA ) 5.000 5.000 0
assign ( resid 35 and name HA ) ( resid 36 and name HN ) 3.400 3.400 0
assign ( resid 35 and name HA ) ( resid 39 and name HB1 ) 5.000 5.000 0
assign ( resid 35 and name HA ) ( resid 39 and name HB2 ) 5.000 5.000 0
assign ( resid 35 and name HA ) ( resid 40 and name HA ) 5.000 5.000 0
assign ( resid 35 and name HA ) ( resid 40 and name HB* ) 5.000 5.000 1
assign ( resid 35 and name HA ) ( resid 40 and name HD* ) 3.400 3.400 1
assign ( resid 35 and name HA ) ( resid 40 and name HG* ) 3.400 3.400 1
assign ( resid 35 and name HB ) ( resid 40 and name HD* ) 3.400 3.400 1
assign ( resid 35 and name HN ) ( resid 36 and name HN ) 3.400 3.400 0
assign ( resid 36 and name HB2 ) ( resid 36 and name HN ) 5.000 5.000 0
assign ( resid 36 and name HB1 ) ( resid 36 and name HN ) 3.400 3.400 0
assign ( resid 36 and name HB2 ) ( resid 37 and name HN ) 2.700 2.700 0
assign ( resid 36 and name HB1 ) ( resid 37 and name HN ) 5.000 5.000 0
assign ( resid 36 and name HB2 ) ( resid 38 and name HN ) 5.500 5.500 0
assign ( resid 36 and name HN ) ( resid 37 and name HN ) 5.000 5.000 0
assign ( resid 36 and name HN ) ( resid 39 and name HB1 ) 5.000 5.000 0
assign ( resid 36 and name HN ) ( resid 39 and name HB2 ) 5.500 5.500 0
assign ( resid 37 and name HA ) ( resid 38 and name HN ) 3.400 3.400 0
assign ( resid 37 and name HA ) ( resid 40 and name HB* ) 3.400 3.400 1
assign ( resid 37 and name HA ) ( resid 40 and name HD* ) 3.400 3.400 1
assign ( resid 37 and name HA ) ( resid 40 and name HG* ) 5.000 5.000 1
assign ( resid 37 and name HA ) ( resid 40 and name HN ) 3.400 3.400 0
assign ( resid 37 and name HB* ) ( resid 40 and name HD* ) 5.000 5.000 2
assign ( resid 37 and name HG* ) ( resid 38 and name HA ) 5.000 5.000 1
assign ( resid 37 and name HG* ) ( resid 38 and name HN ) 5.500 5.500 1
assign ( resid 37 and name HN ) ( resid 38 and name HN ) 2.700 2.700 0
assign ( resid 38 and name HA ) ( resid 39 and name HN ) 5.000 5.000 0
assign ( resid 38 and name HA ) ( resid 41 and name HB* ) 5.000 5.000 1
assign ( resid 38 and name HA ) ( resid 41 and name HG ) 3.400 3.400 0
assign ( resid 38 and name HB* ) ( resid 39 and name HN ) 2.700 2.700 1
assign ( resid 38 and name HN ) ( resid 39 and name HB1 ) 5.000 5.000 0
assign ( resid 38 and name HN ) ( resid 39 and name HB2 ) 5.000 5.000 0
assign ( resid 38 and name HN ) ( resid 39 and name HN ) 2.700 2.700 0
assign ( resid 38 and name HN ) ( resid 40 and name HN ) 5.000 5.000 0
assign ( resid 39 and name HA ) ( resid 15 and name HD22 ) 2.700 2.700 0
assign ( resid 39 and name HA ) ( resid 40 and name HN ) 5.000 5.000 0
assign ( resid 39 and name HA ) ( resid 42 and name HN ) 3.400 3.400 0
assign ( resid 39 and name HA ) ( resid 42 and name HB ) 2.700 2.700 0
assign ( resid 39 and name HN ) ( resid 40 and name HN ) 2.700 2.700 0
assign ( resid 39 and name HB2 ) ( resid 42 and name HB ) 6.000 6.000 0
assign ( resid 40 and name HA ) ( resid 41 and name HN ) 3.400 3.400 0
assign ( resid 40 and name HA ) ( resid 43 and name HB* ) 2.700 2.700 1
assign ( resid 40 and name HN ) ( resid 41 and name HN ) 2.700 2.700 0
assign ( resid 40 and name HN ) ( resid 42 and name HN ) 5.500 5.500 0
assign ( resid 41 and name HA ) ( resid 42 and name HA ) 5.000 5.000 0
assign ( resid 41 and name HA ) ( resid 42 and name HN ) 3.400 3.400 0
assign ( resid 41 and name HA ) ( resid 44 and name HB* ) 2.700 2.700 1
assign ( resid 41 and name HB* ) ( resid 42 and name HN ) 2.700 2.700 1
assign ( resid 41 and name HB* ) ( resid 45 and name HN ) 5.000 5.000 1
assign ( resid 41 and name HD* ) ( resid 42 and name HN ) 5.000 5.000 2.4
assign ( resid 41 and name HG ) ( resid 45 and name HN ) 5.000 5.000 0
assign ( resid 41 and name HN ) ( resid 42 and name HN ) 2.700 2.700 0
assign ( resid 42 and name HA ) ( resid 43 and name HN ) 3.400 3.400 0
assign ( resid 42 and name HN ) ( resid 43 and name HN ) 3.400 3.400 0
assign ( resid 42 and name HA ) ( resid 45 and name HD* ) 5.000 5.000 1
assign ( resid 42 and name HA ) ( resid 45 and name HN ) 3.400 3.400 0
assign ( resid 42 and name HG* ) ( resid 45 and name HB* ) 2.700 2.700 2
assign ( resid 42 and name HG* ) ( resid 43 and name HN ) 3.400 3.400 1
assign ( resid 42 and name HG* ) ( resid 46 and name HN ) 5.000 5.000 1
assign ( resid 42 and name HB ) ( resid 44 and name HB* ) 5.000 5.000 1
assign ( resid 43 and name HB* ) ( resid 44 and name HA ) 5.500 5.500 1
assign ( resid 43 and name HB* ) ( resid 44 and name HN ) 2.700 2.700 1
assign ( resid 44 and name HA ) ( resid 45 and name HB* ) 5.000 5.000 1
assign ( resid 44 and name HA ) ( resid 47 and name HB* ) 5.000 5.000 1
assign ( resid 44 and name HA ) ( resid 47 and name HD* ) 5.000 5.000 1
assign ( resid 44 and name HA ) ( resid 47 and name HG* ) 5.000 5.000 1
assign ( resid 44 and name HB* ) ( resid 46 and name HN ) 5.000 5.000 1
assign ( resid 45 and name HB* ) ( resid 46 and name HN ) 5.000 5.000 1
assign ( resid 46 and name HB* ) ( resid 47 and name HN ) 5.000 5.000 1
assign ( resid 47 and name HA ) ( resid 48 and name HN ) 2.700 2.700 0
assign ( resid 47 and name HB* ) ( resid 48 and name HN ) 5.000 5.000 1
assign ( resid 48 and name HA ) ( resid 49 and name HN ) 2.700 2.700 0
assign ( resid 49 and name HA ) ( resid 50 and name HN ) 3.400 3.400 0
assign ( resid 51 and name HA ) ( resid 52 and name HN ) 2.700 2.700 0


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    SER   1          1H        SER   1 -21.525  16.075   9.353
    2   2H    SER   1          2H        SER   1 -22.636  16.532   8.152
    3   3H    SER   1          3H        SER   1 -20.970  16.750   7.899
    4    HA   SER   1           HA       SER   1 -22.460  14.181   8.011
    5   1HB   SER   1          2HB       SER   1 -21.626  16.065   6.016
    6   2HB   SER   1          1HB       SER   1 -20.713  14.575   5.786
    7    HG   SER   1           HG       SER   1 -22.969  14.865   4.836
    8    H    ILE   2           H        ILE   2 -21.117  12.279   7.982
    9    HA   ILE   2           HA       ILE   2 -18.324  12.748   8.971
   10    HB   ILE   2           HB       ILE   2 -20.129  10.354   9.417
   11   1HG1  ILE   2          2HG1      ILE   2 -20.218  11.565  11.783
   12   2HG1  ILE   2          1HG1      ILE   2 -19.954  13.006  10.801
   13   1HG2  ILE   2          1HG2      ILE   2 -18.550  10.261  11.489
   14   2HG2  ILE   2          2HG2      ILE   2 -17.513  11.333  10.547
   15   3HG2  ILE   2          3HG2      ILE   2 -17.918   9.732   9.929
   16   1HD1  ILE   2          1HD1      ILE   2 -22.015  11.098   9.822
   17   2HD1  ILE   2          2HD1      ILE   2 -22.008  12.862   9.791
   18   3HD1  ILE   2          3HD1      ILE   2 -22.415  12.007  11.280
   19    H    SER   3           H        SER   3 -19.776  12.063   6.181
   20    HA   SER   3           HA       SER   3 -17.642  10.137   5.351
   21   1HB   SER   3          2HB       SER   3 -20.630   9.965   5.107
   22   2HB   SER   3          1HB       SER   3 -19.628   9.233   3.856
   23    HG   SER   3           HG       SER   3 -19.956   7.708   5.440
   24    HA   PRO   4           HA       PRO   4 -18.171  13.856   2.574
   25   1HB   PRO   4          2HB       PRO   4 -15.576  14.709   2.740
   26   2HB   PRO   4          1HB       PRO   4 -16.836  15.225   3.879
   27   1HG   PRO   4          2HG       PRO   4 -14.717  13.162   4.209
   28   2HG   PRO   4          1HG       PRO   4 -15.348  14.330   5.380
   29   1HD   PRO   4          2HD       PRO   4 -16.062  11.697   5.342
   30   2HD   PRO   4          1HD       PRO   4 -17.112  12.993   5.959
   31    H    ARG   5           H        ARG   5 -16.313  11.001   2.741
   32    HA   ARG   5           HA       ARG   5 -15.145  11.362   0.026
   33   1HB   ARG   5          2HB       ARG   5 -14.176  10.320   2.345
   34   2HB   ARG   5          1HB       ARG   5 -14.791   8.855   1.577
   35   1HG   ARG   5          2HG       ARG   5 -13.438  10.415  -0.407
   36   2HG   ARG   5          1HG       ARG   5 -12.376  10.249   0.993
   37   1HD   ARG   5          2HD       ARG   5 -12.016   8.339  -0.497
   38   2HD   ARG   5          1HD       ARG   5 -12.850   7.764   0.961
   39    HE   ARG   5           HE       ARG   5 -15.004   8.077  -0.395
   40   1HH1  ARG   5          1HH2      ARG   5 -12.685   8.902  -2.539
   41   2HH1  ARG   5          2HH2      ARG   5 -12.987   7.641  -3.688
   42   1HH2  ARG   5          1HH1      ARG   5 -15.079   5.857  -1.573
   43   2HH2  ARG   5          2HH1      ARG   5 -14.344   5.916  -3.140
   44    H    THR   6           H        THR   6 -17.499  11.274  -0.811
   45    HA   THR   6           HA       THR   6 -18.868   8.689  -0.691
   46    HB   THR   6           HB       THR   6 -19.992  10.911  -0.844
   47    HG1  THR   6           HG1      THR   6 -21.514   9.872  -1.818
   48   1HG2  THR   6          1HG2      THR   6 -19.841  11.516  -3.557
   49   2HG2  THR   6          2HG2      THR   6 -18.176  11.137  -3.116
   50   3HG2  THR   6          3HG2      THR   6 -19.051  12.401  -2.251
   51    HA   PRO   7           HA       PRO   7 -16.866   6.849  -4.148
   52   1HB   PRO   7          2HB       PRO   7 -18.858   5.172  -4.993
   53   2HB   PRO   7          1HB       PRO   7 -17.909   4.877  -3.523
   54   1HG   PRO   7          2HG       PRO   7 -20.645   6.006  -3.812
   55   2HG   PRO   7          1HG       PRO   7 -20.003   4.901  -2.587
   56   1HD   PRO   7          2HD       PRO   7 -20.374   7.572  -2.165
   57   2HD   PRO   7          1HD       PRO   7 -19.157   6.600  -1.310
   58    HA   PRO   8           HA       PRO   8 -18.288   9.269  -7.568
   59   1HB   PRO   8          2HB       PRO   8 -16.670   8.189  -9.493
   60   2HB   PRO   8          1HB       PRO   8 -16.081   9.321  -8.260
   61   1HG   PRO   8          2HG       PRO   8 -15.830   6.362  -8.385
   62   2HG   PRO   8          1HG       PRO   8 -14.672   7.572  -7.812
   63   1HD   PRO   8          2HD       PRO   8 -16.220   6.033  -6.159
   64   2HD   PRO   8          1HD       PRO   8 -15.575   7.628  -5.716
   65    H    ASN   9           H        ASN   9 -19.817   8.999  -9.204
   66    HA   ASN   9           HA       ASN   9 -21.539   7.929 -10.390
   67   1HB   ASN   9          2HB       ASN   9 -20.710   6.454 -11.990
   68   2HB   ASN   9          1HB       ASN   9 -19.250   7.305 -11.491
   69   1HD2  ASN   9          1HD2      ASN   9 -17.546   5.876 -11.177
   70   2HD2  ASN   9          2HD2      ASN   9 -17.689   4.294 -10.579
   71    H    CYS  10           H        CYS  10 -22.953   6.029 -10.479
   72    HA   CYS  10           HA       CYS  10 -23.278   4.828  -7.807
   73   1HB   CYS  10          2HB       CYS  10 -25.200   5.736  -9.040
   74   2HB   CYS  10          1HB       CYS  10 -24.826   4.737 -10.409
   75    H    ALA  11           H        ALA  11 -22.774   2.654  -7.343
   76    HA   ALA  11           HA       ALA  11 -21.388   1.167  -9.444
   77   1HB   ALA  11          1HB       ALA  11 -22.026   0.297  -6.625
   78   2HB   ALA  11          2HB       ALA  11 -20.667   1.349  -7.023
   79   3HB   ALA  11          3HB       ALA  11 -20.724  -0.296  -7.657
   80    H    ARG  12           H        ARG  12 -24.507   1.149  -7.955
   81    HA   ARG  12           HA       ARG  12 -25.352  -1.523  -8.465
   82   1HB   ARG  12          2HB       ARG  12 -26.468   0.320  -7.166
   83   2HB   ARG  12          1HB       ARG  12 -26.865   1.094  -8.689
   84   1HG   ARG  12          2HG       ARG  12 -28.763  -0.115  -8.577
   85   2HG   ARG  12          1HG       ARG  12 -27.752  -1.449  -9.132
   86   1HD   ARG  12          2HD       ARG  12 -28.170  -0.776  -6.198
   87   2HD   ARG  12          1HD       ARG  12 -29.093  -2.016  -7.070
   88    HE   ARG  12           HE       ARG  12 -26.765  -2.984  -7.655
   89   1HH1  ARG  12          1HH2      ARG  12 -25.057  -1.070  -6.247
   90   2HH1  ARG  12          2HH2      ARG  12 -24.836  -1.797  -4.690
   91   1HH2  ARG  12          1HH1      ARG  12 -27.525  -3.962  -5.027
   92   2HH2  ARG  12          2HH1      ARG  12 -26.238  -3.432  -3.997
   93    H    CYS  13           H        CYS  13 -25.586   1.389 -10.463
   94    HA   CYS  13           HA       CYS  13 -26.591  -0.169 -12.728
   95   1HB   CYS  13          2HB       CYS  13 -26.640   2.102 -13.788
   96   2HB   CYS  13          1HB       CYS  13 -27.415   2.071 -12.222
   97    H    ARG  14           H        ARG  14 -23.313   0.888 -11.730
   98    HA   ARG  14           HA       ARG  14 -22.209   0.834 -14.418
   99   1HB   ARG  14          2HB       ARG  14 -20.044   0.357 -13.194
  100   2HB   ARG  14          1HB       ARG  14 -20.909   1.777 -12.612
  101   1HG   ARG  14          2HG       ARG  14 -20.208   0.542 -10.682
  102   2HG   ARG  14          1HG       ARG  14 -21.934   0.319 -10.856
  103   1HD   ARG  14          2HD       ARG  14 -21.678  -1.915 -10.929
  104   2HD   ARG  14          1HD       ARG  14 -20.554  -1.765 -12.292
  105    HE   ARG  14           HE       ARG  14 -19.783  -2.006  -9.489
  106   1HH1  ARG  14          1HH2      ARG  14 -18.635  -2.457 -12.515
  107   2HH1  ARG  14          2HH2      ARG  14 -17.082  -1.728 -12.274
  108   1HH2  ARG  14          1HH1      ARG  14 -17.916  -0.341  -9.207
  109   2HH2  ARG  14          2HH1      ARG  14 -16.676  -0.528 -10.403
  110    H    ASN  15           H        ASN  15 -23.094  -1.600 -12.125
  111    HA   ASN  15           HA       ASN  15 -21.647  -3.844 -12.781
  112   1HB   ASN  15          2HB       ASN  15 -24.569  -3.347 -12.232
  113   2HB   ASN  15          1HB       ASN  15 -23.916  -4.977 -12.308
  114   1HD2  ASN  15          1HD2      ASN  15 -24.756  -2.753 -10.121
  115   2HD2  ASN  15          2HD2      ASN  15 -23.547  -2.937  -8.952
  116    H    HIS  16           H        HIS  16 -24.216  -2.320 -14.560
  117    HA   HIS  16           HA       HIS  16 -24.104  -4.363 -16.714
  118   1HB   HIS  16          2HB       HIS  16 -25.946  -2.051 -16.046
  119   2HB   HIS  16          1HB       HIS  16 -26.226  -3.225 -17.310
  120    HD1  HIS  16           HD1      HIS  16 -27.176  -5.477 -16.680
  121    HD2  HIS  16           HD2      HIS  16 -25.893  -3.247 -13.403
  122    HE1  HIS  16           HE1      HIS  16 -27.884  -6.772 -14.608
  123    H    GLY  17           H        GLY  17 -22.862  -1.253 -15.986
  124   1HA   GLY  17          2HA       GLY  17 -21.154  -0.396 -17.596
  125   2HA   GLY  17          1HA       GLY  17 -22.271  -0.831 -18.892
  126    H    LEU  18           H        LEU  18 -23.292   0.648 -15.890
  127    HA   LEU  18           HA       LEU  18 -24.271   2.992 -17.451
  128   1HB   LEU  18          2HB       LEU  18 -25.467   1.225 -15.729
  129   2HB   LEU  18          1HB       LEU  18 -25.078   2.559 -14.643
  130    HG   LEU  18           HG       LEU  18 -27.316   2.853 -15.627
  131   1HD1  LEU  18          1HD1      LEU  18 -27.024   5.096 -15.860
  132   2HD1  LEU  18          2HD1      LEU  18 -25.791   4.906 -17.108
  133   3HD1  LEU  18          3HD1      LEU  18 -25.360   4.729 -15.407
  134   1HD2  LEU  18          1HD2      LEU  18 -25.832   2.123 -18.048
  135   2HD2  LEU  18          2HD2      LEU  18 -26.836   3.556 -18.270
  136   3HD2  LEU  18          3HD2      LEU  18 -27.565   2.045 -17.730
  137    H    LYS  19           H        LYS  19 -23.928   5.133 -16.567
  138    HA   LYS  19           HA       LYS  19 -22.056   5.464 -14.302
  139   1HB   LYS  19          2HB       LYS  19 -21.056   5.222 -16.819
  140   2HB   LYS  19          1HB       LYS  19 -21.380   6.956 -16.786
  141   1HG   LYS  19          2HG       LYS  19 -19.087   6.438 -15.995
  142   2HG   LYS  19          1HG       LYS  19 -20.061   7.186 -14.729
  143   1HD   LYS  19          2HD       LYS  19 -19.729   5.401 -13.402
  144   2HD   LYS  19          1HD       LYS  19 -20.466   4.354 -14.614
  145   1HE   LYS  19          2HE       LYS  19 -17.885   4.979 -15.602
  146   2HE   LYS  19          1HE       LYS  19 -17.680   4.556 -13.890
  147   1HZ   LYS  19          1HZ       LYS  19 -17.793   2.472 -14.774
  148   2HZ   LYS  19          2HZ       LYS  19 -18.764   2.948 -16.084
  149   3HZ   LYS  19          3HZ       LYS  19 -19.451   2.742 -14.543
  150    H    ILE  20           H        ILE  20 -23.849   6.503 -13.316
  151    HA   ILE  20           HA       ILE  20 -24.952   8.917 -14.662
  152    HB   ILE  20           HB       ILE  20 -26.897   8.339 -13.620
  153   1HG1  ILE  20          2HG1      ILE  20 -25.709   8.968 -11.375
  154   2HG1  ILE  20          1HG1      ILE  20 -27.233   8.130 -11.406
  155   1HG2  ILE  20          1HG2      ILE  20 -25.485   5.783 -12.971
  156   2HG2  ILE  20          2HG2      ILE  20 -26.091   6.218 -14.564
  157   3HG2  ILE  20          3HG2      ILE  20 -27.215   6.013 -13.225
  158   1HD1  ILE  20          1HD1      ILE  20 -25.664   7.055  -9.894
  159   2HD1  ILE  20          2HD1      ILE  20 -24.548   6.796 -11.224
  160   3HD1  ILE  20          3HD1      ILE  20 -26.113   5.984 -11.208
  161    H    THR  21           H        THR  21 -22.542   8.182 -12.458
  162    HA   THR  21           HA       THR  21 -21.179   9.698 -11.194
  163    HB   THR  21           HB       THR  21 -23.365  11.755 -11.363
  164    HG1  THR  21           HG1      THR  21 -22.331  12.301 -13.427
  165   1HG2  THR  21          1HG2      THR  21 -21.522  13.290 -11.357
  166   2HG2  THR  21          2HG2      THR  21 -20.368  11.999 -11.690
  167   3HG2  THR  21          3HG2      THR  21 -21.172  12.081 -10.122
  168    H    LEU  22           H        LEU  22 -24.189   8.524 -10.525
  169    HA   LEU  22           HA       LEU  22 -25.413   8.068  -8.560
  170   1HB   LEU  22          2HB       LEU  22 -23.481   6.912  -7.909
  171   2HB   LEU  22          1HB       LEU  22 -22.541   8.391  -7.728
  172    HG   LEU  22           HG       LEU  22 -23.755   8.997  -5.727
  173   1HD1  LEU  22          1HD1      LEU  22 -25.901   7.770  -6.780
  174   2HD1  LEU  22          2HD1      LEU  22 -25.746   8.051  -5.048
  175   3HD1  LEU  22          3HD1      LEU  22 -25.347   6.473  -5.724
  176   1HD2  LEU  22          1HD2      LEU  22 -23.237   6.027  -5.500
  177   2HD2  LEU  22          2HD2      LEU  22 -23.014   7.267  -4.266
  178   3HD2  LEU  22          3HD2      LEU  22 -21.926   7.198  -5.653
  179    H    LYS  23           H        LYS  23 -24.710  11.081  -9.381
  180    HA   LYS  23           HA       LYS  23 -25.014  12.480  -6.830
  181   1HB   LYS  23          2HB       LYS  23 -24.443  13.039  -9.598
  182   2HB   LYS  23          1HB       LYS  23 -25.751  14.094  -9.061
  183   1HG   LYS  23          2HG       LYS  23 -24.443  15.102  -7.412
  184   2HG   LYS  23          1HG       LYS  23 -23.335  13.732  -7.314
  185   1HD   LYS  23          2HD       LYS  23 -22.192  14.348  -9.264
  186   2HD   LYS  23          1HD       LYS  23 -23.535  15.326  -9.858
  187   1HE   LYS  23          2HE       LYS  23 -21.627  16.718  -8.994
  188   2HE   LYS  23          1HE       LYS  23 -23.130  16.994  -8.092
  189   1HZ   LYS  23          1HZ       LYS  23 -22.368  15.898  -6.288
  190   2HZ   LYS  23          2HZ       LYS  23 -20.845  16.324  -6.911
  191   3HZ   LYS  23          3HZ       LYS  23 -21.480  14.774  -7.197
  192    H    GLY  24           H        GLY  24 -26.998  12.369  -5.762
  193   1HA   GLY  24          2HA       GLY  24 -29.338  12.120  -5.485
  194   2HA   GLY  24          1HA       GLY  24 -29.438  13.289  -6.810
  195    H    HIS  25           H        HIS  25 -28.558   9.859  -6.388
  196    HA   HIS  25           HA       HIS  25 -30.123   9.244  -8.873
  197   1HB   HIS  25          2HB       HIS  25 -27.722   9.292  -9.210
  198   2HB   HIS  25          1HB       HIS  25 -27.468   8.260  -7.809
  199    HD1  HIS  25           HD1      HIS  25 -29.466   8.023 -11.070
  200    HD2  HIS  25           HD2      HIS  25 -27.012   5.698  -8.641
  201    HE1  HIS  25           HE1      HIS  25 -29.004   5.865 -12.313
  202    H    LYS  26           H        LYS  26 -28.488   6.668  -7.280
  203    HA   LYS  26           HA       LYS  26 -29.401   4.682  -6.383
  204   1HB   LYS  26          2HB       LYS  26 -30.049   7.072  -4.755
  205   2HB   LYS  26          1HB       LYS  26 -30.968   5.621  -4.346
  206   1HG   LYS  26          2HG       LYS  26 -28.805   4.354  -4.228
  207   2HG   LYS  26          1HG       LYS  26 -27.949   5.879  -4.464
  208   1HD   LYS  26          2HD       LYS  26 -28.256   6.491  -2.312
  209   2HD   LYS  26          1HD       LYS  26 -29.966   6.060  -2.359
  210   1HE   LYS  26          2HE       LYS  26 -29.354   3.662  -2.068
  211   2HE   LYS  26          1HE       LYS  26 -27.650   4.138  -1.934
  212   1HZ   LYS  26          1HZ       LYS  26 -28.122   5.476  -0.056
  213   2HZ   LYS  26          2HZ       LYS  26 -28.870   3.978   0.234
  214   3HZ   LYS  26          3HZ       LYS  26 -29.799   5.312  -0.261
  215    H    ARG  27           H        ARG  27 -32.286   6.453  -5.451
  216    HA   ARG  27           HA       ARG  27 -34.165   4.626  -6.422
  217   1HB   ARG  27          2HB       ARG  27 -34.852   6.392  -4.982
  218   2HB   ARG  27          1HB       ARG  27 -34.174   7.626  -6.043
  219   1HG   ARG  27          2HG       ARG  27 -35.864   6.912  -7.792
  220   2HG   ARG  27          1HG       ARG  27 -36.620   5.916  -6.549
  221   1HD   ARG  27          2HD       ARG  27 -37.264   7.796  -5.265
  222   2HD   ARG  27          1HD       ARG  27 -36.108   8.861  -6.087
  223    HE   ARG  27           HE       ARG  27 -37.555   8.892  -8.020
  224   1HH1  ARG  27          1HH2      ARG  27 -39.576   9.200  -5.766
  225   2HH1  ARG  27          2HH2      ARG  27 -40.782   8.049  -6.234
  226   1HH2  ARG  27          1HH1      ARG  27 -38.726   6.413  -8.497
  227   2HH2  ARG  27          2HH1      ARG  27 -40.302   6.471  -7.779
  228    H    TYR  28           H        TYR  28 -32.292   6.989  -8.190
  229    HA   TYR  28           HA       TYR  28 -33.935   6.816 -10.633
  230   1HB   TYR  28          2HB       TYR  28 -31.298   8.115  -9.878
  231   2HB   TYR  28          1HB       TYR  28 -32.050   8.289 -11.466
  232    HD1  TYR  28           HD1      TYR  28 -31.954   9.515  -8.097
  233    HD2  TYR  28           HD2      TYR  28 -34.481   9.155 -11.553
  234    HE1  TYR  28           HE1      TYR  28 -33.411  11.320  -7.219
  235    HE2  TYR  28           HE2      TYR  28 -35.938  10.961 -10.675
  236    HH   TYR  28           HH       TYR  28 -36.413  11.865  -8.135
  237    H    CYS  29           H        CYS  29 -31.561   4.924  -9.166
  238    HA   CYS  29           HA       CYS  29 -29.957   4.133 -11.422
  239   1HB   CYS  29          2HB       CYS  29 -29.532   3.861  -8.914
  240   2HB   CYS  29          1HB       CYS  29 -30.667   2.518  -8.966
  241    H    LYS  30           H        LYS  30 -30.872   3.092 -13.217
  242    HA   LYS  30           HA       LYS  30 -33.341   1.687 -13.253
  243   1HB   LYS  30          2HB       LYS  30 -31.634   2.408 -15.127
  244   2HB   LYS  30          1HB       LYS  30 -30.938   0.811 -14.851
  245   1HG   LYS  30          2HG       LYS  30 -33.558   0.144 -15.010
  246   2HG   LYS  30          1HG       LYS  30 -33.541   1.553 -16.071
  247   1HD   LYS  30          2HD       LYS  30 -31.241   0.124 -16.774
  248   2HD   LYS  30          1HD       LYS  30 -32.478  -1.112 -16.546
  249   1HE   LYS  30          2HE       LYS  30 -33.986   0.515 -17.963
  250   2HE   LYS  30          1HE       LYS  30 -32.429   1.166 -18.510
  251   1HZ   LYS  30          1HZ       LYS  30 -31.741  -1.202 -18.880
  252   2HZ   LYS  30          2HZ       LYS  30 -32.940  -0.633 -19.941
  253   3HZ   LYS  30          3HZ       LYS  30 -33.360  -1.648 -18.645
  254    H    PHE  31           H        PHE  31 -30.242   0.894 -11.979
  255    HA   PHE  31           HA       PHE  31 -30.890  -1.980 -11.552
  256   1HB   PHE  31          2HB       PHE  31 -28.385  -0.308 -11.091
  257   2HB   PHE  31          1HB       PHE  31 -28.434  -2.075 -11.129
  258    HD1  PHE  31           HD1      PHE  31 -28.708   1.018 -13.124
  259    HD2  PHE  31           HD2      PHE  31 -28.725  -3.275 -13.228
  260    HE1  PHE  31           HE1      PHE  31 -28.486   1.080 -15.586
  261    HE2  PHE  31           HE2      PHE  31 -28.514  -3.215 -15.694
  262    HZ   PHE  31           HZ       PHE  31 -28.388  -1.038 -16.879
  263    H    ARG  32           H        ARG  32 -31.660   0.790 -10.055
  264    HA   ARG  32           HA       ARG  32 -30.713   0.910  -7.468
  265   1HB   ARG  32          2HB       ARG  32 -32.745   2.046  -6.974
  266   2HB   ARG  32          1HB       ARG  32 -32.494   2.301  -8.696
  267   1HG   ARG  32          2HG       ARG  32 -34.143  -0.034  -7.742
  268   2HG   ARG  32          1HG       ARG  32 -34.857   1.568  -7.859
  269   1HD   ARG  32          2HD       ARG  32 -34.262   1.697 -10.234
  270   2HD   ARG  32          1HD       ARG  32 -33.473   0.110 -10.138
  271    HE   ARG  32           HE       ARG  32 -35.727  -0.819  -9.502
  272   1HH1  ARG  32          1HH2      ARG  32 -36.271   2.426  -9.644
  273   2HH1  ARG  32          2HH2      ARG  32 -37.535   2.373 -10.828
  274   1HH2  ARG  32          1HH1      ARG  32 -37.018  -0.962 -11.622
  275   2HH2  ARG  32          2HH1      ARG  32 -37.954   0.457 -11.949
  276    H    TYR  33           H        TYR  33 -32.819  -1.500  -8.845
  277    HA   TYR  33           HA       TYR  33 -32.778  -2.954  -6.218
  278   1HB   TYR  33          2HB       TYR  33 -35.026  -2.646  -8.230
  279   2HB   TYR  33          1HB       TYR  33 -35.094  -3.704  -6.821
  280    HD1  TYR  33           HD1      TYR  33 -36.815  -1.156  -7.572
  281    HD2  TYR  33           HD2      TYR  33 -33.472  -1.838  -4.960
  282    HE1  TYR  33           HE1      TYR  33 -37.514   0.767  -6.170
  283    HE2  TYR  33           HE2      TYR  33 -34.170   0.083  -3.564
  284    HH   TYR  33           HH       TYR  33 -37.196   1.809  -4.193
  285    H    CYS  34           H        CYS  34 -31.562  -3.041  -9.237
  286    HA   CYS  34           HA       CYS  34 -32.167  -5.469 -10.460
  287   1HB   CYS  34          2HB       CYS  34 -30.461  -3.751 -11.174
  288   2HB   CYS  34          1HB       CYS  34 -29.402  -4.358  -9.901
  289    H    THR  35           H        THR  35 -30.810  -7.550 -10.284
  290    HA   THR  35           HA       THR  35 -29.937  -8.115  -7.486
  291    HB   THR  35           HB       THR  35 -31.329 -10.182  -7.579
  292    HG1  THR  35           HG1      THR  35 -31.995  -9.047 -10.074
  293   1HG2  THR  35          1HG2      THR  35 -33.321  -8.105  -8.226
  294   2HG2  THR  35          2HG2      THR  35 -32.124  -7.627  -7.022
  295   3HG2  THR  35          3HG2      THR  35 -33.121  -9.056  -6.754
  296    H    CYS  36           H        CYS  36 -29.150  -8.222 -10.724
  297    HA   CYS  36           HA       CYS  36 -28.135 -10.740 -11.321
  298   1HB   CYS  36          2HB       CYS  36 -26.621  -9.574 -12.769
  299   2HB   CYS  36          1HB       CYS  36 -28.069  -8.574 -12.655
  300    H    GLU  37           H        GLU  37 -25.680 -11.382 -11.146
  301    HA   GLU  37           HA       GLU  37 -24.988 -11.441  -8.313
  302   1HB   GLU  37          2HB       GLU  37 -24.744 -13.240 -10.126
  303   2HB   GLU  37          1HB       GLU  37 -23.326 -12.345 -10.671
  304   1HG   GLU  37          2HG       GLU  37 -23.198 -12.645  -7.816
  305   2HG   GLU  37          1HG       GLU  37 -23.474 -14.226  -8.550
  306    H    LYS  38           H        LYS  38 -24.468  -9.054 -10.570
  307    HA   LYS  38           HA       LYS  38 -21.743  -8.336  -9.566
  308   1HB   LYS  38          2HB       LYS  38 -23.380  -7.912 -11.996
  309   2HB   LYS  38          1HB       LYS  38 -22.471  -6.492 -11.477
  310   1HG   LYS  38          2HG       LYS  38 -20.786  -7.466 -12.672
  311   2HG   LYS  38          1HG       LYS  38 -20.566  -8.406 -11.196
  312   1HD   LYS  38          2HD       LYS  38 -22.603  -9.750 -12.537
  313   2HD   LYS  38          1HD       LYS  38 -21.492  -9.280 -13.824
  314   1HE   LYS  38          2HE       LYS  38 -19.864 -10.179 -11.686
  315   2HE   LYS  38          1HE       LYS  38 -21.166 -11.372 -11.864
  316   1HZ   LYS  38          1HZ       LYS  38 -20.775 -11.366 -14.262
  317   2HZ   LYS  38          2HZ       LYS  38 -19.384 -11.850 -13.415
  318   3HZ   LYS  38          3HZ       LYS  38 -19.486 -10.282 -14.060
  319    H    CYS  39           H        CYS  39 -25.078  -7.575  -9.342
  320    HA   CYS  39           HA       CYS  39 -24.691  -4.870  -8.236
  321   1HB   CYS  39          2HB       CYS  39 -26.856  -6.683  -9.164
  322   2HB   CYS  39          1HB       CYS  39 -27.295  -5.622  -7.840
  323    H    ARG  40           H        ARG  40 -25.436  -8.192  -7.293
  324    HA   ARG  40           HA       ARG  40 -25.902  -7.649  -4.477
  325   1HB   ARG  40          2HB       ARG  40 -25.142 -10.146  -6.028
  326   2HB   ARG  40          1HB       ARG  40 -25.724 -10.139  -4.364
  327   1HG   ARG  40          2HG       ARG  40 -27.794  -8.928  -5.234
  328   2HG   ARG  40          1HG       ARG  40 -27.231  -9.324  -6.857
  329   1HD   ARG  40          2HD       ARG  40 -27.893 -11.302  -4.644
  330   2HD   ARG  40          1HD       ARG  40 -28.777 -11.071  -6.164
  331    HE   ARG  40           HE       ARG  40 -25.892 -11.800  -6.285
  332   1HH1  ARG  40          1HH2      ARG  40 -28.660 -11.766  -8.071
  333   2HH1  ARG  40          2HH2      ARG  40 -28.610 -13.427  -8.560
  334   1HH2  ARG  40          1HH1      ARG  40 -26.055 -14.269  -6.370
  335   2HH2  ARG  40          2HH1      ARG  40 -27.133 -14.844  -7.597
  336    H    LEU  41           H        LEU  41 -23.210  -8.757  -6.473
  337    HA   LEU  41           HA       LEU  41 -21.300  -9.193  -4.395
  338   1HB   LEU  41          2HB       LEU  41 -20.498 -10.048  -6.356
  339   2HB   LEU  41          1HB       LEU  41 -21.445  -8.921  -7.321
  340    HG   LEU  41           HG       LEU  41 -19.785  -7.170  -6.987
  341   1HD1  LEU  41          1HD1      LEU  41 -19.149  -8.551  -4.678
  342   2HD1  LEU  41          2HD1      LEU  41 -18.203  -7.226  -5.358
  343   3HD1  LEU  41          3HD1      LEU  41 -17.771  -8.897  -5.722
  344   1HD2  LEU  41          1HD2      LEU  41 -19.452  -9.409  -8.531
  345   2HD2  LEU  41          2HD2      LEU  41 -17.946  -9.393  -7.612
  346   3HD2  LEU  41          3HD2      LEU  41 -18.396  -7.997  -8.591
  347    H    THR  42           H        THR  42 -22.424  -6.331  -6.068
  348    HA   THR  42           HA       THR  42 -20.354  -4.523  -5.169
  349    HB   THR  42           HB       THR  42 -23.208  -4.216  -6.119
  350    HG1  THR  42           HG1      THR  42 -20.670  -4.252  -7.253
  351   1HG2  THR  42          1HG2      THR  42 -23.153  -2.061  -5.486
  352   2HG2  THR  42          2HG2      THR  42 -21.710  -1.821  -6.471
  353   3HG2  THR  42          3HG2      THR  42 -21.555  -2.299  -4.781
  354    H    ALA  43           H        ALA  43 -23.770  -4.618  -4.208
  355    HA   ALA  43           HA       ALA  43 -23.657  -3.129  -1.855
  356   1HB   ALA  43          1HB       ALA  43 -25.298  -5.500  -1.526
  357   2HB   ALA  43          2HB       ALA  43 -25.418  -4.900  -3.179
  358   3HB   ALA  43          3HB       ALA  43 -25.811  -3.840  -1.826
  359    H    ASP  44           H        ASP  44 -22.529  -6.377  -2.483
  360    HA   ASP  44           HA       ASP  44 -22.129  -7.185   0.274
  361   1HB   ASP  44          2HB       ASP  44 -22.369  -8.594  -1.854
  362   2HB   ASP  44          1HB       ASP  44 -20.709  -8.134  -2.230
  363    H    ARG  45           H        ARG  45 -20.131  -5.687  -2.245
  364    HA   ARG  45           HA       ARG  45 -17.596  -5.758  -0.980
  365   1HB   ARG  45          2HB       ARG  45 -18.395  -5.016  -3.341
  366   2HB   ARG  45          1HB       ARG  45 -18.664  -3.439  -2.597
  367   1HG   ARG  45          2HG       ARG  45 -16.303  -3.408  -1.840
  368   2HG   ARG  45          1HG       ARG  45 -16.039  -4.960  -2.637
  369   1HD   ARG  45          2HD       ARG  45 -17.270  -2.915  -4.379
  370   2HD   ARG  45          1HD       ARG  45 -15.617  -2.538  -3.854
  371    HE   ARG  45           HE       ARG  45 -16.283  -4.586  -5.728
  372   1HH1  ARG  45          1HH2      ARG  45 -13.774  -3.362  -3.923
  373   2HH1  ARG  45          2HH2      ARG  45 -12.860  -4.832  -3.842
  374   1HH2  ARG  45          1HH1      ARG  45 -15.391  -6.789  -5.179
  375   2HH2  ARG  45          2HH1      ARG  45 -13.776  -6.771  -4.555
  376    H    GLN  46           H        GLN  46 -20.255  -3.403  -0.672
  377    HA   GLN  46           HA       GLN  46 -18.800  -1.622   1.103
  378   1HB   GLN  46          2HB       GLN  46 -21.756  -1.988   0.519
  379   2HB   GLN  46          1HB       GLN  46 -21.038  -0.578   1.300
  380   1HG   GLN  46          2HG       GLN  46 -19.497  -0.651  -0.897
  381   2HG   GLN  46          1HG       GLN  46 -20.944  -1.416  -1.559
  382   1HE2  GLN  46          1HE2      GLN  46 -21.464   0.486  -2.870
  383   2HE2  GLN  46          2HE2      GLN  46 -22.049   1.911  -2.158
  384    H    ARG  47           H        ARG  47 -21.482  -3.952   1.652
  385    HA   ARG  47           HA       ARG  47 -21.512  -3.652   4.508
  386   1HB   ARG  47          2HB       ARG  47 -23.098  -4.778   2.641
  387   2HB   ARG  47          1HB       ARG  47 -22.283  -6.229   3.225
  388   1HG   ARG  47          2HG       ARG  47 -22.894  -5.583   5.561
  389   2HG   ARG  47          1HG       ARG  47 -23.807  -4.221   4.910
  390   1HD   ARG  47          2HD       ARG  47 -25.237  -5.789   3.628
  391   2HD   ARG  47          1HD       ARG  47 -24.334  -7.156   4.310
  392    HE   ARG  47           HE       ARG  47 -25.040  -6.228   6.591
  393   1HH1  ARG  47          1HH2      ARG  47 -26.525  -4.499   4.125
  394   2HH1  ARG  47          2HH2      ARG  47 -28.140  -4.691   4.721
  395   1HH2  ARG  47          1HH1      ARG  47 -27.239  -6.949   7.195
  396   2HH2  ARG  47          2HH1      ARG  47 -28.544  -6.074   6.463
  397    H    VAL  48           H        VAL  48 -20.547  -4.964   6.124
  398    HA   VAL  48           HA       VAL  48 -18.467  -6.914   5.202
  399    HB   VAL  48           HB       VAL  48 -17.474  -4.707   5.712
  400   1HG1  VAL  48          1HG1      VAL  48 -17.925  -4.759   8.579
  401   2HG1  VAL  48          2HG1      VAL  48 -19.455  -4.665   7.706
  402   3HG1  VAL  48          3HG1      VAL  48 -18.207  -3.448   7.432
  403   1HG2  VAL  48          1HG2      VAL  48 -15.735  -5.520   7.070
  404   2HG2  VAL  48          2HG2      VAL  48 -16.436  -7.001   6.418
  405   3HG2  VAL  48          3HG2      VAL  48 -16.832  -6.487   8.058
  406    H    MET  49           H        MET  49 -19.019  -8.858   6.107
  407    HA   MET  49           HA       MET  49 -20.316  -8.849   8.809
  408   1HB   MET  49          2HB       MET  49 -21.395  -9.739   6.571
  409   2HB   MET  49          1HB       MET  49 -20.369 -11.143   6.870
  410   1HG   MET  49          2HG       MET  49 -21.625 -10.427   9.335
  411   2HG   MET  49          1HG       MET  49 -22.870 -10.504   8.089
  412   1HE   MET  49          1HE       MET  49 -23.458 -13.545   6.929
  413   2HE   MET  49          2HE       MET  49 -23.967 -11.988   7.578
  414   3HE   MET  49          3HE       MET  49 -24.066 -13.430   8.586
  415    H    ALA  50           H        ALA  50 -17.547  -9.801   7.010
  416    HA   ALA  50           HA       ALA  50 -16.468 -11.209   9.404
  417   1HB   ALA  50          1HB       ALA  50 -17.599 -12.622   7.405
  418   2HB   ALA  50          2HB       ALA  50 -16.195 -13.214   8.294
  419   3HB   ALA  50          3HB       ALA  50 -15.981 -12.432   6.728
  420    H    LEU  51           H        LEU  51 -14.283 -10.763   9.681
  421    HA   LEU  51           HA       LEU  51 -12.942  -9.210   7.493
  422   1HB   LEU  51          2HB       LEU  51 -12.740  -9.126  10.518
  423   2HB   LEU  51          1HB       LEU  51 -11.670  -8.221   9.445
  424    HG   LEU  51           HG       LEU  51 -14.456  -7.859   8.700
  425   1HD1  LEU  51          1HD1      LEU  51 -13.635  -6.962  11.480
  426   2HD1  LEU  51          2HD1      LEU  51 -14.797  -8.244  11.136
  427   3HD1  LEU  51          3HD1      LEU  51 -15.154  -6.581  10.670
  428   1HD2  LEU  51          1HD2      LEU  51 -12.296  -5.958   9.666
  429   2HD2  LEU  51          2HD2      LEU  51 -13.783  -5.488   8.843
  430   3HD2  LEU  51          3HD2      LEU  51 -12.564  -6.434   7.989
  431    H    GLN  52           H        GLN  52 -10.737  -9.715   7.057
  432    HA   GLN  52           HA       GLN  52  -9.789 -12.312   8.226
  433   1HB   GLN  52          2HB       GLN  52 -10.467 -12.382   5.849
  434   2HB   GLN  52          1HB       GLN  52  -9.346 -11.067   5.491
  435   1HG   GLN  52          2HG       GLN  52  -7.564 -12.460   5.450
  436   2HG   GLN  52          1HG       GLN  52  -8.071 -13.278   6.928
  437   1HE2  GLN  52          1HE2      GLN  52  -9.377 -15.198   6.726
  438   2HE2  GLN  52          2HE2      GLN  52  -9.667 -15.944   5.229
  Start of MODEL    2
    1   1H    SER   1          1H        SER   1 -30.609  20.374 -13.272
    2   2H    SER   1          2H        SER   1 -32.284  20.538 -13.504
    3   3H    SER   1          3H        SER   1 -31.533  21.273 -12.169
    4    HA   SER   1           HA       SER   1 -31.272  22.027 -15.031
    5   1HB   SER   1          2HB       SER   1 -33.202  22.980 -14.095
    6   2HB   SER   1          1HB       SER   1 -32.476  23.109 -12.495
    7    HG   SER   1           HG       SER   1 -31.656  24.971 -13.035
    8    H    ILE   2           H        ILE   2 -29.982  22.388 -11.733
    9    HA   ILE   2           HA       ILE   2 -27.489  23.533 -12.933
   10    HB   ILE   2           HB       ILE   2 -28.993  25.283 -11.975
   11   1HG1  ILE   2          2HG1      ILE   2 -26.504  24.808 -10.304
   12   2HG1  ILE   2          1HG1      ILE   2 -26.499  25.509 -11.922
   13   1HG2  ILE   2          1HG2      ILE   2 -29.695  23.463 -10.131
   14   2HG2  ILE   2          2HG2      ILE   2 -29.817  25.197  -9.829
   15   3HG2  ILE   2          3HG2      ILE   2 -28.431  24.292  -9.221
   16   1HD1  ILE   2          1HD1      ILE   2 -26.755  26.938  -9.565
   17   2HD1  ILE   2          2HD1      ILE   2 -28.422  26.800 -10.125
   18   3HD1  ILE   2          3HD1      ILE   2 -27.198  27.526 -11.167
   19    H    SER   3           H        SER   3 -26.377  21.524 -12.627
   20    HA   SER   3           HA       SER   3 -25.629  20.964  -9.808
   21   1HB   SER   3          2HB       SER   3 -26.154  18.522 -10.239
   22   2HB   SER   3          1HB       SER   3 -27.569  19.566 -10.169
   23    HG   SER   3           HG       SER   3 -27.039  17.967 -12.073
   24    HA   PRO   4           HA       PRO   4 -21.820  20.481 -12.061
   25   1HB   PRO   4          2HB       PRO   4 -20.263  19.837  -9.903
   26   2HB   PRO   4          1HB       PRO   4 -20.785  21.498 -10.256
   27   1HG   PRO   4          2HG       PRO   4 -21.876  19.548  -8.290
   28   2HG   PRO   4          1HG       PRO   4 -21.651  21.297  -8.139
   29   1HD   PRO   4          2HD       PRO   4 -24.062  20.127  -8.653
   30   2HD   PRO   4          1HD       PRO   4 -23.639  21.774  -9.170
   31    H    ARG   5           H        ARG   5 -19.945  18.613 -11.727
   32    HA   ARG   5           HA       ARG   5 -21.415  15.998 -11.605
   33   1HB   ARG   5          2HB       ARG   5 -20.739  16.884 -13.880
   34   2HB   ARG   5          1HB       ARG   5 -19.059  16.756 -13.357
   35   1HG   ARG   5          2HG       ARG   5 -19.058  14.571 -13.887
   36   2HG   ARG   5          1HG       ARG   5 -20.363  14.292 -12.733
   37   1HD   ARG   5          2HD       ARG   5 -21.791  13.918 -14.449
   38   2HD   ARG   5          1HD       ARG   5 -21.472  15.550 -15.068
   39    HE   ARG   5           HE       ARG   5 -19.258  13.803 -15.664
   40   1HH1  ARG   5          1HH2      ARG   5 -22.142  12.650 -16.411
   41   2HH1  ARG   5          2HH2      ARG   5 -22.122  12.988 -18.110
   42   1HH2  ARG   5          1HH1      ARG   5 -19.366  15.087 -17.929
   43   2HH2  ARG   5          2HH1      ARG   5 -20.550  14.370 -18.969
   44    H    THR   6           H        THR   6 -20.343  14.307 -10.531
   45    HA   THR   6           HA       THR   6 -17.817  15.066  -9.106
   46    HB   THR   6           HB       THR   6 -18.603  13.573  -7.365
   47    HG1  THR   6           HG1      THR   6 -20.520  12.383  -7.697
   48   1HG2  THR   6          1HG2      THR   6 -21.252  14.640  -7.813
   49   2HG2  THR   6          2HG2      THR   6 -20.031  15.839  -8.237
   50   3HG2  THR   6          3HG2      THR   6 -20.047  15.129  -6.623
   51    HA   PRO   7           HA       PRO   7 -15.733  11.811 -11.149
   52   1HB   PRO   7          2HB       PRO   7 -14.023  10.910  -9.213
   53   2HB   PRO   7          1HB       PRO   7 -13.824  12.450 -10.070
   54   1HG   PRO   7          2HG       PRO   7 -14.832  11.926  -7.338
   55   2HG   PRO   7          1HG       PRO   7 -13.919  13.302  -7.963
   56   1HD   PRO   7          2HD       PRO   7 -16.644  13.301  -7.473
   57   2HD   PRO   7          1HD       PRO   7 -15.797  14.440  -8.541
   58    HA   PRO   8           HA       PRO   8 -16.897   8.020  -8.431
   59   1HB   PRO   8          2HB       PRO   8 -19.006   8.347  -6.721
   60   2HB   PRO   8          1HB       PRO   8 -17.315   8.570  -6.234
   61   1HG   PRO   8          2HG       PRO   8 -19.378  10.598  -6.889
   62   2HG   PRO   8          1HG       PRO   8 -18.089  10.645  -5.679
   63   1HD   PRO   8          2HD       PRO   8 -17.994  11.931  -8.090
   64   2HD   PRO   8          1HD       PRO   8 -16.565  11.457  -7.157
   65    H    ASN   9           H        ASN   9 -19.274   6.829  -8.150
   66    HA   ASN   9           HA       ASN   9 -21.397   7.736  -9.936
   67   1HB   ASN   9          2HB       ASN   9 -20.916   6.246 -11.775
   68   2HB   ASN   9          1HB       ASN   9 -19.435   7.153 -11.456
   69   1HD2  ASN   9          1HD2      ASN   9 -20.526   4.048 -12.034
   70   2HD2  ASN   9          2HD2      ASN   9 -19.285   3.176 -11.272
   71    H    CYS  10           H        CYS  10 -23.056   6.017 -10.130
   72    HA   CYS  10           HA       CYS  10 -23.360   4.530  -7.659
   73   1HB   CYS  10          2HB       CYS  10 -25.236   5.523  -8.904
   74   2HB   CYS  10          1HB       CYS  10 -24.844   4.563 -10.294
   75    H    ALA  11           H        ALA  11 -22.692   2.411  -7.285
   76    HA   ALA  11           HA       ALA  11 -21.361   0.997  -9.459
   77   1HB   ALA  11          1HB       ALA  11 -21.958   0.033  -6.662
   78   2HB   ALA  11          2HB       ALA  11 -20.603   1.094  -7.048
   79   3HB   ALA  11          3HB       ALA  11 -20.674  -0.530  -7.732
   80    H    ARG  12           H        ARG  12 -24.465   0.961  -7.976
   81    HA   ARG  12           HA       ARG  12 -25.346  -1.695  -8.519
   82   1HB   ARG  12          2HB       ARG  12 -26.427   0.177  -7.206
   83   2HB   ARG  12          1HB       ARG  12 -26.836   0.936  -8.738
   84   1HG   ARG  12          2HG       ARG  12 -28.595  -0.393  -9.002
   85   2HG   ARG  12          1HG       ARG  12 -27.607  -1.835  -8.779
   86   1HD   ARG  12          2HD       ARG  12 -27.732  -1.012  -6.209
   87   2HD   ARG  12          1HD       ARG  12 -29.279  -0.369  -6.793
   88    HE   ARG  12           HE       ARG  12 -29.078  -2.974  -7.836
   89   1HH1  ARG  12          1HH2      ARG  12 -29.277  -1.348  -4.797
   90   2HH1  ARG  12          2HH2      ARG  12 -29.966  -2.704  -3.969
   91   1HH2  ARG  12          1HH1      ARG  12 -29.926  -4.769  -6.751
   92   2HH2  ARG  12          2HH1      ARG  12 -30.338  -4.635  -5.074
   93    H    CYS  13           H        CYS  13 -25.562   1.241 -10.472
   94    HA   CYS  13           HA       CYS  13 -26.564  -0.276 -12.763
   95   1HB   CYS  13          2HB       CYS  13 -26.625   2.022 -13.773
   96   2HB   CYS  13          1HB       CYS  13 -27.408   1.939 -12.214
   97    H    ARG  14           H        ARG  14 -23.286   0.726 -11.737
   98    HA   ARG  14           HA       ARG  14 -22.177   0.745 -14.430
   99   1HB   ARG  14          2HB       ARG  14 -20.017   0.232 -13.214
  100   2HB   ARG  14          1HB       ARG  14 -20.874   1.643 -12.605
  101   1HG   ARG  14          2HG       ARG  14 -20.174   0.355 -10.701
  102   2HG   ARG  14          1HG       ARG  14 -21.902   0.170 -10.874
  103   1HD   ARG  14          2HD       ARG  14 -21.715  -2.068 -11.047
  104   2HD   ARG  14          1HD       ARG  14 -20.518  -1.908 -12.345
  105    HE   ARG  14           HE       ARG  14 -19.889  -2.371  -9.570
  106   1HH1  ARG  14          1HH2      ARG  14 -18.853  -1.079 -12.579
  107   2HH1  ARG  14          2HH2      ARG  14 -17.224  -0.803 -12.058
  108   1HH2  ARG  14          1HH1      ARG  14 -17.811  -1.837  -8.801
  109   2HH2  ARG  14          2HH1      ARG  14 -16.635  -1.231  -9.918
  110    H    ASN  15           H        ASN  15 -23.125  -1.739 -12.230
  111    HA   ASN  15           HA       ASN  15 -21.663  -3.977 -12.921
  112   1HB   ASN  15          2HB       ASN  15 -24.579  -3.471 -12.354
  113   2HB   ASN  15          1HB       ASN  15 -23.949  -5.107 -12.492
  114   1HD2  ASN  15          1HD2      ASN  15 -24.681  -2.832 -10.270
  115   2HD2  ASN  15          2HD2      ASN  15 -23.510  -3.136  -9.087
  116    H    HIS  16           H        HIS  16 -24.234  -2.411 -14.668
  117    HA   HIS  16           HA       HIS  16 -24.116  -4.407 -16.863
  118   1HB   HIS  16          2HB       HIS  16 -25.975  -2.121 -16.156
  119   2HB   HIS  16          1HB       HIS  16 -26.254  -3.302 -17.416
  120    HD1  HIS  16           HD1      HIS  16 -27.151  -5.581 -16.766
  121    HD2  HIS  16           HD2      HIS  16 -25.904  -3.297 -13.513
  122    HE1  HIS  16           HE1      HIS  16 -27.836  -6.868 -14.679
  123    H    GLY  17           H        GLY  17 -22.878  -1.314 -16.067
  124   1HA   GLY  17          2HA       GLY  17 -21.188  -0.414 -17.673
  125   2HA   GLY  17          1HA       GLY  17 -22.317  -0.817 -18.969
  126    H    LEU  18           H        LEU  18 -23.260   0.610 -15.906
  127    HA   LEU  18           HA       LEU  18 -24.257   2.990 -17.407
  128   1HB   LEU  18          2HB       LEU  18 -25.461   1.190 -15.729
  129   2HB   LEU  18          1HB       LEU  18 -25.055   2.488 -14.607
  130    HG   LEU  18           HG       LEU  18 -27.297   2.817 -15.595
  131   1HD1  LEU  18          1HD1      LEU  18 -25.788   4.939 -16.969
  132   2HD1  LEU  18          2HD1      LEU  18 -25.303   4.662 -15.295
  133   3HD1  LEU  18          3HD1      LEU  18 -26.979   5.061 -15.672
  134   1HD2  LEU  18          1HD2      LEU  18 -27.620   2.281 -17.761
  135   2HD2  LEU  18          2HD2      LEU  18 -25.885   2.045 -17.984
  136   3HD2  LEU  18          3HD2      LEU  18 -26.596   3.641 -18.222
  137    H    LYS  19           H        LYS  19 -23.899   5.109 -16.464
  138    HA   LYS  19           HA       LYS  19 -21.983   5.363 -14.222
  139   1HB   LYS  19          2HB       LYS  19 -21.535   6.230 -17.093
  140   2HB   LYS  19          1HB       LYS  19 -20.597   6.883 -15.749
  141   1HG   LYS  19          2HG       LYS  19 -20.808   3.955 -16.511
  142   2HG   LYS  19          1HG       LYS  19 -19.407   4.995 -16.773
  143   1HD   LYS  19          2HD       LYS  19 -19.988   5.330 -14.068
  144   2HD   LYS  19          1HD       LYS  19 -20.246   3.606 -14.348
  145   1HE   LYS  19          2HE       LYS  19 -17.763   5.037 -15.335
  146   2HE   LYS  19          1HE       LYS  19 -17.848   4.260 -13.742
  147   1HZ   LYS  19          1HZ       LYS  19 -17.844   3.053 -16.386
  148   2HZ   LYS  19          2HZ       LYS  19 -18.946   2.383 -15.281
  149   3HZ   LYS  19          3HZ       LYS  19 -17.289   2.429 -14.911
  150    H    ILE  20           H        ILE  20 -23.751   6.387 -13.167
  151    HA   ILE  20           HA       ILE  20 -24.835   8.868 -14.407
  152    HB   ILE  20           HB       ILE  20 -26.795   8.233 -13.447
  153   1HG1  ILE  20          2HG1      ILE  20 -25.635   8.818 -11.153
  154   2HG1  ILE  20          1HG1      ILE  20 -27.183   8.023 -11.242
  155   1HG2  ILE  20          1HG2      ILE  20 -27.102   5.895 -13.086
  156   2HG2  ILE  20          2HG2      ILE  20 -25.379   5.676 -12.792
  157   3HG2  ILE  20          3HG2      ILE  20 -25.947   6.128 -14.392
  158   1HD1  ILE  20          1HD1      ILE  20 -24.548   6.606 -11.037
  159   2HD1  ILE  20          2HD1      ILE  20 -26.140   5.851 -11.043
  160   3HD1  ILE  20          3HD1      ILE  20 -25.660   6.890  -9.712
  161    H    THR  21           H        THR  21 -22.470   7.989 -12.168
  162    HA   THR  21           HA       THR  21 -21.124   9.426 -10.798
  163    HB   THR  21           HB       THR  21 -23.246  11.538 -11.049
  164    HG1  THR  21           HG1      THR  21 -21.710  10.401 -13.046
  165   1HG2  THR  21          1HG2      THR  21 -20.549  11.359 -10.099
  166   2HG2  THR  21          2HG2      THR  21 -21.628  12.755 -10.080
  167   3HG2  THR  21          3HG2      THR  21 -20.590  12.460 -11.476
  168    H    LEU  22           H        LEU  22 -24.112   8.254 -10.248
  169    HA   LEU  22           HA       LEU  22 -25.497   7.896  -8.352
  170   1HB   LEU  22          2HB       LEU  22 -23.488   6.668  -7.776
  171   2HB   LEU  22          1HB       LEU  22 -22.718   8.135  -7.176
  172    HG   LEU  22           HG       LEU  22 -25.308   7.751  -5.932
  173   1HD1  LEU  22          1HD1      LEU  22 -24.984   5.695  -4.802
  174   2HD1  LEU  22          2HD1      LEU  22 -23.296   5.590  -5.302
  175   3HD1  LEU  22          3HD1      LEU  22 -24.582   5.336  -6.482
  176   1HD2  LEU  22          1HD2      LEU  22 -22.748   8.760  -5.338
  177   2HD2  LEU  22          2HD2      LEU  22 -22.996   7.425  -4.213
  178   3HD2  LEU  22          3HD2      LEU  22 -24.154   8.754  -4.274
  179    H    LYS  23           H        LYS  23 -24.934  10.807  -9.146
  180    HA   LYS  23           HA       LYS  23 -24.913  12.259  -6.597
  181   1HB   LYS  23          2HB       LYS  23 -24.222  12.876  -9.116
  182   2HB   LYS  23          1HB       LYS  23 -25.895  13.429  -9.172
  183   1HG   LYS  23          2HG       LYS  23 -23.933  14.255  -7.017
  184   2HG   LYS  23          1HG       LYS  23 -24.241  15.203  -8.472
  185   1HD   LYS  23          2HD       LYS  23 -26.732  15.068  -7.810
  186   2HD   LYS  23          1HD       LYS  23 -26.150  14.549  -6.228
  187   1HE   LYS  23          2HE       LYS  23 -25.014  17.036  -7.508
  188   2HE   LYS  23          1HE       LYS  23 -26.537  17.103  -6.599
  189   1HZ   LYS  23          1HZ       LYS  23 -24.280  17.340  -5.348
  190   2HZ   LYS  23          2HZ       LYS  23 -24.249  15.646  -5.469
  191   3HZ   LYS  23          3HZ       LYS  23 -25.532  16.420  -4.668
  192    H    GLY  24           H        GLY  24 -26.760  11.917  -5.307
  193   1HA   GLY  24          2HA       GLY  24 -29.054  11.641  -4.780
  194   2HA   GLY  24          1HA       GLY  24 -29.299  12.937  -5.961
  195    H    HIS  25           H        HIS  25 -28.115   9.614  -6.245
  196    HA   HIS  25           HA       HIS  25 -29.959   9.191  -8.556
  197   1HB   HIS  25          2HB       HIS  25 -27.585   9.120  -8.975
  198   2HB   HIS  25          1HB       HIS  25 -27.328   8.032  -7.618
  199    HD1  HIS  25           HD1      HIS  25 -29.380   7.995 -10.852
  200    HD2  HIS  25           HD2      HIS  25 -27.034   5.470  -8.522
  201    HE1  HIS  25           HE1      HIS  25 -29.023   5.867 -12.175
  202    H    LYS  26           H        LYS  26 -28.419   6.456  -7.108
  203    HA   LYS  26           HA       LYS  26 -29.394   4.478  -6.270
  204   1HB   LYS  26          2HB       LYS  26 -30.243   6.836  -4.640
  205   2HB   LYS  26          1HB       LYS  26 -31.011   5.289  -4.281
  206   1HG   LYS  26          2HG       LYS  26 -29.000   4.283  -3.652
  207   2HG   LYS  26          1HG       LYS  26 -28.025   5.422  -4.581
  208   1HD   LYS  26          2HD       LYS  26 -27.695   6.125  -2.357
  209   2HD   LYS  26          1HD       LYS  26 -28.956   7.213  -2.941
  210   1HE   LYS  26          2HE       LYS  26 -30.232   4.845  -1.949
  211   2HE   LYS  26          1HE       LYS  26 -29.099   5.433  -0.714
  212   1HZ   LYS  26          1HZ       LYS  26 -30.839   7.293  -2.211
  213   2HZ   LYS  26          2HZ       LYS  26 -30.049   7.542  -0.727
  214   3HZ   LYS  26          3HZ       LYS  26 -31.402   6.515  -0.813
  215    H    ARG  27           H        ARG  27 -32.310   6.236  -5.448
  216    HA   ARG  27           HA       ARG  27 -34.145   4.471  -6.585
  217   1HB   ARG  27          2HB       ARG  27 -34.339   7.499  -6.454
  218   2HB   ARG  27          1HB       ARG  27 -35.692   6.368  -6.457
  219   1HG   ARG  27          2HG       ARG  27 -34.118   5.435  -4.380
  220   2HG   ARG  27          1HG       ARG  27 -33.954   7.186  -4.243
  221   1HD   ARG  27          2HD       ARG  27 -35.946   7.093  -3.132
  222   2HD   ARG  27          1HD       ARG  27 -36.667   6.860  -4.738
  223    HE   ARG  27           HE       ARG  27 -35.711   4.337  -3.910
  224   1HH1  ARG  27          1HH2      ARG  27 -38.514   6.106  -4.107
  225   2HH1  ARG  27          2HH2      ARG  27 -39.377   5.241  -2.879
  226   1HH2  ARG  27          1HH1      ARG  27 -36.598   3.460  -1.812
  227   2HH2  ARG  27          2HH1      ARG  27 -38.292   3.742  -1.578
  228    H    TYR  28           H        TYR  28 -32.304   7.042  -8.158
  229    HA   TYR  28           HA       TYR  28 -33.756   6.861 -10.701
  230   1HB   TYR  28          2HB       TYR  28 -31.133   8.140  -9.856
  231   2HB   TYR  28          1HB       TYR  28 -31.950   8.434 -11.393
  232    HD1  TYR  28           HD1      TYR  28 -31.727   9.376  -7.938
  233    HD2  TYR  28           HD2      TYR  28 -34.377   9.301 -11.317
  234    HE1  TYR  28           HE1      TYR  28 -33.152  11.098  -6.860
  235    HE2  TYR  28           HE2      TYR  28 -35.801  11.021 -10.239
  236    HH   TYR  28           HH       TYR  28 -34.813  12.894  -7.701
  237    H    CYS  29           H        CYS  29 -31.820   4.688  -9.244
  238    HA   CYS  29           HA       CYS  29 -29.956   4.091 -11.430
  239   1HB   CYS  29          2HB       CYS  29 -29.566   3.755  -8.942
  240   2HB   CYS  29          1HB       CYS  29 -30.727   2.436  -9.014
  241    H    LYS  30           H        LYS  30 -30.759   3.087 -13.271
  242    HA   LYS  30           HA       LYS  30 -33.225   1.691 -13.477
  243   1HB   LYS  30          2HB       LYS  30 -31.660   2.464 -15.322
  244   2HB   LYS  30          1HB       LYS  30 -30.627   1.088 -14.932
  245   1HG   LYS  30          2HG       LYS  30 -33.453   0.364 -15.284
  246   2HG   LYS  30          1HG       LYS  30 -32.710   1.034 -16.738
  247   1HD   LYS  30          2HD       LYS  30 -31.115  -0.663 -16.872
  248   2HD   LYS  30          1HD       LYS  30 -31.236  -1.050 -15.154
  249   1HE   LYS  30          2HE       LYS  30 -33.656  -1.450 -16.894
  250   2HE   LYS  30          1HE       LYS  30 -32.359  -2.661 -16.923
  251   1HZ   LYS  30          1HZ       LYS  30 -33.908  -1.700 -14.587
  252   2HZ   LYS  30          2HZ       LYS  30 -32.425  -2.511 -14.412
  253   3HZ   LYS  30          3HZ       LYS  30 -33.743  -3.292 -15.148
  254    H    PHE  31           H        PHE  31 -30.197   0.866 -12.063
  255    HA   PHE  31           HA       PHE  31 -30.887  -2.015 -11.720
  256   1HB   PHE  31          2HB       PHE  31 -28.358  -0.393 -11.201
  257   2HB   PHE  31          1HB       PHE  31 -28.439  -2.159 -11.256
  258    HD1  PHE  31           HD1      PHE  31 -28.640   0.954 -13.224
  259    HD2  PHE  31           HD2      PHE  31 -28.717  -3.335 -13.363
  260    HE1  PHE  31           HE1      PHE  31 -28.406   1.033 -15.686
  261    HE2  PHE  31           HE2      PHE  31 -28.493  -3.261 -15.826
  262    HZ   PHE  31           HZ       PHE  31 -28.333  -1.076 -16.995
  263    H    ARG  32           H        ARG  32 -31.694   0.717 -10.210
  264    HA   ARG  32           HA       ARG  32 -30.772   0.792  -7.597
  265   1HB   ARG  32          2HB       ARG  32 -32.770   1.982  -7.131
  266   2HB   ARG  32          1HB       ARG  32 -32.528   2.221  -8.856
  267   1HG   ARG  32          2HG       ARG  32 -34.240  -0.033  -7.791
  268   2HG   ARG  32          1HG       ARG  32 -34.894   1.572  -8.096
  269   1HD   ARG  32          2HD       ARG  32 -34.272   1.449 -10.445
  270   2HD   ARG  32          1HD       ARG  32 -33.443  -0.098 -10.180
  271    HE   ARG  32           HE       ARG  32 -35.614  -1.124  -9.716
  272   1HH1  ARG  32          1HH2      ARG  32 -36.146   2.180  -9.566
  273   2HH1  ARG  32          2HH2      ARG  32 -37.603   2.171 -10.503
  274   1HH2  ARG  32          1HH1      ARG  32 -37.298  -1.157 -11.434
  275   2HH2  ARG  32          2HH1      ARG  32 -38.256   0.280 -11.558
  276    H    TYR  33           H        TYR  33 -32.973  -1.502  -9.044
  277    HA   TYR  33           HA       TYR  33 -33.033  -2.992  -6.439
  278   1HB   TYR  33          2HB       TYR  33 -35.143  -2.559  -8.570
  279   2HB   TYR  33          1HB       TYR  33 -35.312  -3.756  -7.285
  280    HD1  TYR  33           HD1      TYR  33 -36.731  -0.884  -8.008
  281    HD2  TYR  33           HD2      TYR  33 -34.025  -2.353  -5.011
  282    HE1  TYR  33           HE1      TYR  33 -37.487   0.892  -6.452
  283    HE2  TYR  33           HE2      TYR  33 -34.781  -0.577  -3.457
  284    HH   TYR  33           HH       TYR  33 -37.436   1.606  -4.312
  285    H    CYS  34           H        CYS  34 -31.697  -3.078  -9.440
  286    HA   CYS  34           HA       CYS  34 -32.224  -5.551 -10.623
  287   1HB   CYS  34          2HB       CYS  34 -30.550  -3.817 -11.367
  288   2HB   CYS  34          1HB       CYS  34 -29.505  -4.337 -10.045
  289    H    THR  35           H        THR  35 -30.818  -7.590 -10.361
  290    HA   THR  35           HA       THR  35 -29.972  -8.050  -7.535
  291    HB   THR  35           HB       THR  35 -31.287 -10.364  -8.146
  292    HG1  THR  35           HG1      THR  35 -33.102  -8.480  -9.066
  293   1HG2  THR  35          1HG2      THR  35 -31.590  -8.194  -6.401
  294   2HG2  THR  35          2HG2      THR  35 -32.426  -9.744  -6.307
  295   3HG2  THR  35          3HG2      THR  35 -33.171  -8.389  -7.156
  296    H    CYS  36           H        CYS  36 -29.121  -8.219 -10.744
  297    HA   CYS  36           HA       CYS  36 -28.063 -10.738 -11.261
  298   1HB   CYS  36          2HB       CYS  36 -26.519  -9.585 -12.693
  299   2HB   CYS  36          1HB       CYS  36 -27.987  -8.610 -12.649
  300    H    GLU  37           H        GLU  37 -25.650 -11.407 -10.963
  301    HA   GLU  37           HA       GLU  37 -25.019 -11.326  -8.120
  302   1HB   GLU  37          2HB       GLU  37 -24.444 -12.876 -10.429
  303   2HB   GLU  37          1HB       GLU  37 -22.895 -12.342  -9.776
  304   1HG   GLU  37          2HG       GLU  37 -23.070 -13.718  -7.998
  305   2HG   GLU  37          1HG       GLU  37 -24.721 -13.190  -7.668
  306    H    LYS  38           H        LYS  38 -24.476  -9.036 -10.460
  307    HA   LYS  38           HA       LYS  38 -21.779  -8.247  -9.421
  308   1HB   LYS  38          2HB       LYS  38 -23.481  -7.409 -11.798
  309   2HB   LYS  38          1HB       LYS  38 -21.925  -6.677 -11.408
  310   1HG   LYS  38          2HG       LYS  38 -21.027  -9.118 -11.415
  311   2HG   LYS  38          1HG       LYS  38 -22.507  -9.495 -12.298
  312   1HD   LYS  38          2HD       LYS  38 -21.534  -8.759 -14.188
  313   2HD   LYS  38          1HD       LYS  38 -21.426  -7.150 -13.475
  314   1HE   LYS  38          2HE       LYS  38 -19.171  -7.687 -14.000
  315   2HE   LYS  38          1HE       LYS  38 -19.296  -8.079 -12.274
  316   1HZ   LYS  38          1HZ       LYS  38 -20.193 -10.332 -13.301
  317   2HZ   LYS  38          2HZ       LYS  38 -18.538 -10.071 -13.017
  318   3HZ   LYS  38          3HZ       LYS  38 -19.177  -9.871 -14.579
  319    H    CYS  39           H        CYS  39 -25.123  -7.549  -9.267
  320    HA   CYS  39           HA       CYS  39 -24.785  -4.777  -8.308
  321   1HB   CYS  39          2HB       CYS  39 -26.911  -6.622  -9.232
  322   2HB   CYS  39          1HB       CYS  39 -27.398  -5.545  -7.937
  323    H    ARG  40           H        ARG  40 -25.611  -8.042  -7.192
  324    HA   ARG  40           HA       ARG  40 -26.058  -7.270  -4.421
  325   1HB   ARG  40          2HB       ARG  40 -25.822  -9.759  -6.066
  326   2HB   ARG  40          1HB       ARG  40 -25.622  -9.913  -4.320
  327   1HG   ARG  40          2HG       ARG  40 -27.796  -9.152  -3.872
  328   2HG   ARG  40          1HG       ARG  40 -27.951  -8.378  -5.449
  329   1HD   ARG  40          2HD       ARG  40 -28.982 -10.249  -6.204
  330   2HD   ARG  40          1HD       ARG  40 -27.469 -11.139  -5.943
  331    HE   ARG  40           HE       ARG  40 -29.780 -11.320  -4.254
  332   1HH1  ARG  40          1HH2      ARG  40 -27.236 -13.092  -4.429
  333   2HH1  ARG  40          2HH2      ARG  40 -26.663 -12.962  -2.800
  334   1HH2  ARG  40          1HH1      ARG  40 -28.667 -10.237  -2.030
  335   2HH2  ARG  40          2HH1      ARG  40 -27.473 -11.346  -1.441
  336    H    LEU  41           H        LEU  41 -23.418  -8.568  -6.363
  337    HA   LEU  41           HA       LEU  41 -21.508  -8.948  -4.247
  338   1HB   LEU  41          2HB       LEU  41 -20.926 -10.004  -6.237
  339   2HB   LEU  41          1HB       LEU  41 -21.565  -8.694  -7.224
  340    HG   LEU  41           HG       LEU  41 -19.643  -7.335  -6.850
  341   1HD1  LEU  41          1HD1      LEU  41 -18.454  -7.420  -4.933
  342   2HD1  LEU  41          2HD1      LEU  41 -18.005  -9.097  -5.241
  343   3HD1  LEU  41          3HD1      LEU  41 -19.505  -8.729  -4.390
  344   1HD2  LEU  41          1HD2      LEU  41 -18.654  -8.601  -8.430
  345   2HD2  LEU  41          2HD2      LEU  41 -19.380 -10.073  -7.781
  346   3HD2  LEU  41          3HD2      LEU  41 -17.854  -9.479  -7.126
  347    H    THR  42           H        THR  42 -22.619  -6.214  -6.091
  348    HA   THR  42           HA       THR  42 -20.491  -4.366  -5.420
  349    HB   THR  42           HB       THR  42 -23.329  -4.202  -6.418
  350    HG1  THR  42           HG1      THR  42 -20.741  -3.887  -7.490
  351   1HG2  THR  42          1HG2      THR  42 -23.221  -2.133  -5.347
  352   2HG2  THR  42          2HG2      THR  42 -22.570  -1.739  -6.938
  353   3HG2  THR  42          3HG2      THR  42 -21.478  -1.993  -5.578
  354    H    ALA  43           H        ALA  43 -23.892  -4.256  -4.429
  355    HA   ALA  43           HA       ALA  43 -23.748  -2.550  -2.248
  356   1HB   ALA  43          1HB       ALA  43 -25.727  -3.819  -3.305
  357   2HB   ALA  43          2HB       ALA  43 -25.788  -3.608  -1.554
  358   3HB   ALA  43          3HB       ALA  43 -25.296  -5.156  -2.239
  359    H    ASP  44           H        ASP  44 -22.794  -5.928  -2.452
  360    HA   ASP  44           HA       ASP  44 -22.265  -6.338   0.365
  361   1HB   ASP  44          2HB       ASP  44 -22.635  -7.942  -1.698
  362   2HB   ASP  44          1HB       ASP  44 -20.892  -7.762  -1.905
  363    H    ARG  45           H        ARG  45 -20.348  -5.318  -2.439
  364    HA   ARG  45           HA       ARG  45 -17.759  -5.325  -1.237
  365   1HB   ARG  45          2HB       ARG  45 -18.841  -4.875  -3.688
  366   2HB   ARG  45          1HB       ARG  45 -18.487  -3.217  -3.204
  367   1HG   ARG  45          2HG       ARG  45 -16.527  -5.525  -3.313
  368   2HG   ARG  45          1HG       ARG  45 -16.551  -4.110  -4.366
  369   1HD   ARG  45          2HD       ARG  45 -15.843  -2.660  -2.637
  370   2HD   ARG  45          1HD       ARG  45 -16.293  -3.816  -1.368
  371    HE   ARG  45           HE       ARG  45 -14.088  -4.389  -3.314
  372   1HH1  ARG  45          1HH2      ARG  45 -15.414  -6.192  -1.069
  373   2HH1  ARG  45          2HH2      ARG  45 -14.124  -6.180   0.086
  374   1HH2  ARG  45          1HH1      ARG  45 -12.432  -3.564  -1.443
  375   2HH2  ARG  45          2HH1      ARG  45 -12.434  -4.688  -0.125
  376    H    GLN  46           H        GLN  46 -19.939  -2.525  -1.797
  377    HA   GLN  46           HA       GLN  46 -18.598  -1.146   0.505
  378   1HB   GLN  46          2HB       GLN  46 -19.583  -0.367  -2.188
  379   2HB   GLN  46          1HB       GLN  46 -19.862   0.807  -0.900
  380   1HG   GLN  46          2HG       GLN  46 -17.562   1.034  -0.442
  381   2HG   GLN  46          1HG       GLN  46 -17.158  -0.475  -1.260
  382   1HE2  GLN  46          1HE2      GLN  46 -18.470   2.807  -1.959
  383   2HE2  GLN  46          2HE2      GLN  46 -17.836   2.886  -3.531
  384    H    ARG  47           H        ARG  47 -20.491  -2.833   1.401
  385    HA   ARG  47           HA       ARG  47 -23.216  -2.059   1.314
  386   1HB   ARG  47          2HB       ARG  47 -23.337  -3.353   3.421
  387   2HB   ARG  47          1HB       ARG  47 -22.306  -4.164   2.242
  388   1HG   ARG  47          2HG       ARG  47 -20.320  -3.060   3.321
  389   2HG   ARG  47          1HG       ARG  47 -21.404  -2.463   4.580
  390   1HD   ARG  47          2HD       ARG  47 -22.036  -5.167   4.447
  391   2HD   ARG  47          1HD       ARG  47 -20.272  -5.141   4.247
  392    HE   ARG  47           HE       ARG  47 -21.664  -3.720   6.488
  393   1HH1  ARG  47          1HH2      ARG  47 -18.705  -3.275   5.734
  394   2HH1  ARG  47          2HH2      ARG  47 -17.927  -4.281   6.910
  395   1HH2  ARG  47          1HH1      ARG  47 -20.825  -5.991   7.752
  396   2HH2  ARG  47          2HH1      ARG  47 -19.127  -5.819   8.052
  397    H    VAL  48           H        VAL  48 -24.458  -0.707   2.714
  398    HA   VAL  48           HA       VAL  48 -22.884   1.197   4.417
  399    HB   VAL  48           HB       VAL  48 -25.274   1.833   2.661
  400   1HG1  VAL  48          1HG1      VAL  48 -25.103   3.472   4.357
  401   2HG1  VAL  48          2HG1      VAL  48 -24.243   4.181   2.991
  402   3HG1  VAL  48          3HG1      VAL  48 -23.341   3.452   4.318
  403   1HG2  VAL  48          1HG2      VAL  48 -22.300   1.993   2.139
  404   2HG2  VAL  48          2HG2      VAL  48 -23.452   3.005   1.266
  405   3HG2  VAL  48          3HG2      VAL  48 -23.546   1.250   1.135
  406    H    MET  49           H        MET  49 -24.504   2.426   5.915
  407    HA   MET  49           HA       MET  49 -26.374   0.406   7.077
  408   1HB   MET  49          2HB       MET  49 -24.678   2.663   8.066
  409   2HB   MET  49          1HB       MET  49 -26.128   2.259   8.984
  410   1HG   MET  49          2HG       MET  49 -24.185   1.003   9.832
  411   2HG   MET  49          1HG       MET  49 -25.380  -0.091   9.134
  412   1HE   MET  49          1HE       MET  49 -22.055  -0.813   9.522
  413   2HE   MET  49          2HE       MET  49 -22.079   0.949   9.540
  414   3HE   MET  49          3HE       MET  49 -21.098   0.101   8.347
  415    H    ALA  50           H        ALA  50 -26.855   2.437   4.783
  416    HA   ALA  50           HA       ALA  50 -29.185   3.861   6.029
  417   1HB   ALA  50          1HB       ALA  50 -27.427   4.491   3.637
  418   2HB   ALA  50          2HB       ALA  50 -27.460   5.352   5.176
  419   3HB   ALA  50          3HB       ALA  50 -28.847   5.433   4.090
  420    H    LEU  51           H        LEU  51 -30.538   1.935   5.671
  421    HA   LEU  51           HA       LEU  51 -31.123   1.379   2.784
  422   1HB   LEU  51          2HB       LEU  51 -31.947  -0.781   3.640
  423   2HB   LEU  51          1HB       LEU  51 -30.299  -0.493   4.197
  424    HG   LEU  51           HG       LEU  51 -32.033   0.702   6.102
  425   1HD1  LEU  51          1HD1      LEU  51 -32.743  -2.177   6.053
  426   2HD1  LEU  51          2HD1      LEU  51 -33.522  -1.181   4.823
  427   3HD1  LEU  51          3HD1      LEU  51 -33.716  -0.785   6.530
  428   1HD2  LEU  51          1HD2      LEU  51 -29.858  -1.190   5.927
  429   2HD2  LEU  51          2HD2      LEU  51 -31.058  -1.770   7.081
  430   3HD2  LEU  51          3HD2      LEU  51 -30.332  -0.177   7.291
  431    H    GLN  52           H        GLN  52 -33.308   1.480   2.099
  432    HA   GLN  52           HA       GLN  52 -35.266   2.544   4.108
  433   1HB   GLN  52          2HB       GLN  52 -34.359   3.506   1.431
  434   2HB   GLN  52          1HB       GLN  52 -36.064   3.724   1.832
  435   1HG   GLN  52          2HG       GLN  52 -35.489   5.538   3.033
  436   2HG   GLN  52          1HG       GLN  52 -34.632   4.469   4.144
  437   1HE2  GLN  52          1HE2      GLN  52 -32.413   4.827   4.305
  438   2HE2  GLN  52          2HE2      GLN  52 -31.477   5.652   3.154
  Start of MODEL    3
    1   1H    SER   1          1H        SER   1  -7.241   6.420  -5.876
    2   2H    SER   1          2H        SER   1  -8.541   7.230  -5.141
    3   3H    SER   1          3H        SER   1  -6.983   7.336  -4.472
    4    HA   SER   1           HA       SER   1  -6.815   9.265  -5.590
    5   1HB   SER   1          2HB       SER   1  -5.657   7.205  -6.854
    6   2HB   SER   1          1HB       SER   1  -6.779   7.678  -8.126
    7    HG   SER   1           HG       SER   1  -4.850   9.302  -6.817
    8    H    ILE   2           H        ILE   2  -8.617   7.388  -8.051
    9    HA   ILE   2           HA       ILE   2 -10.315   9.709  -8.650
   10    HB   ILE   2           HB       ILE   2  -9.389   8.092 -10.327
   11   1HG1  ILE   2          2HG1      ILE   2 -11.935   7.510 -11.161
   12   2HG1  ILE   2          1HG1      ILE   2 -12.234   8.828 -10.028
   13   1HG2  ILE   2          1HG2      ILE   2 -10.632   6.220  -8.498
   14   2HG2  ILE   2          2HG2      ILE   2  -9.514   5.901  -9.823
   15   3HG2  ILE   2          3HG2      ILE   2 -11.248   5.987 -10.133
   16   1HD1  ILE   2          1HD1      ILE   2 -10.373   8.865 -12.420
   17   2HD1  ILE   2          2HD1      ILE   2 -10.436  10.145 -11.207
   18   3HD1  ILE   2          3HD1      ILE   2 -11.850   9.806 -12.206
   19    H    SER   3           H        SER   3 -11.045   9.531  -6.198
   20    HA   SER   3           HA       SER   3 -13.724   8.323  -6.204
   21   1HB   SER   3          2HB       SER   3 -11.381   7.033  -5.043
   22   2HB   SER   3          1HB       SER   3 -12.633   7.309  -3.834
   23    HG   SER   3           HG       SER   3 -14.055   6.437  -5.638
   24    HA   PRO   4           HA       PRO   4 -13.209  10.790  -2.154
   25   1HB   PRO   4          2HB       PRO   4 -10.699  11.606  -1.420
   26   2HB   PRO   4          1HB       PRO   4 -11.389  10.042  -0.939
   27   1HG   PRO   4          2HG       PRO   4  -9.462  10.669  -3.122
   28   2HG   PRO   4          1HG       PRO   4  -9.490   9.298  -2.000
   29   1HD   PRO   4          2HD       PRO   4 -10.348   9.122  -4.566
   30   2HD   PRO   4          1HD       PRO   4 -11.021   8.134  -3.252
   31    H    ARG   5           H        ARG   5 -10.958  11.650  -4.752
   32    HA   ARG   5           HA       ARG   5 -11.661  14.534  -4.417
   33   1HB   ARG   5          2HB       ARG   5  -9.663  14.928  -5.705
   34   2HB   ARG   5          1HB       ARG   5  -9.268  13.667  -4.538
   35   1HG   ARG   5          2HG       ARG   5  -8.747  12.245  -6.200
   36   2HG   ARG   5          1HG       ARG   5 -10.348  12.447  -6.911
   37   1HD   ARG   5          2HD       ARG   5  -9.638  14.136  -8.362
   38   2HD   ARG   5          1HD       ARG   5  -8.284  14.602  -7.313
   39    HE   ARG   5           HE       ARG   5  -8.314  12.302  -9.173
   40   1HH1  ARG   5          1HH2      ARG   5  -6.104  14.370  -8.911
   41   2HH1  ARG   5          2HH2      ARG   5  -4.885  13.461  -8.081
   42   1HH2  ARG   5          1HH1      ARG   5  -7.060  10.953  -7.082
   43   2HH2  ARG   5          2HH1      ARG   5  -5.426  11.528  -7.045
   44    H    THR   6           H        THR   6 -13.058  12.031  -5.868
   45    HA   THR   6           HA       THR   6 -13.963  13.659  -8.201
   46    HB   THR   6           HB       THR   6 -13.796  11.390  -9.474
   47    HG1  THR   6           HG1      THR   6 -13.336  10.172  -7.596
   48   1HG2  THR   6          1HG2      THR   6 -12.231  12.726 -10.410
   49   2HG2  THR   6          2HG2      THR   6 -11.075  11.902  -9.363
   50   3HG2  THR   6          3HG2      THR   6 -11.790  13.431  -8.855
   51    HA   PRO   7           HA       PRO   7 -17.895  12.117  -6.973
   52   1HB   PRO   7          2HB       PRO   7 -19.239  12.229  -9.353
   53   2HB   PRO   7          1HB       PRO   7 -18.816  13.674  -8.414
   54   1HG   PRO   7          2HG       PRO   7 -17.503  12.531 -10.825
   55   2HG   PRO   7          1HG       PRO   7 -17.763  14.223 -10.373
   56   1HD   PRO   7          2HD       PRO   7 -15.373  12.916 -10.093
   57   2HD   PRO   7          1HD       PRO   7 -15.865  14.310  -9.108
   58    HA   PRO   8           HA       PRO   8 -17.324   7.834  -8.197
   59   1HB   PRO   8          2HB       PRO   8 -18.706   6.775  -6.092
   60   2HB   PRO   8          1HB       PRO   8 -17.033   7.352  -5.956
   61   1HG   PRO   8          2HG       PRO   8 -19.551   8.627  -5.062
   62   2HG   PRO   8          1HG       PRO   8 -17.931   8.703  -4.358
   63   1HD   PRO   8          2HD       PRO   8 -19.111  10.686  -5.904
   64   2HD   PRO   8          1HD       PRO   8 -17.372  10.531  -5.574
   65    H    ASN   9           H        ASN   9 -18.623   7.188  -9.886
   66    HA   ASN   9           HA       ASN   9 -21.420   7.812 -10.183
   67   1HB   ASN   9          2HB       ASN   9 -21.232   6.418 -12.116
   68   2HB   ASN   9          1HB       ASN   9 -19.645   7.166 -11.923
   69   1HD2  ASN   9          1HD2      ASN   9 -21.419   4.121 -11.680
   70   2HD2  ASN   9          2HD2      ASN   9 -20.056   3.136 -11.449
   71    H    CYS  10           H        CYS  10 -23.154   6.177 -10.220
   72    HA   CYS  10           HA       CYS  10 -23.349   4.698  -7.768
   73   1HB   CYS  10          2HB       CYS  10 -25.277   5.627  -8.979
   74   2HB   CYS  10          1HB       CYS  10 -24.909   4.645 -10.360
   75    H    ALA  11           H        ALA  11 -22.953   2.504  -7.380
   76    HA   ALA  11           HA       ALA  11 -21.504   1.029  -9.470
   77   1HB   ALA  11          1HB       ALA  11 -22.213  -0.288  -6.929
   78   2HB   ALA  11          2HB       ALA  11 -21.307   1.215  -6.759
   79   3HB   ALA  11          3HB       ALA  11 -20.638  -0.116  -7.704
   80    H    ARG  12           H        ARG  12 -24.609   0.848  -7.788
   81    HA   ARG  12           HA       ARG  12 -25.508  -1.703  -8.485
   82   1HB   ARG  12          2HB       ARG  12 -26.629   0.145  -7.174
   83   2HB   ARG  12          1HB       ARG  12 -27.012   0.926  -8.700
   84   1HG   ARG  12          2HG       ARG  12 -28.857  -0.310  -8.796
   85   2HG   ARG  12          1HG       ARG  12 -27.838  -1.730  -9.016
   86   1HD   ARG  12          2HD       ARG  12 -28.054  -0.826  -6.208
   87   2HD   ARG  12          1HD       ARG  12 -29.575  -1.414  -6.910
   88    HE   ARG  12           HE       ARG  12 -27.384  -3.152  -7.629
   89   1HH1  ARG  12          1HH2      ARG  12 -30.298  -3.126  -6.097
   90   2HH1  ARG  12          2HH2      ARG  12 -29.898  -4.279  -4.868
   91   1HH2  ARG  12          1HH1      ARG  12 -26.506  -4.269  -5.590
   92   2HH2  ARG  12          2HH1      ARG  12 -27.751  -4.928  -4.582
   93    H    CYS  13           H        CYS  13 -25.688   1.250 -10.411
   94    HA   CYS  13           HA       CYS  13 -26.594  -0.265 -12.768
   95   1HB   CYS  13          2HB       CYS  13 -26.683   2.033 -13.742
   96   2HB   CYS  13          1HB       CYS  13 -27.449   1.977 -12.173
   97    H    ARG  14           H        ARG  14 -23.514   0.646 -11.430
   98    HA   ARG  14           HA       ARG  14 -21.956   0.873 -13.837
   99   1HB   ARG  14          2HB       ARG  14 -20.447   1.320 -12.214
  100   2HB   ARG  14          1HB       ARG  14 -21.666   0.888 -11.037
  101   1HG   ARG  14          2HG       ARG  14 -20.053  -1.322 -12.294
  102   2HG   ARG  14          1HG       ARG  14 -19.315  -0.341 -11.044
  103   1HD   ARG  14          2HD       ARG  14 -21.254  -0.899  -9.551
  104   2HD   ARG  14          1HD       ARG  14 -21.802  -2.040 -10.783
  105    HE   ARG  14           HE       ARG  14 -20.101  -3.467 -10.001
  106   1HH1  ARG  14          1HH2      ARG  14 -17.883  -1.963 -11.205
  107   2HH1  ARG  14          2HH2      ARG  14 -16.922  -1.509  -9.838
  108   1HH2  ARG  14          1HH1      ARG  14 -19.443  -2.104  -7.533
  109   2HH2  ARG  14          2HH1      ARG  14 -17.806  -1.585  -7.760
  110    H    ASN  15           H        ASN  15 -23.128  -1.837 -12.015
  111    HA   ASN  15           HA       ASN  15 -21.496  -3.936 -12.866
  112   1HB   ASN  15          2HB       ASN  15 -24.419  -3.647 -12.195
  113   2HB   ASN  15          1HB       ASN  15 -23.658  -5.220 -12.389
  114   1HD2  ASN  15          1HD2      ASN  15 -24.259  -2.706 -10.228
  115   2HD2  ASN  15          2HD2      ASN  15 -23.066  -3.017  -9.075
  116    H    HIS  16           H        HIS  16 -24.201  -2.419 -14.475
  117    HA   HIS  16           HA       HIS  16 -24.052  -4.328 -16.735
  118   1HB   HIS  16          2HB       HIS  16 -25.907  -2.043 -16.014
  119   2HB   HIS  16          1HB       HIS  16 -26.174  -3.210 -17.290
  120    HD1  HIS  16           HD1      HIS  16 -27.279  -5.379 -16.670
  121    HD2  HIS  16           HD2      HIS  16 -25.674  -3.366 -13.399
  122    HE1  HIS  16           HE1      HIS  16 -27.943  -6.717 -14.606
  123    H    GLY  17           H        GLY  17 -22.736  -1.309 -15.874
  124   1HA   GLY  17          2HA       GLY  17 -21.061  -0.348 -17.419
  125   2HA   GLY  17          1HA       GLY  17 -22.127  -0.782 -18.755
  126    H    LEU  18           H        LEU  18 -23.334   0.614 -15.788
  127    HA   LEU  18           HA       LEU  18 -24.284   2.961 -17.353
  128   1HB   LEU  18          2HB       LEU  18 -25.473   1.211 -15.605
  129   2HB   LEU  18          1HB       LEU  18 -25.083   2.559 -14.537
  130    HG   LEU  18           HG       LEU  18 -27.312   2.877 -15.488
  131   1HD1  LEU  18          1HD1      LEU  18 -25.757   4.822 -17.094
  132   2HD1  LEU  18          2HD1      LEU  18 -25.347   4.731 -15.383
  133   3HD1  LEU  18          3HD1      LEU  18 -26.998   5.106 -15.874
  134   1HD2  LEU  18          1HD2      LEU  18 -26.056   3.060 -18.224
  135   2HD2  LEU  18          2HD2      LEU  18 -27.756   2.859 -17.805
  136   3HD2  LEU  18          3HD2      LEU  18 -26.634   1.514 -17.602
  137    H    LYS  19           H        LYS  19 -23.908   5.105 -16.532
  138    HA   LYS  19           HA       LYS  19 -22.014   5.437 -14.278
  139   1HB   LYS  19          2HB       LYS  19 -21.572   6.291 -17.157
  140   2HB   LYS  19          1HB       LYS  19 -20.596   6.876 -15.809
  141   1HG   LYS  19          2HG       LYS  19 -20.932   3.968 -16.608
  142   2HG   LYS  19          1HG       LYS  19 -19.505   4.960 -16.913
  143   1HD   LYS  19          2HD       LYS  19 -20.161   5.185 -14.137
  144   2HD   LYS  19          1HD       LYS  19 -20.135   3.472 -14.560
  145   1HE   LYS  19          2HE       LYS  19 -17.918   5.281 -15.511
  146   2HE   LYS  19          1HE       LYS  19 -17.878   4.598 -13.873
  147   1HZ   LYS  19          1HZ       LYS  19 -16.906   2.928 -15.117
  148   2HZ   LYS  19          2HZ       LYS  19 -17.903   3.195 -16.466
  149   3HZ   LYS  19          3HZ       LYS  19 -18.527   2.428 -15.085
  150    H    ILE  20           H        ILE  20 -23.842   6.438 -13.285
  151    HA   ILE  20           HA       ILE  20 -24.915   8.899 -14.566
  152    HB   ILE  20           HB       ILE  20 -26.864   8.302 -13.545
  153   1HG1  ILE  20          2HG1      ILE  20 -25.657   8.911 -11.291
  154   2HG1  ILE  20          1HG1      ILE  20 -27.203   8.112 -11.332
  155   1HG2  ILE  20          1HG2      ILE  20 -26.062   6.178 -14.490
  156   2HG2  ILE  20          2HG2      ILE  20 -27.179   5.972 -13.144
  157   3HG2  ILE  20          3HG2      ILE  20 -25.452   5.741 -12.898
  158   1HD1  ILE  20          1HD1      ILE  20 -24.567   6.697 -11.184
  159   2HD1  ILE  20          2HD1      ILE  20 -26.157   5.945 -11.123
  160   3HD1  ILE  20          3HD1      ILE  20 -25.629   7.002  -9.823
  161    H    THR  21           H        THR  21 -22.504   8.063 -12.383
  162    HA   THR  21           HA       THR  21 -21.119   9.502 -11.059
  163    HB   THR  21           HB       THR  21 -23.197  11.653 -11.298
  164    HG1  THR  21           HG1      THR  21 -22.938  11.796 -13.374
  165   1HG2  THR  21          1HG2      THR  21 -21.396  12.555 -10.199
  166   2HG2  THR  21          2HG2      THR  21 -20.818  12.792 -11.849
  167   3HG2  THR  21          3HG2      THR  21 -20.259  11.409 -10.909
  168    H    LEU  22           H        LEU  22 -24.120   8.392 -10.438
  169    HA   LEU  22           HA       LEU  22 -25.479   8.094  -8.518
  170   1HB   LEU  22          2HB       LEU  22 -23.437   6.895  -7.943
  171   2HB   LEU  22          1HB       LEU  22 -22.693   8.381  -7.359
  172    HG   LEU  22           HG       LEU  22 -25.248   8.042  -6.083
  173   1HD1  LEU  22          1HD1      LEU  22 -24.938   5.645  -6.576
  174   2HD1  LEU  22          2HD1      LEU  22 -24.777   5.959  -4.848
  175   3HD1  LEU  22          3HD1      LEU  22 -23.338   5.698  -5.835
  176   1HD2  LEU  22          1HD2      LEU  22 -22.777   7.551  -4.542
  177   2HD2  LEU  22          2HD2      LEU  22 -24.033   8.764  -4.294
  178   3HD2  LEU  22          3HD2      LEU  22 -22.763   9.040  -5.485
  179    H    LYS  23           H        LYS  23 -24.812  10.980  -9.424
  180    HA   LYS  23           HA       LYS  23 -24.874  12.508  -6.916
  181   1HB   LYS  23          2HB       LYS  23 -24.110  12.984  -9.508
  182   2HB   LYS  23          1HB       LYS  23 -25.698  13.752  -9.478
  183   1HG   LYS  23          2HG       LYS  23 -24.993  15.426  -8.118
  184   2HG   LYS  23          1HG       LYS  23 -24.053  14.328  -7.106
  185   1HD   LYS  23          2HD       LYS  23 -22.528  14.224  -9.301
  186   2HD   LYS  23          1HD       LYS  23 -23.231  15.823  -9.556
  187   1HE   LYS  23          2HE       LYS  23 -21.137  16.022  -8.268
  188   2HE   LYS  23          1HE       LYS  23 -22.513  16.456  -7.235
  189   1HZ   LYS  23          1HZ       LYS  23 -22.431  14.478  -6.117
  190   2HZ   LYS  23          2HZ       LYS  23 -20.777  14.683  -6.445
  191   3HZ   LYS  23          3HZ       LYS  23 -21.712  13.640  -7.404
  192    H    GLY  24           H        GLY  24 -26.815  12.276  -5.740
  193   1HA   GLY  24          2HA       GLY  24 -29.146  12.124  -5.356
  194   2HA   GLY  24          1HA       GLY  24 -29.280  13.314  -6.663
  195    H    HIS  25           H        HIS  25 -28.413   9.874  -6.330
  196    HA   HIS  25           HA       HIS  25 -30.056   9.305  -8.773
  197   1HB   HIS  25          2HB       HIS  25 -27.666   9.294  -9.162
  198   2HB   HIS  25          1HB       HIS  25 -27.402   8.262  -7.762
  199    HD1  HIS  25           HD1      HIS  25 -29.441   8.066 -10.999
  200    HD2  HIS  25           HD2      HIS  25 -27.042   5.673  -8.587
  201    HE1  HIS  25           HE1      HIS  25 -29.049   5.897 -12.242
  202    H    LYS  26           H        LYS  26 -28.448   6.689  -7.213
  203    HA   LYS  26           HA       LYS  26 -29.376   4.729  -6.284
  204   1HB   LYS  26          2HB       LYS  26 -30.416   7.085  -4.702
  205   2HB   LYS  26          1HB       LYS  26 -30.759   5.429  -4.199
  206   1HG   LYS  26          2HG       LYS  26 -28.721   5.298  -3.257
  207   2HG   LYS  26          1HG       LYS  26 -27.982   5.581  -4.833
  208   1HD   LYS  26          2HD       LYS  26 -28.214   8.023  -4.496
  209   2HD   LYS  26          1HD       LYS  26 -28.917   7.727  -2.904
  210   1HE   LYS  26          2HE       LYS  26 -26.397   6.286  -3.249
  211   2HE   LYS  26          1HE       LYS  26 -26.197   8.040  -3.434
  212   1HZ   LYS  26          1HZ       LYS  26 -27.160   8.452  -1.373
  213   2HZ   LYS  26          2HZ       LYS  26 -26.196   7.087  -1.068
  214   3HZ   LYS  26          3HZ       LYS  26 -27.873   6.917  -1.276
  215    H    ARG  27           H        ARG  27 -32.276   6.475  -5.399
  216    HA   ARG  27           HA       ARG  27 -34.127   4.653  -6.438
  217   1HB   ARG  27          2HB       ARG  27 -34.539   6.598  -4.912
  218   2HB   ARG  27          1HB       ARG  27 -34.369   7.679  -6.296
  219   1HG   ARG  27          2HG       ARG  27 -36.206   6.169  -7.382
  220   2HG   ARG  27          1HG       ARG  27 -36.541   5.678  -5.720
  221   1HD   ARG  27          2HD       ARG  27 -36.372   8.418  -5.468
  222   2HD   ARG  27          1HD       ARG  27 -37.133   8.234  -7.061
  223    HE   ARG  27           HE       ARG  27 -38.878   6.860  -5.999
  224   1HH1  ARG  27          1HH2      ARG  27 -37.636   9.404  -4.264
  225   2HH1  ARG  27          2HH2      ARG  27 -38.198   8.875  -2.714
  226   1HH2  ARG  27          1HH1      ARG  27 -39.184   5.749  -3.842
  227   2HH2  ARG  27          2HH1      ARG  27 -39.076   6.808  -2.476
  228    H    TYR  28           H        TYR  28 -32.237   7.061  -8.115
  229    HA   TYR  28           HA       TYR  28 -33.836   6.926 -10.595
  230   1HB   TYR  28          2HB       TYR  28 -31.275   8.281  -9.706
  231   2HB   TYR  28          1HB       TYR  28 -31.918   8.439 -11.343
  232    HD1  TYR  28           HD1      TYR  28 -32.918   8.833  -7.754
  233    HD2  TYR  28           HD2      TYR  28 -33.534  10.067 -11.821
  234    HE1  TYR  28           HE1      TYR  28 -34.482  10.596  -6.981
  235    HE2  TYR  28           HE2      TYR  28 -35.099  11.830 -11.049
  236    HH   TYR  28           HH       TYR  28 -36.411  11.897  -7.962
  237    H    CYS  29           H        CYS  29 -31.886   4.759  -9.191
  238    HA   CYS  29           HA       CYS  29 -30.033   4.170 -11.386
  239   1HB   CYS  29          2HB       CYS  29 -29.681   3.819  -8.880
  240   2HB   CYS  29          1HB       CYS  29 -30.809   2.474  -9.004
  241    H    LYS  30           H        LYS  30 -30.663   3.010 -13.181
  242    HA   LYS  30           HA       LYS  30 -33.207   1.723 -13.463
  243   1HB   LYS  30          2HB       LYS  30 -31.148   2.409 -15.094
  244   2HB   LYS  30          1HB       LYS  30 -30.829   0.681 -14.934
  245   1HG   LYS  30          2HG       LYS  30 -33.553   0.729 -15.338
  246   2HG   LYS  30          1HG       LYS  30 -33.000   2.057 -16.361
  247   1HD   LYS  30          2HD       LYS  30 -31.131   0.030 -16.804
  248   2HD   LYS  30          1HD       LYS  30 -32.679  -0.814 -16.738
  249   1HE   LYS  30          2HE       LYS  30 -32.534  -0.180 -19.008
  250   2HE   LYS  30          1HE       LYS  30 -33.497   1.139 -18.309
  251   1HZ   LYS  30          1HZ       LYS  30 -31.691   2.543 -18.227
  252   2HZ   LYS  30          2HZ       LYS  30 -31.371   1.698 -19.667
  253   3HZ   LYS  30          3HZ       LYS  30 -30.558   1.280 -18.234
  254    H    PHE  31           H        PHE  31 -30.315   0.878 -11.838
  255    HA   PHE  31           HA       PHE  31 -31.075  -1.997 -11.550
  256   1HB   PHE  31          2HB       PHE  31 -28.502  -0.490 -10.941
  257   2HB   PHE  31          1HB       PHE  31 -28.670  -2.245 -11.046
  258    HD1  PHE  31           HD1      PHE  31 -28.818   0.925 -12.956
  259    HD2  PHE  31           HD2      PHE  31 -28.768  -3.360 -13.181
  260    HE1  PHE  31           HE1      PHE  31 -28.509   1.063 -15.405
  261    HE2  PHE  31           HE2      PHE  31 -28.456  -3.225 -15.633
  262    HZ   PHE  31           HZ       PHE  31 -28.321  -1.014 -16.752
  263    H    ARG  32           H        ARG  32 -31.722   0.815 -10.072
  264    HA   ARG  32           HA       ARG  32 -30.931   0.909  -7.452
  265   1HB   ARG  32          2HB       ARG  32 -32.909   2.131  -7.100
  266   2HB   ARG  32          1HB       ARG  32 -32.704   2.235  -8.842
  267   1HG   ARG  32          2HG       ARG  32 -34.397   0.099  -7.522
  268   2HG   ARG  32          1HG       ARG  32 -35.051   1.647  -8.040
  269   1HD   ARG  32          2HD       ARG  32 -33.469   0.387 -10.155
  270   2HD   ARG  32          1HD       ARG  32 -34.831  -0.620  -9.643
  271    HE   ARG  32           HE       ARG  32 -35.870   1.964  -9.796
  272   1HH1  ARG  32          1HH2      ARG  32 -35.138  -0.707 -11.736
  273   2HH1  ARG  32          2HH2      ARG  32 -35.497   0.076 -13.238
  274   1HH2  ARG  32          1HH1      ARG  32 -35.954   3.200 -11.807
  275   2HH2  ARG  32          2HH1      ARG  32 -35.962   2.286 -13.278
  276    H    TYR  33           H        TYR  33 -32.973  -1.489  -8.932
  277    HA   TYR  33           HA       TYR  33 -33.094  -2.943  -6.303
  278   1HB   TYR  33          2HB       TYR  33 -35.167  -2.574  -8.480
  279   2HB   TYR  33          1HB       TYR  33 -35.333  -3.774  -7.198
  280    HD1  TYR  33           HD1      TYR  33 -36.837  -0.977  -7.959
  281    HD2  TYR  33           HD2      TYR  33 -34.125  -2.303  -4.901
  282    HE1  TYR  33           HE1      TYR  33 -37.696   0.778  -6.432
  283    HE2  TYR  33           HE2      TYR  33 -34.983  -0.549  -3.377
  284    HH   TYR  33           HH       TYR  33 -36.123   1.645  -3.555
  285    H    CYS  34           H        CYS  34 -31.662  -3.033  -9.238
  286    HA   CYS  34           HA       CYS  34 -32.130  -5.480 -10.478
  287   1HB   CYS  34          2HB       CYS  34 -30.433  -3.695 -11.074
  288   2HB   CYS  34          1HB       CYS  34 -29.417  -4.325  -9.778
  289    H    THR  35           H        THR  35 -30.752  -7.513 -10.245
  290    HA   THR  35           HA       THR  35 -29.903  -8.079  -7.447
  291    HB   THR  35           HB       THR  35 -31.299 -10.200  -7.613
  292    HG1  THR  35           HG1      THR  35 -31.474  -9.687 -10.031
  293   1HG2  THR  35          1HG2      THR  35 -32.943  -9.107  -6.505
  294   2HG2  THR  35          2HG2      THR  35 -33.306  -8.074  -7.888
  295   3HG2  THR  35          3HG2      THR  35 -31.982  -7.658  -6.798
  296    H    CYS  36           H        CYS  36 -29.076  -8.139 -10.642
  297    HA   CYS  36           HA       CYS  36 -28.143 -10.696 -11.268
  298   1HB   CYS  36          2HB       CYS  36 -26.612  -9.560 -12.720
  299   2HB   CYS  36          1HB       CYS  36 -28.038  -8.532 -12.598
  300    H    GLU  37           H        GLU  37 -25.655 -11.336 -11.111
  301    HA   GLU  37           HA       GLU  37 -25.000 -11.402  -8.255
  302   1HB   GLU  37          2HB       GLU  37 -24.820 -13.288  -9.937
  303   2HB   GLU  37          1HB       GLU  37 -23.442 -12.439 -10.640
  304   1HG   GLU  37          2HG       GLU  37 -22.430 -12.435  -8.288
  305   2HG   GLU  37          1HG       GLU  37 -23.688 -13.593  -7.857
  306    H    LYS  38           H        LYS  38 -24.407  -9.041 -10.492
  307    HA   LYS  38           HA       LYS  38 -21.648  -8.450  -9.482
  308   1HB   LYS  38          2HB       LYS  38 -23.296  -7.324 -11.781
  309   2HB   LYS  38          1HB       LYS  38 -21.619  -6.902 -11.429
  310   1HG   LYS  38          2HG       LYS  38 -21.485  -9.637 -11.483
  311   2HG   LYS  38          1HG       LYS  38 -22.717  -9.324 -12.707
  312   1HD   LYS  38          2HD       LYS  38 -21.221  -7.790 -13.877
  313   2HD   LYS  38          1HD       LYS  38 -20.001  -7.981 -12.617
  314   1HE   LYS  38          2HE       LYS  38 -19.258  -9.501 -14.256
  315   2HE   LYS  38          1HE       LYS  38 -20.226 -10.552 -13.203
  316   1HZ   LYS  38          1HZ       LYS  38 -20.702 -10.423 -15.771
  317   2HZ   LYS  38          2HZ       LYS  38 -21.600  -9.055 -15.315
  318   3HZ   LYS  38          3HZ       LYS  38 -21.968 -10.576 -14.654
  319    H    CYS  39           H        CYS  39 -24.949  -7.526  -9.359
  320    HA   CYS  39           HA       CYS  39 -24.478  -4.829  -8.262
  321   1HB   CYS  39          2HB       CYS  39 -26.715  -6.584  -9.161
  322   2HB   CYS  39          1HB       CYS  39 -27.105  -5.461  -7.873
  323    H    ARG  40           H        ARG  40 -25.469  -8.101  -7.298
  324    HA   ARG  40           HA       ARG  40 -25.840  -7.484  -4.479
  325   1HB   ARG  40          2HB       ARG  40 -26.007  -9.736  -6.349
  326   2HB   ARG  40          1HB       ARG  40 -25.347 -10.216  -4.786
  327   1HG   ARG  40          2HG       ARG  40 -27.272  -9.375  -3.621
  328   2HG   ARG  40          1HG       ARG  40 -27.880  -8.586  -5.079
  329   1HD   ARG  40          2HD       ARG  40 -29.161 -10.545  -5.081
  330   2HD   ARG  40          1HD       ARG  40 -27.769 -11.071  -6.050
  331    HE   ARG  40           HE       ARG  40 -26.819 -12.081  -4.005
  332   1HH1  ARG  40          1HH2      ARG  40 -29.619 -13.252  -4.430
  333   2HH1  ARG  40          2HH2      ARG  40 -30.242 -13.198  -2.814
  334   1HH2  ARG  40          1HH1      ARG  40 -27.806 -11.016  -1.664
  335   2HH2  ARG  40          2HH1      ARG  40 -29.216 -11.932  -1.249
  336    H    LEU  41           H        LEU  41 -23.292  -8.704  -6.563
  337    HA   LEU  41           HA       LEU  41 -21.385  -9.391  -4.516
  338   1HB   LEU  41          2HB       LEU  41 -20.944 -10.320  -6.610
  339   2HB   LEU  41          1HB       LEU  41 -21.449  -8.865  -7.464
  340    HG   LEU  41           HG       LEU  41 -19.403  -7.738  -6.945
  341   1HD1  LEU  41          1HD1      LEU  41 -19.414  -9.310  -4.640
  342   2HD1  LEU  41          2HD1      LEU  41 -18.130  -8.205  -5.128
  343   3HD1  LEU  41          3HD1      LEU  41 -18.032  -9.914  -5.550
  344   1HD2  LEU  41          1HD2      LEU  41 -19.299  -9.409  -8.782
  345   2HD2  LEU  41          2HD2      LEU  41 -18.749 -10.622  -7.626
  346   3HD2  LEU  41          3HD2      LEU  41 -17.741  -9.218  -7.977
  347    H    THR  42           H        THR  42 -22.255  -6.448  -6.199
  348    HA   THR  42           HA       THR  42 -19.997  -4.859  -5.260
  349    HB   THR  42           HB       THR  42 -22.709  -4.228  -6.440
  350    HG1  THR  42           HG1      THR  42 -20.767  -5.348  -7.550
  351   1HG2  THR  42          1HG2      THR  42 -22.083  -2.230  -5.357
  352   2HG2  THR  42          2HG2      THR  42 -21.485  -2.015  -7.003
  353   3HG2  THR  42          3HG2      THR  42 -20.372  -2.470  -5.712
  354    H    ALA  43           H        ALA  43 -23.452  -4.347  -4.677
  355    HA   ALA  43           HA       ALA  43 -23.387  -2.769  -2.405
  356   1HB   ALA  43          1HB       ALA  43 -25.396  -3.580  -3.660
  357   2HB   ALA  43          2HB       ALA  43 -25.588  -3.764  -1.917
  358   3HB   ALA  43          3HB       ALA  43 -25.192  -5.165  -2.914
  359    H    ASP  44           H        ASP  44 -22.660  -6.175  -2.705
  360    HA   ASP  44           HA       ASP  44 -22.558  -6.732   0.164
  361   1HB   ASP  44          2HB       ASP  44 -23.117  -8.438  -1.491
  362   2HB   ASP  44          1HB       ASP  44 -21.602  -8.148  -2.346
  363    H    ARG  45           H        ARG  45 -20.226  -6.091  -2.451
  364    HA   ARG  45           HA       ARG  45 -17.802  -6.513  -1.063
  365   1HB   ARG  45          2HB       ARG  45 -18.731  -5.477  -3.518
  366   2HB   ARG  45          1HB       ARG  45 -17.728  -4.204  -2.824
  367   1HG   ARG  45          2HG       ARG  45 -16.291  -6.547  -2.326
  368   2HG   ARG  45          1HG       ARG  45 -16.929  -6.770  -3.956
  369   1HD   ARG  45          2HD       ARG  45 -15.964  -4.648  -4.682
  370   2HD   ARG  45          1HD       ARG  45 -15.425  -4.296  -3.027
  371    HE   ARG  45           HE       ARG  45 -14.065  -6.042  -4.862
  372   1HH1  ARG  45          1HH2      ARG  45 -14.922  -5.514  -1.565
  373   2HH1  ARG  45          2HH2      ARG  45 -13.714  -6.586  -0.941
  374   1HH2  ARG  45          1HH1      ARG  45 -12.556  -7.533  -4.069
  375   2HH2  ARG  45          2HH1      ARG  45 -12.375  -7.728  -2.357
  376    H    GLN  46           H        GLN  46 -20.047  -3.789  -0.969
  377    HA   GLN  46           HA       GLN  46 -18.569  -2.697   1.371
  378   1HB   GLN  46          2HB       GLN  46 -18.810  -1.545  -1.343
  379   2HB   GLN  46          1HB       GLN  46 -19.177  -0.422  -0.033
  380   1HG   GLN  46          2HG       GLN  46 -17.003  -0.265   0.547
  381   2HG   GLN  46          1HG       GLN  46 -16.821  -2.019   0.573
  382   1HE2  GLN  46          1HE2      GLN  46 -17.451   0.407  -2.039
  383   2HE2  GLN  46          2HE2      GLN  46 -16.235  -0.177  -3.069
  384    H    ARG  47           H        ARG  47 -20.323  -3.087   2.764
  385    HA   ARG  47           HA       ARG  47 -23.082  -2.562   2.031
  386   1HB   ARG  47          2HB       ARG  47 -21.595  -3.088   4.616
  387   2HB   ARG  47          1HB       ARG  47 -23.350  -2.933   4.540
  388   1HG   ARG  47          2HG       ARG  47 -23.567  -4.842   3.139
  389   2HG   ARG  47          1HG       ARG  47 -21.841  -4.864   2.775
  390   1HD   ARG  47          2HD       ARG  47 -22.843  -5.211   5.609
  391   2HD   ARG  47          1HD       ARG  47 -22.665  -6.591   4.507
  392    HE   ARG  47           HE       ARG  47 -20.260  -5.465   4.170
  393   1HH1  ARG  47          1HH2      ARG  47 -21.186  -7.499   6.455
  394   2HH1  ARG  47          2HH2      ARG  47 -20.235  -6.870   7.758
  395   1HH2  ARG  47          1HH1      ARG  47 -19.432  -3.929   6.106
  396   2HH2  ARG  47          2HH1      ARG  47 -19.244  -4.849   7.561
  397    H    VAL  48           H        VAL  48 -22.024  -0.216   1.323
  398    HA   VAL  48           HA       VAL  48 -22.126   1.688   3.597
  399    HB   VAL  48           HB       VAL  48 -21.400   3.276   1.810
  400   1HG1  VAL  48          1HG1      VAL  48 -19.448   1.363   1.119
  401   2HG1  VAL  48          2HG1      VAL  48 -20.010   0.911   2.728
  402   3HG1  VAL  48          3HG1      VAL  48 -19.373   2.529   2.440
  403   1HG2  VAL  48          1HG2      VAL  48 -21.151   2.589  -0.444
  404   2HG2  VAL  48          2HG2      VAL  48 -22.715   1.929   0.030
  405   3HG2  VAL  48          3HG2      VAL  48 -21.298   0.882  -0.028
  406    H    MET  49           H        MET  49 -24.606   0.645   3.431
  407    HA   MET  49           HA       MET  49 -26.299   2.098   1.528
  408   1HB   MET  49          2HB       MET  49 -26.686  -0.241   2.341
  409   2HB   MET  49          1HB       MET  49 -26.995   0.414   3.949
  410   1HG   MET  49          2HG       MET  49 -28.549   1.852   1.985
  411   2HG   MET  49          1HG       MET  49 -28.854   0.121   1.844
  412   1HE   MET  49          1HE       MET  49 -31.654   1.399   2.978
  413   2HE   MET  49          2HE       MET  49 -30.449   2.588   2.489
  414   3HE   MET  49          3HE       MET  49 -31.179   2.692   4.088
  415    H    ALA  50           H        ALA  50 -26.090   1.993   5.077
  416    HA   ALA  50           HA       ALA  50 -26.596   4.913   5.195
  417   1HB   ALA  50          1HB       ALA  50 -28.498   4.361   6.851
  418   2HB   ALA  50          2HB       ALA  50 -28.432   2.727   6.190
  419   3HB   ALA  50          3HB       ALA  50 -28.826   4.088   5.140
  420    H    LEU  51           H        LEU  51 -26.972   2.309   7.610
  421    HA   LEU  51           HA       LEU  51 -24.493   3.262   8.978
  422   1HB   LEU  51          2HB       LEU  51 -25.923   3.166  11.113
  423   2HB   LEU  51          1HB       LEU  51 -26.253   4.505  10.013
  424    HG   LEU  51           HG       LEU  51 -27.780   2.052   9.426
  425   1HD1  LEU  51          1HD1      LEU  51 -28.259   1.667  11.629
  426   2HD1  LEU  51          2HD1      LEU  51 -29.374   3.014  11.401
  427   3HD1  LEU  51          3HD1      LEU  51 -27.789   3.294  12.121
  428   1HD2  LEU  51          1HD2      LEU  51 -29.208   4.542  10.003
  429   2HD2  LEU  51          2HD2      LEU  51 -29.167   3.594   8.516
  430   3HD2  LEU  51          3HD2      LEU  51 -27.897   4.772   8.846
  431    H    GLN  52           H        GLN  52 -23.776   1.680  10.662
  432    HA   GLN  52           HA       GLN  52 -24.990  -1.008  10.621
  433   1HB   GLN  52          2HB       GLN  52 -22.841  -1.996   9.749
  434   2HB   GLN  52          1HB       GLN  52 -23.691  -1.002   8.564
  435   1HG   GLN  52          2HG       GLN  52 -21.510  -0.187   8.377
  436   2HG   GLN  52          1HG       GLN  52 -22.210   0.936   9.543
  437   1HE2  GLN  52          1HE2      GLN  52 -20.547   1.353  11.027
  438   2HE2  GLN  52          2HE2      GLN  52 -19.631   0.155  11.806
  Start of MODEL    4
    1   1H    SER   1          1H        SER   1  -2.179   4.846 -12.379
    2   2H    SER   1          2H        SER   1  -2.455   3.172 -12.472
    3   3H    SER   1          3H        SER   1  -2.951   4.041 -11.100
    4    HA   SER   1           HA       SER   1  -4.652   3.400 -13.001
    5   1HB   SER   1          2HB       SER   1  -5.093   4.496 -10.848
    6   2HB   SER   1          1HB       SER   1  -4.429   6.008 -11.463
    7    HG   SER   1           HG       SER   1  -6.174   6.296 -12.677
    8    H    ILE   2           H        ILE   2  -5.317   4.085 -15.035
    9    HA   ILE   2           HA       ILE   2  -3.549   5.938 -16.496
   10    HB   ILE   2           HB       ILE   2  -6.049   4.490 -17.417
   11   1HG1  ILE   2          2HG1      ILE   2  -4.455   2.939 -16.276
   12   2HG1  ILE   2          1HG1      ILE   2  -4.597   2.611 -18.003
   13   1HG2  ILE   2          1HG2      ILE   2  -5.422   5.856 -19.180
   14   2HG2  ILE   2          2HG2      ILE   2  -4.421   4.443 -19.519
   15   3HG2  ILE   2          3HG2      ILE   2  -3.719   5.849 -18.717
   16   1HD1  ILE   2          1HD1      ILE   2  -2.224   3.072 -16.608
   17   2HD1  ILE   2          2HD1      ILE   2  -2.529   4.590 -17.451
   18   3HD1  ILE   2          3HD1      ILE   2  -2.419   3.082 -18.360
   19    H    SER   3           H        SER   3  -6.652   6.011 -14.921
   20    HA   SER   3           HA       SER   3  -7.019   8.829 -15.849
   21   1HB   SER   3          2HB       SER   3  -9.174   6.695 -15.757
   22   2HB   SER   3          1HB       SER   3  -9.361   8.348 -16.336
   23    HG   SER   3           HG       SER   3  -8.284   7.856 -18.120
   24    HA   PRO   4           HA       PRO   4  -7.793   9.354 -11.536
   25   1HB   PRO   4          2HB       PRO   4  -8.895  11.856 -11.641
   26   2HB   PRO   4          1HB       PRO   4  -7.157  11.558 -11.847
   27   1HG   PRO   4          2HG       PRO   4  -9.242  12.096 -13.896
   28   2HG   PRO   4          1HG       PRO   4  -7.552  12.616 -13.840
   29   1HD   PRO   4          2HD       PRO   4  -8.473  10.548 -15.387
   30   2HD   PRO   4          1HD       PRO   4  -6.796  10.698 -14.816
   31    H    ARG   5           H        ARG   5  -9.469   8.047 -10.807
   32    HA   ARG   5           HA       ARG   5 -12.227   8.470 -11.803
   33   1HB   ARG   5          2HB       ARG   5 -10.788   6.268 -11.224
   34   2HB   ARG   5          1HB       ARG   5 -11.534   6.528  -9.646
   35   1HG   ARG   5          2HG       ARG   5 -13.655   6.917 -11.362
   36   2HG   ARG   5          1HG       ARG   5 -12.753   5.631 -12.167
   37   1HD   ARG   5          2HD       ARG   5 -13.986   4.312 -10.721
   38   2HD   ARG   5          1HD       ARG   5 -12.663   4.719  -9.611
   39    HE   ARG   5           HE       ARG   5 -14.807   6.717  -9.692
   40   1HH1  ARG   5          1HH2      ARG   5 -16.149   4.218  -8.803
   41   2HH1  ARG   5          2HH2      ARG   5 -15.885   4.237  -7.092
   42   1HH2  ARG   5          1HH1      ARG   5 -13.343   6.591  -7.243
   43   2HH2  ARG   5          2HH1      ARG   5 -14.297   5.581  -6.208
   44    H    THR   6           H        THR   6 -11.978  10.739 -10.627
   45    HA   THR   6           HA       THR   6 -12.279  10.637  -7.714
   46    HB   THR   6           HB       THR   6 -11.041  12.385  -9.075
   47    HG1  THR   6           HG1      THR   6 -12.115  14.129  -7.788
   48   1HG2  THR   6          1HG2      THR   6 -13.882  12.995  -9.855
   49   2HG2  THR   6          2HG2      THR   6 -12.443  12.921 -10.872
   50   3HG2  THR   6          3HG2      THR   6 -12.682  14.285  -9.781
   51    HA   PRO   7           HA       PRO   7 -16.727  11.832  -8.971
   52   1HB   PRO   7          2HB       PRO   7 -17.662  10.833 -11.336
   53   2HB   PRO   7          1HB       PRO   7 -16.870  12.415 -11.203
   54   1HG   PRO   7          2HG       PRO   7 -15.829   9.868 -12.272
   55   2HG   PRO   7          1HG       PRO   7 -15.420  11.532 -12.707
   56   1HD   PRO   7          2HD       PRO   7 -13.910   9.824 -11.084
   57   2HD   PRO   7          1HD       PRO   7 -13.690  11.575 -11.256
   58    HA   PRO   8           HA       PRO   8 -17.452   7.601  -7.568
   59   1HB   PRO   8          2HB       PRO   8 -19.285   8.286  -5.662
   60   2HB   PRO   8          1HB       PRO   8 -17.535   8.430  -5.409
   61   1HG   PRO   8          2HG       PRO   8 -19.531  10.531  -6.063
   62   2HG   PRO   8          1HG       PRO   8 -18.110  10.611  -5.012
   63   1HD   PRO   8          2HD       PRO   8 -18.198  11.623  -7.560
   64   2HD   PRO   8          1HD       PRO   8 -16.707  11.117  -6.736
   65    H    ASN   9           H        ASN   9 -18.666   6.606  -9.188
   66    HA   ASN   9           HA       ASN   9 -21.385   7.637  -9.835
   67   1HB   ASN   9          2HB       ASN   9 -21.190   6.147 -11.732
   68   2HB   ASN   9          1HB       ASN   9 -19.673   7.037 -11.578
   69   1HD2  ASN   9          1HD2      ASN   9 -17.763   5.846 -10.953
   70   2HD2  ASN   9          2HD2      ASN   9 -17.750   4.153 -10.833
   71    H    CYS  10           H        CYS  10 -23.192   6.215  -9.792
   72    HA   CYS  10           HA       CYS  10 -23.521   4.625  -7.458
   73   1HB   CYS  10          2HB       CYS  10 -25.362   5.631  -8.769
   74   2HB   CYS  10          1HB       CYS  10 -24.944   4.640 -10.131
   75    H    ALA  11           H        ALA  11 -22.844   2.492  -7.068
   76    HA   ALA  11           HA       ALA  11 -21.494   1.108  -9.236
   77   1HB   ALA  11          1HB       ALA  11 -20.733  -0.372  -7.551
   78   2HB   ALA  11          2HB       ALA  11 -22.105   0.004  -6.509
   79   3HB   ALA  11          3HB       ALA  11 -20.836   1.203  -6.763
   80    H    ARG  12           H        ARG  12 -24.617   0.998  -7.784
   81    HA   ARG  12           HA       ARG  12 -25.449  -1.661  -8.390
   82   1HB   ARG  12          2HB       ARG  12 -26.556   0.185  -7.047
   83   2HB   ARG  12          1HB       ARG  12 -26.994   0.941  -8.571
   84   1HG   ARG  12          2HG       ARG  12 -28.686  -0.467  -8.891
   85   2HG   ARG  12          1HG       ARG  12 -27.686  -1.874  -8.544
   86   1HD   ARG  12          2HD       ARG  12 -28.918  -0.064  -6.429
   87   2HD   ARG  12          1HD       ARG  12 -29.536  -1.664  -6.880
   88    HE   ARG  12           HE       ARG  12 -26.684  -1.625  -6.189
   89   1HH1  ARG  12          1HH2      ARG  12 -29.180  -0.874  -4.205
   90   2HH1  ARG  12          2HH2      ARG  12 -29.105  -2.295  -3.217
   91   1HH2  ARG  12          1HH1      ARG  12 -26.899  -3.956  -5.310
   92   2HH2  ARG  12          2HH1      ARG  12 -27.812  -4.038  -3.841
   93    H    CYS  13           H        CYS  13 -25.698   1.309 -10.294
   94    HA   CYS  13           HA       CYS  13 -26.678  -0.182 -12.603
   95   1HB   CYS  13          2HB       CYS  13 -26.719   2.126 -13.598
   96   2HB   CYS  13          1HB       CYS  13 -27.508   2.037 -12.043
   97    H    ARG  14           H        ARG  14 -23.406   0.834 -11.573
   98    HA   ARG  14           HA       ARG  14 -22.285   0.796 -14.268
   99   1HB   ARG  14          2HB       ARG  14 -20.130   0.294 -12.992
  100   2HB   ARG  14          1HB       ARG  14 -20.975   1.763 -12.511
  101   1HG   ARG  14          2HG       ARG  14 -20.331   0.601 -10.510
  102   2HG   ARG  14          1HG       ARG  14 -22.064   0.454 -10.694
  103   1HD   ARG  14          2HD       ARG  14 -20.762  -1.655 -10.002
  104   2HD   ARG  14          1HD       ARG  14 -21.909  -1.832 -11.318
  105    HE   ARG  14           HE       ARG  14 -19.985  -1.613 -12.903
  106   1HH1  ARG  14          1HH1      ARG  14 -17.922  -0.385 -11.259
  107   2HH1  ARG  14          2HH1      ARG  14 -16.945  -1.726 -10.757
  108   1HH2  ARG  14          1HH2      ARG  14 -19.350  -4.104 -11.522
  109   2HH2  ARG  14          2HH2      ARG  14 -17.754  -3.832 -10.909
  110    H    ASN  15           H        ASN  15 -23.503  -1.646 -12.232
  111    HA   ASN  15           HA       ASN  15 -21.843  -3.852 -12.810
  112   1HB   ASN  15          2HB       ASN  15 -24.765  -3.440 -12.206
  113   2HB   ASN  15          1HB       ASN  15 -24.064  -5.048 -12.299
  114   1HD2  ASN  15          1HD2      ASN  15 -24.888  -2.796 -10.118
  115   2HD2  ASN  15          2HD2      ASN  15 -23.657  -2.954  -8.971
  116    H    HIS  16           H        HIS  16 -24.481  -2.388 -14.555
  117    HA   HIS  16           HA       HIS  16 -24.358  -4.428 -16.707
  118   1HB   HIS  16          2HB       HIS  16 -26.228  -2.148 -16.008
  119   2HB   HIS  16          1HB       HIS  16 -26.505  -3.326 -17.272
  120    HD1  HIS  16           HD1      HIS  16 -27.387  -5.599 -16.634
  121    HD2  HIS  16           HD2      HIS  16 -26.096  -3.351 -13.369
  122    HE1  HIS  16           HE1      HIS  16 -28.003  -6.930 -14.555
  123    H    GLY  17           H        GLY  17 -23.094  -1.348 -15.978
  124   1HA   GLY  17          2HA       GLY  17 -21.438  -0.481 -17.638
  125   2HA   GLY  17          1HA       GLY  17 -22.610  -0.875 -18.898
  126    H    LEU  18           H        LEU  18 -23.371   0.594 -15.799
  127    HA   LEU  18           HA       LEU  18 -24.407   2.976 -17.279
  128   1HB   LEU  18          2HB       LEU  18 -25.590   1.195 -15.560
  129   2HB   LEU  18          1HB       LEU  18 -25.129   2.491 -14.455
  130    HG   LEU  18           HG       LEU  18 -27.372   2.909 -15.311
  131   1HD1  LEU  18          1HD1      LEU  18 -26.997   5.133 -15.629
  132   2HD1  LEU  18          2HD1      LEU  18 -25.836   4.854 -16.928
  133   3HD1  LEU  18          3HD1      LEU  18 -25.336   4.689 -15.246
  134   1HD2  LEU  18          1HD2      LEU  18 -26.448   1.705 -17.620
  135   2HD2  LEU  18          2HD2      LEU  18 -26.537   3.402 -18.089
  136   3HD2  LEU  18          3HD2      LEU  18 -27.972   2.580 -17.478
  137    H    LYS  19           H        LYS  19 -23.926   5.078 -16.394
  138    HA   LYS  19           HA       LYS  19 -21.991   5.286 -14.168
  139   1HB   LYS  19          2HB       LYS  19 -21.495   5.904 -17.074
  140   2HB   LYS  19          1HB       LYS  19 -20.667   6.846 -15.834
  141   1HG   LYS  19          2HG       LYS  19 -20.601   3.822 -16.085
  142   2HG   LYS  19          1HG       LYS  19 -19.295   4.916 -16.537
  143   1HD   LYS  19          2HD       LYS  19 -20.171   5.480 -13.836
  144   2HD   LYS  19          1HD       LYS  19 -19.750   3.775 -13.995
  145   1HE   LYS  19          2HE       LYS  19 -17.826   5.514 -15.362
  146   2HE   LYS  19          1HE       LYS  19 -17.926   5.842 -13.621
  147   1HZ   LYS  19          1HZ       LYS  19 -17.335   3.288 -14.984
  148   2HZ   LYS  19          2HZ       LYS  19 -17.961   3.302 -13.404
  149   3HZ   LYS  19          3HZ       LYS  19 -16.472   4.049 -13.739
  150    H    ILE  20           H        ILE  20 -23.724   6.370 -13.130
  151    HA   ILE  20           HA       ILE  20 -24.723   8.875 -14.386
  152    HB   ILE  20           HB       ILE  20 -26.696   8.304 -13.409
  153   1HG1  ILE  20          2HG1      ILE  20 -25.472   8.899 -11.132
  154   2HG1  ILE  20          1HG1      ILE  20 -27.072   8.223 -11.207
  155   1HG2  ILE  20          1HG2      ILE  20 -25.906   6.149 -14.303
  156   2HG2  ILE  20          2HG2      ILE  20 -27.070   5.990 -12.994
  157   3HG2  ILE  20          3HG2      ILE  20 -25.357   5.723 -12.686
  158   1HD1  ILE  20          1HD1      ILE  20 -25.678   7.003  -9.634
  159   2HD1  ILE  20          2HD1      ILE  20 -24.542   6.635 -10.921
  160   3HD1  ILE  20          3HD1      ILE  20 -26.170   5.972 -10.966
  161    H    THR  21           H        THR  21 -22.408   7.893 -12.114
  162    HA   THR  21           HA       THR  21 -20.970   9.272 -10.776
  163    HB   THR  21           HB       THR  21 -22.944  11.515 -11.092
  164    HG1  THR  21           HG1      THR  21 -22.228  11.891 -13.117
  165   1HG2  THR  21          1HG2      THR  21 -21.236  12.732 -10.285
  166   2HG2  THR  21          2HG2      THR  21 -20.153  12.115 -11.534
  167   3HG2  THR  21          3HG2      THR  21 -20.354  11.227 -10.023
  168    H    LEU  22           H        LEU  22 -24.027   8.303 -10.212
  169    HA   LEU  22           HA       LEU  22 -25.425   8.058  -8.314
  170   1HB   LEU  22          2HB       LEU  22 -23.619   6.752  -7.544
  171   2HB   LEU  22          1HB       LEU  22 -22.583   8.157  -7.306
  172    HG   LEU  22           HG       LEU  22 -23.838   8.862  -5.382
  173   1HD1  LEU  22          1HD1      LEU  22 -25.747   6.793  -5.011
  174   2HD1  LEU  22          2HD1      LEU  22 -25.936   7.360  -6.670
  175   3HD1  LEU  22          3HD1      LEU  22 -26.063   8.498  -5.330
  176   1HD2  LEU  22          1HD2      LEU  22 -23.008   6.011  -5.575
  177   2HD2  LEU  22          2HD2      LEU  22 -23.970   6.453  -4.164
  178   3HD2  LEU  22          3HD2      LEU  22 -22.443   7.276  -4.484
  179    H    LYS  23           H        LYS  23 -24.540  10.910  -9.251
  180    HA   LYS  23           HA       LYS  23 -24.792  12.479  -6.768
  181   1HB   LYS  23          2HB       LYS  23 -23.367  13.327  -8.512
  182   2HB   LYS  23          1HB       LYS  23 -24.602  13.062  -9.739
  183   1HG   LYS  23          2HG       LYS  23 -25.994  14.729  -8.195
  184   2HG   LYS  23          1HG       LYS  23 -24.379  15.250  -7.713
  185   1HD   LYS  23          2HD       LYS  23 -24.047  15.132 -10.401
  186   2HD   LYS  23          1HD       LYS  23 -25.760  15.545 -10.323
  187   1HE   LYS  23          2HE       LYS  23 -24.357  17.154  -8.398
  188   2HE   LYS  23          1HE       LYS  23 -23.550  17.303  -9.972
  189   1HZ   LYS  23          1HZ       LYS  23 -25.393  18.837  -9.878
  190   2HZ   LYS  23          2HZ       LYS  23 -26.462  17.589  -9.448
  191   3HZ   LYS  23          3HZ       LYS  23 -25.750  17.608 -10.991
  192    H    GLY  24           H        GLY  24 -26.882  12.407  -5.880
  193   1HA   GLY  24          2HA       GLY  24 -29.242  12.504  -5.803
  194   2HA   GLY  24          1HA       GLY  24 -29.115  13.581  -7.202
  195    H    HIS  25           H        HIS  25 -28.654  10.126  -6.453
  196    HA   HIS  25           HA       HIS  25 -30.061   9.465  -9.017
  197   1HB   HIS  25          2HB       HIS  25 -27.637   9.369  -9.214
  198   2HB   HIS  25          1HB       HIS  25 -27.529   8.385  -7.760
  199    HD1  HIS  25           HD1      HIS  25 -29.338   8.129 -11.128
  200    HD2  HIS  25           HD2      HIS  25 -27.182   5.765  -8.470
  201    HE1  HIS  25           HE1      HIS  25 -28.966   5.882 -12.242
  202    H    LYS  26           H        LYS  26 -28.652   6.901  -7.224
  203    HA   LYS  26           HA       LYS  26 -29.673   5.026  -6.250
  204   1HB   LYS  26          2HB       LYS  26 -29.427   6.821  -4.487
  205   2HB   LYS  26          1HB       LYS  26 -31.115   7.241  -4.758
  206   1HG   LYS  26          2HG       LYS  26 -31.238   5.728  -2.964
  207   2HG   LYS  26          1HG       LYS  26 -31.562   4.701  -4.362
  208   1HD   LYS  26          2HD       LYS  26 -29.794   3.425  -3.810
  209   2HD   LYS  26          1HD       LYS  26 -28.738   4.818  -4.052
  210   1HE   LYS  26          2HE       LYS  26 -30.275   4.569  -1.474
  211   2HE   LYS  26          1HE       LYS  26 -28.767   3.660  -1.695
  212   1HZ   LYS  26          1HZ       LYS  26 -28.469   5.964  -0.799
  213   2HZ   LYS  26          2HZ       LYS  26 -29.029   6.556  -2.290
  214   3HZ   LYS  26          3HZ       LYS  26 -27.600   5.640  -2.220
  215    H    ARG  27           H        ARG  27 -32.599   6.962  -5.715
  216    HA   ARG  27           HA       ARG  27 -34.372   5.012  -6.733
  217   1HB   ARG  27          2HB       ARG  27 -35.033   6.894  -5.308
  218   2HB   ARG  27          1HB       ARG  27 -34.603   8.038  -6.581
  219   1HG   ARG  27          2HG       ARG  27 -36.341   7.164  -8.034
  220   2HG   ARG  27          1HG       ARG  27 -36.705   5.875  -6.888
  221   1HD   ARG  27          2HD       ARG  27 -38.372   7.463  -6.389
  222   2HD   ARG  27          1HD       ARG  27 -37.111   7.878  -5.210
  223    HE   ARG  27           HE       ARG  27 -36.301   9.432  -7.216
  224   1HH1  ARG  27          1HH2      ARG  27 -38.739   9.195  -8.822
  225   2HH1  ARG  27          2HH2      ARG  27 -39.742  10.472  -8.222
  226   1HH2  ARG  27          1HH1      ARG  27 -37.924  10.883  -5.298
  227   2HH2  ARG  27          2HH1      ARG  27 -39.282  11.427  -6.226
  228    H    TYR  28           H        TYR  28 -32.336   7.260  -8.399
  229    HA   TYR  28           HA       TYR  28 -33.845   7.146 -10.936
  230   1HB   TYR  28          2HB       TYR  28 -31.303   8.409  -9.905
  231   2HB   TYR  28          1HB       TYR  28 -31.686   8.429 -11.626
  232    HD1  TYR  28           HD1      TYR  28 -34.595   8.385  -9.506
  233    HD2  TYR  28           HD2      TYR  28 -31.667  10.977 -11.284
  234    HE1  TYR  28           HE1      TYR  28 -36.103  10.325  -9.163
  235    HE2  TYR  28           HE2      TYR  28 -33.174  12.916 -10.942
  236    HH   TYR  28           HH       TYR  28 -35.059  13.538  -9.456
  237    H    CYS  29           H        CYS  29 -31.802   5.057  -9.326
  238    HA   CYS  29           HA       CYS  29 -29.967   4.238 -11.376
  239   1HB   CYS  29          2HB       CYS  29 -30.063   3.744  -8.805
  240   2HB   CYS  29          1HB       CYS  29 -31.130   2.430  -9.270
  241    H    LYS  30           H        LYS  30 -30.096   2.568 -12.860
  242    HA   LYS  30           HA       LYS  30 -32.841   1.617 -13.546
  243   1HB   LYS  30          2HB       LYS  30 -30.362   2.236 -14.926
  244   2HB   LYS  30          1HB       LYS  30 -30.851   0.580 -15.290
  245   1HG   LYS  30          2HG       LYS  30 -33.224   1.642 -15.636
  246   2HG   LYS  30          1HG       LYS  30 -32.319   3.143 -15.836
  247   1HD   LYS  30          2HD       LYS  30 -31.713   2.553 -17.921
  248   2HD   LYS  30          1HD       LYS  30 -31.039   1.034 -17.330
  249   1HE   LYS  30          2HE       LYS  30 -33.754   0.548 -17.183
  250   2HE   LYS  30          1HE       LYS  30 -33.618   1.528 -18.658
  251   1HZ   LYS  30          1HZ       LYS  30 -33.141  -1.033 -18.726
  252   2HZ   LYS  30          2HZ       LYS  30 -31.614  -0.558 -18.155
  253   3HZ   LYS  30          3HZ       LYS  30 -32.196   0.044 -19.634
  254    H    PHE  31           H        PHE  31 -30.680   0.862 -11.351
  255    HA   PHE  31           HA       PHE  31 -31.073  -2.091 -11.472
  256   1HB   PHE  31          2HB       PHE  31 -28.488  -0.574 -10.925
  257   2HB   PHE  31          1HB       PHE  31 -28.630  -2.330 -11.050
  258    HD1  PHE  31           HD1      PHE  31 -28.772   0.867 -12.882
  259    HD2  PHE  31           HD2      PHE  31 -28.923  -3.409 -13.206
  260    HE1  PHE  31           HE1      PHE  31 -28.543   1.052 -15.331
  261    HE2  PHE  31           HE2      PHE  31 -28.704  -3.230 -15.659
  262    HZ   PHE  31           HZ       PHE  31 -28.506  -0.999 -16.736
  263    H    ARG  32           H        ARG  32 -31.690   0.647  -9.835
  264    HA   ARG  32           HA       ARG  32 -30.673   0.562  -7.266
  265   1HB   ARG  32          2HB       ARG  32 -33.298   1.144  -6.743
  266   2HB   ARG  32          1HB       ARG  32 -32.125   2.304  -7.346
  267   1HG   ARG  32          2HG       ARG  32 -34.315   2.230  -8.607
  268   2HG   ARG  32          1HG       ARG  32 -32.882   2.018  -9.595
  269   1HD   ARG  32          2HD       ARG  32 -33.372  -0.186 -10.080
  270   2HD   ARG  32          1HD       ARG  32 -34.157  -0.451  -8.510
  271    HE   ARG  32           HE       ARG  32 -35.740   1.456  -9.796
  272   1HH1  ARG  32          1HH2      ARG  32 -34.791  -1.837 -10.104
  273   2HH1  ARG  32          2HH2      ARG  32 -36.097  -2.255 -11.161
  274   1HH2  ARG  32          1HH1      ARG  32 -37.375   0.965 -11.291
  275   2HH2  ARG  32          2HH1      ARG  32 -37.562  -0.670 -11.830
  276    H    TYR  33           H        TYR  33 -32.816  -1.716  -8.745
  277    HA   TYR  33           HA       TYR  33 -33.001  -3.185  -6.130
  278   1HB   TYR  33          2HB       TYR  33 -35.033  -2.874  -8.362
  279   2HB   TYR  33          1HB       TYR  33 -35.253  -3.904  -6.947
  280    HD1  TYR  33           HD1      TYR  33 -36.536  -1.084  -8.105
  281    HD2  TYR  33           HD2      TYR  33 -34.098  -2.299  -4.784
  282    HE1  TYR  33           HE1      TYR  33 -37.336   0.870  -6.805
  283    HE2  TYR  33           HE2      TYR  33 -34.897  -0.345  -3.482
  284    HH   TYR  33           HH       TYR  33 -37.065   2.070  -4.937
  285    H    CYS  34           H        CYS  34 -31.726  -3.258  -9.213
  286    HA   CYS  34           HA       CYS  34 -32.199  -5.746 -10.345
  287   1HB   CYS  34          2HB       CYS  34 -30.570  -3.953 -11.098
  288   2HB   CYS  34          1HB       CYS  34 -29.472  -4.527  -9.840
  289    H    THR  35           H        THR  35 -30.760  -7.763 -10.136
  290    HA   THR  35           HA       THR  35 -29.748  -8.220  -7.375
  291    HB   THR  35           HB       THR  35 -31.127 -10.382  -7.425
  292    HG1  THR  35           HG1      THR  35 -32.388 -10.689  -9.069
  293   1HG2  THR  35          1HG2      THR  35 -31.724  -7.842  -6.534
  294   2HG2  THR  35          2HG2      THR  35 -32.659  -9.292  -6.164
  295   3HG2  THR  35          3HG2      THR  35 -33.142  -8.248  -7.501
  296    H    CYS  36           H        CYS  36 -28.958  -8.265 -10.498
  297    HA   CYS  36           HA       CYS  36 -28.099 -10.861 -11.186
  298   1HB   CYS  36          2HB       CYS  36 -26.618  -9.709 -12.704
  299   2HB   CYS  36          1HB       CYS  36 -28.094  -8.756 -12.565
  300    H    GLU  37           H        GLU  37 -25.419 -11.140 -11.343
  301    HA   GLU  37           HA       GLU  37 -24.608 -11.453  -8.524
  302   1HB   GLU  37          2HB       GLU  37 -24.337 -12.911 -10.817
  303   2HB   GLU  37          1HB       GLU  37 -22.757 -12.135 -10.729
  304   1HG   GLU  37          2HG       GLU  37 -22.226 -13.139  -8.691
  305   2HG   GLU  37          1HG       GLU  37 -23.916 -13.407  -8.268
  306    H    LYS  38           H        LYS  38 -24.317  -8.924 -10.667
  307    HA   LYS  38           HA       LYS  38 -21.589  -8.126  -9.726
  308   1HB   LYS  38          2HB       LYS  38 -23.434  -7.086 -11.913
  309   2HB   LYS  38          1HB       LYS  38 -21.811  -6.474 -11.592
  310   1HG   LYS  38          2HG       LYS  38 -21.188  -9.058 -11.814
  311   2HG   LYS  38          1HG       LYS  38 -22.653  -9.078 -12.795
  312   1HD   LYS  38          2HD       LYS  38 -21.576  -6.933 -13.897
  313   2HD   LYS  38          1HD       LYS  38 -20.077  -7.618 -13.270
  314   1HE   LYS  38          2HE       LYS  38 -20.044  -8.915 -15.139
  315   2HE   LYS  38          1HE       LYS  38 -21.408  -9.802 -14.428
  316   1HZ   LYS  38          1HZ       LYS  38 -22.946  -8.532 -15.550
  317   2HZ   LYS  38          2HZ       LYS  38 -21.709  -8.631 -16.711
  318   3HZ   LYS  38          3HZ       LYS  38 -21.886  -7.227 -15.770
  319    H    CYS  39           H        CYS  39 -24.953  -7.536  -9.431
  320    HA   CYS  39           HA       CYS  39 -24.689  -4.862  -8.221
  321   1HB   CYS  39          2HB       CYS  39 -26.801  -6.766  -9.134
  322   2HB   CYS  39          1HB       CYS  39 -27.242  -5.709  -7.808
  323    H    ARG  40           H        ARG  40 -25.256  -8.258  -7.405
  324    HA   ARG  40           HA       ARG  40 -25.638  -7.816  -4.545
  325   1HB   ARG  40          2HB       ARG  40 -25.518 -10.018  -6.515
  326   2HB   ARG  40          1HB       ARG  40 -24.901 -10.451  -4.920
  327   1HG   ARG  40          2HG       ARG  40 -26.956  -9.974  -3.863
  328   2HG   ARG  40          1HG       ARG  40 -27.537  -9.021  -5.229
  329   1HD   ARG  40          2HD       ARG  40 -28.641 -11.240  -5.183
  330   2HD   ARG  40          1HD       ARG  40 -27.603 -11.099  -6.615
  331    HE   ARG  40           HE       ARG  40 -26.058 -12.120  -4.427
  332   1HH1  ARG  40          1HH2      ARG  40 -29.018 -13.348  -5.190
  333   2HH1  ARG  40          2HH2      ARG  40 -28.460 -14.864  -5.814
  334   1HH2  ARG  40          1HH1      ARG  40 -25.123 -13.921  -5.858
  335   2HH2  ARG  40          2HH1      ARG  40 -26.254 -15.190  -6.189
  336    H    LEU  41           H        LEU  41 -23.024  -8.686  -6.730
  337    HA   LEU  41           HA       LEU  41 -21.010  -9.221  -4.739
  338   1HB   LEU  41          2HB       LEU  41 -20.433 -10.034  -6.829
  339   2HB   LEU  41          1HB       LEU  41 -21.235  -8.711  -7.665
  340    HG   LEU  41           HG       LEU  41 -19.405  -7.210  -7.195
  341   1HD1  LEU  41          1HD1      LEU  41 -18.994  -8.758  -4.960
  342   2HD1  LEU  41          2HD1      LEU  41 -17.864  -7.540  -5.553
  343   3HD1  LEU  41          3HD1      LEU  41 -17.640  -9.236  -5.983
  344   1HD2  LEU  41          1HD2      LEU  41 -19.248  -9.065  -9.028
  345   2HD2  LEU  41          2HD2      LEU  41 -18.030  -9.776  -7.969
  346   3HD2  LEU  41          3HD2      LEU  41 -17.793  -8.154  -8.620
  347    H    THR  42           H        THR  42 -22.343  -6.352  -6.176
  348    HA   THR  42           HA       THR  42 -20.206  -4.556  -5.274
  349    HB   THR  42           HB       THR  42 -22.928  -4.299  -6.542
  350    HG1  THR  42           HG1      THR  42 -20.241  -3.979  -7.331
  351   1HG2  THR  42          1HG2      THR  42 -23.055  -2.154  -5.886
  352   2HG2  THR  42          2HG2      THR  42 -21.516  -1.839  -6.686
  353   3HG2  THR  42          3HG2      THR  42 -21.545  -2.322  -4.991
  354    H    ALA  43           H        ALA  43 -23.692  -4.455  -4.648
  355    HA   ALA  43           HA       ALA  43 -23.771  -2.924  -2.340
  356   1HB   ALA  43          1HB       ALA  43 -25.932  -3.669  -2.328
  357   2HB   ALA  43          2HB       ALA  43 -25.432  -5.357  -2.206
  358   3HB   ALA  43          3HB       ALA  43 -25.479  -4.562  -3.780
  359    H    ASP  44           H        ASP  44 -22.657  -6.218  -2.727
  360    HA   ASP  44           HA       ASP  44 -22.489  -6.853   0.113
  361   1HB   ASP  44          2HB       ASP  44 -22.758  -8.515  -1.701
  362   2HB   ASP  44          1HB       ASP  44 -21.205  -8.026  -2.380
  363    H    ARG  45           H        ARG  45 -20.211  -5.822  -2.431
  364    HA   ARG  45           HA       ARG  45 -17.777  -5.920  -1.040
  365   1HB   ARG  45          2HB       ARG  45 -18.596  -5.144  -3.470
  366   2HB   ARG  45          1HB       ARG  45 -18.420  -3.546  -2.743
  367   1HG   ARG  45          2HG       ARG  45 -16.132  -3.762  -2.483
  368   2HG   ARG  45          1HG       ARG  45 -16.208  -5.519  -2.344
  369   1HD   ARG  45          2HD       ARG  45 -16.645  -5.727  -4.750
  370   2HD   ARG  45          1HD       ARG  45 -16.665  -3.959  -4.916
  371    HE   ARG  45           HE       ARG  45 -14.267  -4.134  -3.888
  372   1HH1  ARG  45          1HH2      ARG  45 -14.614  -4.651  -6.893
  373   2HH1  ARG  45          2HH2      ARG  45 -13.655  -6.081  -7.088
  374   1HH2  ARG  45          1HH1      ARG  45 -13.526  -6.777  -3.693
  375   2HH2  ARG  45          2HH1      ARG  45 -13.038  -7.283  -5.277
  376    H    GLN  46           H        GLN  46 -20.390  -3.545  -0.784
  377    HA   GLN  46           HA       GLN  46 -18.772  -1.929   1.133
  378   1HB   GLN  46          2HB       GLN  46 -21.213  -1.546  -0.575
  379   2HB   GLN  46          1HB       GLN  46 -20.974  -0.495   0.821
  380   1HG   GLN  46          2HG       GLN  46 -18.489  -0.403  -0.250
  381   2HG   GLN  46          1HG       GLN  46 -19.438  -0.650  -1.716
  382   1HE2  GLN  46          1HE2      GLN  46 -18.801   1.646  -2.270
  383   2HE2  GLN  46          2HE2      GLN  46 -19.675   2.927  -1.581
  384    H    ARG  47           H        ARG  47 -21.622  -4.001   0.932
  385    HA   ARG  47           HA       ARG  47 -22.665  -3.322   3.563
  386   1HB   ARG  47          2HB       ARG  47 -23.094  -5.475   1.494
  387   2HB   ARG  47          1HB       ARG  47 -23.903  -5.559   3.059
  388   1HG   ARG  47          2HG       ARG  47 -24.942  -3.393   2.696
  389   2HG   ARG  47          1HG       ARG  47 -24.038  -3.171   1.198
  390   1HD   ARG  47          2HD       ARG  47 -25.178  -5.128   0.206
  391   2HD   ARG  47          1HD       ARG  47 -26.091  -5.354   1.713
  392    HE   ARG  47           HE       ARG  47 -26.612  -3.303  -0.278
  393   1HH1  ARG  47          1HH2      ARG  47 -27.696  -4.716   2.537
  394   2HH1  ARG  47          2HH2      ARG  47 -28.462  -3.300   3.177
  395   1HH2  ARG  47          1HH1      ARG  47 -27.149  -1.181   0.767
  396   2HH2  ARG  47          2HH1      ARG  47 -28.153  -1.298   2.173
  397    H    VAL  48           H        VAL  48 -20.617  -3.579   4.822
  398    HA   VAL  48           HA       VAL  48 -20.121  -6.458   5.498
  399    HB   VAL  48           HB       VAL  48 -17.728  -5.841   5.704
  400   1HG1  VAL  48          1HG1      VAL  48 -17.546  -6.415   3.537
  401   2HG1  VAL  48          2HG1      VAL  48 -18.039  -4.796   3.043
  402   3HG1  VAL  48          3HG1      VAL  48 -19.257  -6.041   3.322
  403   1HG2  VAL  48          1HG2      VAL  48 -17.723  -3.372   4.278
  404   2HG2  VAL  48          2HG2      VAL  48 -17.163  -3.672   5.923
  405   3HG2  VAL  48          3HG2      VAL  48 -18.836  -3.194   5.634
  406    H    MET  49           H        MET  49 -21.908  -5.349   7.086
  407    HA   MET  49           HA       MET  49 -20.439  -4.149   9.407
  408   1HB   MET  49          2HB       MET  49 -22.850  -3.522   7.995
  409   2HB   MET  49          1HB       MET  49 -23.288  -3.990   9.639
  410   1HG   MET  49          2HG       MET  49 -22.766  -1.839  10.158
  411   2HG   MET  49          1HG       MET  49 -21.097  -2.408  10.093
  412   1HE   MET  49          1HE       MET  49 -19.915  -2.019   6.746
  413   2HE   MET  49          2HE       MET  49 -19.755  -2.567   8.413
  414   3HE   MET  49          3HE       MET  49 -19.307  -0.917   7.990
  415    H    ALA  50           H        ALA  50 -20.996  -7.107   8.521
  416    HA   ALA  50           HA       ALA  50 -22.665  -8.123  10.723
  417   1HB   ALA  50          1HB       ALA  50 -21.699 -10.320   9.635
  418   2HB   ALA  50          2HB       ALA  50 -21.140  -9.220   8.374
  419   3HB   ALA  50          3HB       ALA  50 -22.862  -9.346   8.735
  420    H    LEU  51           H        LEU  51 -21.664  -9.969  12.079
  421    HA   LEU  51           HA       LEU  51 -19.170  -8.969  13.305
  422   1HB   LEU  51          2HB       LEU  51 -21.524 -10.068  14.208
  423   2HB   LEU  51          1HB       LEU  51 -20.430 -11.449  14.285
  424    HG   LEU  51           HG       LEU  51 -18.825  -9.543  15.337
  425   1HD1  LEU  51          1HD1      LEU  51 -21.630  -8.595  15.588
  426   2HD1  LEU  51          2HD1      LEU  51 -20.126  -7.674  15.589
  427   3HD1  LEU  51          3HD1      LEU  51 -20.650  -8.509  17.052
  428   1HD2  LEU  51          1HD2      LEU  51 -18.958 -10.912  17.138
  429   2HD2  LEU  51          2HD2      LEU  51 -20.158 -11.816  16.216
  430   3HD2  LEU  51          3HD2      LEU  51 -20.675 -10.578  17.361
  431    H    GLN  52           H        GLN  52 -17.221  -9.767  12.642
  432    HA   GLN  52           HA       GLN  52 -17.124 -12.328  11.135
  433   1HB   GLN  52          2HB       GLN  52 -15.919  -9.818  10.923
  434   2HB   GLN  52          1HB       GLN  52 -14.632 -10.856  11.535
  435   1HG   GLN  52          2HG       GLN  52 -14.345 -11.539   9.402
  436   2HG   GLN  52          1HG       GLN  52 -15.863 -12.419   9.591
  437   1HE2  GLN  52          1HE2      GLN  52 -17.810 -10.502   9.513
  438   2HE2  GLN  52          2HE2      GLN  52 -17.736  -9.605   8.075
  Start of MODEL    5
    1   1H    SER   1          1H        SER   1 -28.932  17.761 -20.747
    2   2H    SER   1          2H        SER   1 -28.135  16.289 -21.036
    3   3H    SER   1          3H        SER   1 -27.272  17.751 -21.095
    4    HA   SER   1           HA       SER   1 -28.260  17.877 -18.606
    5   1HB   SER   1          2HB       SER   1 -29.265  15.805 -18.426
    6   2HB   SER   1          1HB       SER   1 -28.199  15.072 -19.621
    7    HG   SER   1           HG       SER   1 -27.882  14.457 -17.341
    8    H    ILE   2           H        ILE   2 -25.815  16.312 -20.643
    9    HA   ILE   2           HA       ILE   2 -23.455  16.372 -20.514
   10    HB   ILE   2           HB       ILE   2 -24.013  18.683 -18.630
   11   1HG1  ILE   2          2HG1      ILE   2 -23.850  18.746 -21.658
   12   2HG1  ILE   2          1HG1      ILE   2 -25.365  18.782 -20.756
   13   1HG2  ILE   2          1HG2      ILE   2 -21.647  17.563 -19.861
   14   2HG2  ILE   2          2HG2      ILE   2 -21.771  18.881 -18.695
   15   3HG2  ILE   2          3HG2      ILE   2 -21.901  19.216 -20.423
   16   1HD1  ILE   2          1HD1      ILE   2 -23.445  20.734 -19.745
   17   2HD1  ILE   2          2HD1      ILE   2 -25.119  20.968 -20.248
   18   3HD1  ILE   2          3HD1      ILE   2 -23.825  20.998 -21.446
   19    H    SER   3           H        SER   3 -21.670  15.896 -18.987
   20    HA   SER   3           HA       SER   3 -22.472  15.285 -16.191
   21   1HB   SER   3          2HB       SER   3 -21.725  12.948 -16.470
   22   2HB   SER   3          1HB       SER   3 -23.034  13.318 -17.589
   23    HG   SER   3           HG       SER   3 -20.360  12.780 -18.062
   24    HA   PRO   4           HA       PRO   4 -18.311  16.797 -15.816
   25   1HB   PRO   4          2HB       PRO   4 -18.133  16.557 -13.096
   26   2HB   PRO   4          1HB       PRO   4 -19.022  17.869 -13.893
   27   1HG   PRO   4          2HG       PRO   4 -20.048  15.385 -12.627
   28   2HG   PRO   4          1HG       PRO   4 -20.740  17.013 -12.646
   29   1HD   PRO   4          2HD       PRO   4 -21.605  14.959 -14.239
   30   2HD   PRO   4          1HD       PRO   4 -21.794  16.679 -14.640
   31    H    ARG   5           H        ARG   5 -16.212  15.910 -14.968
   32    HA   ARG   5           HA       ARG   5 -16.095  12.992 -15.335
   33   1HB   ARG   5          2HB       ARG   5 -13.638  13.477 -15.210
   34   2HB   ARG   5          1HB       ARG   5 -14.470  14.490 -16.391
   35   1HG   ARG   5          2HG       ARG   5 -13.890  16.362 -15.284
   36   2HG   ARG   5          1HG       ARG   5 -14.548  15.728 -13.775
   37   1HD   ARG   5          2HD       ARG   5 -12.260  15.977 -13.259
   38   2HD   ARG   5          1HD       ARG   5 -12.340  14.275 -13.762
   39    HE   ARG   5           HE       ARG   5 -11.657  16.442 -15.713
   40   1HH1  ARG   5          1HH2      ARG   5 -11.950  13.726 -16.814
   41   2HH1  ARG   5          2HH2      ARG   5 -10.337  13.101 -16.746
   42   1HH2  ARG   5          1HH1      ARG   5  -9.219  15.493 -14.501
   43   2HH2  ARG   5          2HH1      ARG   5  -8.793  14.099 -15.436
   44    H    THR   6           H        THR   6 -17.457  12.855 -13.179
   45    HA   THR   6           HA       THR   6 -15.706  13.080 -10.775
   46    HB   THR   6           HB       THR   6 -18.263  12.297 -10.004
   47    HG1  THR   6           HG1      THR   6 -19.441  13.968 -11.310
   48   1HG2  THR   6          1HG2      THR   6 -18.149  15.152 -10.203
   49   2HG2  THR   6          2HG2      THR   6 -16.538  14.551  -9.805
   50   3HG2  THR   6          3HG2      THR   6 -17.910  14.142  -8.776
   51    HA   PRO   7           HA       PRO   7 -15.165   8.703 -10.938
   52   1HB   PRO   7          2HB       PRO   7 -13.982   8.410  -8.490
   53   2HB   PRO   7          1HB       PRO   7 -13.141   9.038  -9.919
   54   1HG   PRO   7          2HG       PRO   7 -14.235  10.487  -7.582
   55   2HG   PRO   7          1HG       PRO   7 -12.812  10.839  -8.568
   56   1HD   PRO   7          2HD       PRO   7 -15.235  12.152  -8.776
   57   2HD   PRO   7          1HD       PRO   7 -13.995  12.094 -10.045
   58    HA   PRO   8           HA       PRO   8 -17.813   7.784  -7.034
   59   1HB   PRO   8          2HB       PRO   8 -19.537   9.751  -6.235
   60   2HB   PRO   8          1HB       PRO   8 -17.911   9.547  -5.554
   61   1HG   PRO   8          2HG       PRO   8 -18.890  11.492  -7.568
   62   2HG   PRO   8          1HG       PRO   8 -17.684  11.696  -6.289
   63   1HD   PRO   8          2HD       PRO   8 -17.085  11.321  -8.931
   64   2HD   PRO   8          1HD       PRO   8 -15.990  10.930  -7.594
   65    H    ASN   9           H        ASN   9 -18.771   6.547  -8.755
   66    HA   ASN   9           HA       ASN   9 -21.339   7.653  -9.888
   67   1HB   ASN   9          2HB       ASN   9 -20.925   6.197 -11.753
   68   2HB   ASN   9          1HB       ASN   9 -19.394   7.010 -11.420
   69   1HD2  ASN   9          1HD2      ASN   9 -17.761   5.736 -10.126
   70   2HD2  ASN   9          2HD2      ASN   9 -17.789   4.041 -10.208
   71    H    CYS  10           H        CYS  10 -23.074   6.026 -10.039
   72    HA   CYS  10           HA       CYS  10 -23.375   4.483  -7.605
   73   1HB   CYS  10          2HB       CYS  10 -25.250   5.544  -8.818
   74   2HB   CYS  10          1HB       CYS  10 -24.905   4.576 -10.216
   75    H    ALA  11           H        ALA  11 -22.680   2.358  -7.293
   76    HA   ALA  11           HA       ALA  11 -21.463   0.973  -9.553
   77   1HB   ALA  11          1HB       ALA  11 -21.636   0.684  -6.608
   78   2HB   ALA  11          2HB       ALA  11 -20.233   0.545  -7.668
   79   3HB   ALA  11          3HB       ALA  11 -21.362  -0.802  -7.516
   80    H    ARG  12           H        ARG  12 -24.513   0.914  -7.929
   81    HA   ARG  12           HA       ARG  12 -25.420  -1.732  -8.493
   82   1HB   ARG  12          2HB       ARG  12 -26.476   0.111  -7.116
   83   2HB   ARG  12          1HB       ARG  12 -26.921   0.901  -8.621
   84   1HG   ARG  12          2HG       ARG  12 -28.807  -0.313  -8.528
   85   2HG   ARG  12          1HG       ARG  12 -27.801  -1.679  -9.015
   86   1HD   ARG  12          2HD       ARG  12 -29.096  -2.245  -6.979
   87   2HD   ARG  12          1HD       ARG  12 -27.364  -2.169  -6.595
   88    HE   ARG  12           HE       ARG  12 -29.191   0.162  -6.143
   89   1HH1  ARG  12          1HH2      ARG  12 -28.600  -1.909  -3.945
   90   2HH1  ARG  12          2HH2      ARG  12 -27.355  -1.088  -3.063
   91   1HH2  ARG  12          1HH1      ARG  12 -26.727   1.217  -5.578
   92   2HH2  ARG  12          2HH1      ARG  12 -26.294   0.682  -3.988
   93    H    CYS  13           H        CYS  13 -25.654   1.239 -10.385
   94    HA   CYS  13           HA       CYS  13 -26.754  -0.237 -12.649
   95   1HB   CYS  13          2HB       CYS  13 -26.846   2.077 -13.627
   96   2HB   CYS  13          1HB       CYS  13 -27.564   1.977 -12.038
   97    H    ARG  14           H        ARG  14 -23.437   0.751 -11.764
   98    HA   ARG  14           HA       ARG  14 -22.443   0.764 -14.498
   99   1HB   ARG  14          2HB       ARG  14 -20.236   0.267 -13.373
  100   2HB   ARG  14          1HB       ARG  14 -21.084   1.659 -12.704
  101   1HG   ARG  14          2HG       ARG  14 -20.307   0.358 -10.844
  102   2HG   ARG  14          1HG       ARG  14 -22.035   0.121 -10.965
  103   1HD   ARG  14          2HD       ARG  14 -21.776  -2.104 -11.173
  104   2HD   ARG  14          1HD       ARG  14 -20.649  -1.884 -12.527
  105    HE   ARG  14           HE       ARG  14 -19.204  -1.125 -10.258
  106   1HH1  ARG  14          1HH2      ARG  14 -20.909  -3.291  -8.977
  107   2HH1  ARG  14          2HH2      ARG  14 -19.901  -4.684  -9.183
  108   1HH2  ARG  14          1HH1      ARG  14 -17.881  -3.193 -11.577
  109   2HH2  ARG  14          2HH1      ARG  14 -18.188  -4.629 -10.658
  110    H    ASN  15           H        ASN  15 -23.282  -1.732 -12.260
  111    HA   ASN  15           HA       ASN  15 -21.856  -3.967 -13.012
  112   1HB   ASN  15          2HB       ASN  15 -24.763  -3.473 -12.377
  113   2HB   ASN  15          1HB       ASN  15 -24.115  -5.102 -12.508
  114   1HD2  ASN  15          1HD2      ASN  15 -24.876  -2.878 -10.265
  115   2HD2  ASN  15          2HD2      ASN  15 -23.656  -3.126  -9.116
  116    H    HIS  16           H        HIS  16 -24.487  -2.406 -14.676
  117    HA   HIS  16           HA       HIS  16 -24.420  -4.400 -16.875
  118   1HB   HIS  16          2HB       HIS  16 -26.282  -2.154 -16.064
  119   2HB   HIS  16          1HB       HIS  16 -26.589  -3.292 -17.358
  120    HD1  HIS  16           HD1      HIS  16 -27.306  -5.661 -16.769
  121    HD2  HIS  16           HD2      HIS  16 -26.166  -3.382 -13.471
  122    HE1  HIS  16           HE1      HIS  16 -27.844  -7.056 -14.710
  123    H    GLY  17           H        GLY  17 -23.203  -1.280 -16.135
  124   1HA   GLY  17          2HA       GLY  17 -21.565  -0.424 -17.844
  125   2HA   GLY  17          1HA       GLY  17 -22.792  -0.781 -19.062
  126    H    LEU  18           H        LEU  18 -23.596   0.555 -15.949
  127    HA   LEU  18           HA       LEU  18 -24.572   3.018 -17.318
  128   1HB   LEU  18          2HB       LEU  18 -25.750   1.185 -15.655
  129   2HB   LEU  18          1HB       LEU  18 -25.262   2.430 -14.505
  130    HG   LEU  18           HG       LEU  18 -27.509   2.913 -15.297
  131   1HD1  LEU  18          1HD1      LEU  18 -25.476   4.673 -15.213
  132   2HD1  LEU  18          2HD1      LEU  18 -27.130   5.141 -15.608
  133   3HD1  LEU  18          3HD1      LEU  18 -25.958   4.867 -16.898
  134   1HD2  LEU  18          1HD2      LEU  18 -27.778   1.875 -17.367
  135   2HD2  LEU  18          2HD2      LEU  18 -26.218   2.438 -17.967
  136   3HD2  LEU  18          3HD2      LEU  18 -27.578   3.556 -17.864
  137    H    LYS  19           H        LYS  19 -24.068   5.071 -16.385
  138    HA   LYS  19           HA       LYS  19 -22.134   5.233 -14.160
  139   1HB   LYS  19          2HB       LYS  19 -21.591   5.742 -17.062
  140   2HB   LYS  19          1HB       LYS  19 -20.833   6.816 -15.886
  141   1HG   LYS  19          2HG       LYS  19 -20.675   3.796 -15.718
  142   2HG   LYS  19          1HG       LYS  19 -19.448   4.787 -16.506
  143   1HD   LYS  19          2HD       LYS  19 -20.200   5.702 -13.803
  144   2HD   LYS  19          1HD       LYS  19 -19.416   4.122 -13.848
  145   1HE   LYS  19          2HE       LYS  19 -17.402   5.076 -14.259
  146   2HE   LYS  19          1HE       LYS  19 -18.067   5.985 -15.632
  147   1HZ   LYS  19          1HZ       LYS  19 -17.646   7.693 -14.193
  148   2HZ   LYS  19          2HZ       LYS  19 -17.903   6.749 -12.804
  149   3HZ   LYS  19          3HZ       LYS  19 -19.226   7.307 -13.711
  150    H    ILE  20           H        ILE  20 -23.815   6.359 -13.117
  151    HA   ILE  20           HA       ILE  20 -24.830   8.848 -14.390
  152    HB   ILE  20           HB       ILE  20 -26.780   8.317 -13.333
  153   1HG1  ILE  20          2HG1      ILE  20 -25.485   8.858 -11.091
  154   2HG1  ILE  20          1HG1      ILE  20 -27.079   8.161 -11.118
  155   1HG2  ILE  20          1HG2      ILE  20 -27.161   5.997 -12.950
  156   2HG2  ILE  20          2HG2      ILE  20 -25.439   5.711 -12.714
  157   3HG2  ILE  20          3HG2      ILE  20 -26.045   6.173 -14.299
  158   1HD1  ILE  20          1HD1      ILE  20 -25.589   6.931  -9.633
  159   2HD1  ILE  20          2HD1      ILE  20 -24.526   6.592 -10.988
  160   3HD1  ILE  20          3HD1      ILE  20 -26.152   5.922 -10.954
  161    H    THR  21           H        THR  21 -22.441   7.923 -12.194
  162    HA   THR  21           HA       THR  21 -21.005   9.326 -10.874
  163    HB   THR  21           HB       THR  21 -23.027  11.528 -11.162
  164    HG1  THR  21           HG1      THR  21 -21.615  11.907 -13.164
  165   1HG2  THR  21          1HG2      THR  21 -20.805  11.647  -9.845
  166   2HG2  THR  21          2HG2      THR  21 -21.157  12.953 -10.977
  167   3HG2  THR  21          3HG2      THR  21 -20.028  11.675 -11.428
  168    H    LEU  22           H        LEU  22 -23.978   8.239 -10.245
  169    HA   LEU  22           HA       LEU  22 -25.375   8.010  -8.340
  170   1HB   LEU  22          2HB       LEU  22 -23.478   6.739  -7.658
  171   2HB   LEU  22          1HB       LEU  22 -22.537   8.189  -7.315
  172    HG   LEU  22           HG       LEU  22 -23.840   8.694  -5.379
  173   1HD1  LEU  22          1HD1      LEU  22 -26.072   8.349  -5.570
  174   2HD1  LEU  22          2HD1      LEU  22 -25.743   6.686  -5.085
  175   3HD1  LEU  22          3HD1      LEU  22 -25.847   7.100  -6.795
  176   1HD2  LEU  22          1HD2      LEU  22 -23.961   6.218  -4.325
  177   2HD2  LEU  22          2HD2      LEU  22 -22.434   7.064  -4.572
  178   3HD2  LEU  22          3HD2      LEU  22 -22.979   5.867  -5.748
  179    H    LYS  23           H        LYS  23 -24.603  10.882  -9.275
  180    HA   LYS  23           HA       LYS  23 -24.671  12.456  -6.809
  181   1HB   LYS  23          2HB       LYS  23 -24.678  12.879  -9.769
  182   2HB   LYS  23          1HB       LYS  23 -25.297  14.195  -8.772
  183   1HG   LYS  23          2HG       LYS  23 -22.783  13.006  -7.787
  184   2HG   LYS  23          1HG       LYS  23 -22.646  13.814  -9.351
  185   1HD   LYS  23          2HD       LYS  23 -22.843  15.854  -8.411
  186   2HD   LYS  23          1HD       LYS  23 -24.258  15.361  -7.481
  187   1HE   LYS  23          2HE       LYS  23 -22.925  14.527  -5.690
  188   2HE   LYS  23          1HE       LYS  23 -21.451  14.547  -6.679
  189   1HZ   LYS  23          1HZ       LYS  23 -21.494  16.894  -6.785
  190   2HZ   LYS  23          2HZ       LYS  23 -21.734  16.503  -5.150
  191   3HZ   LYS  23          3HZ       LYS  23 -23.049  16.980  -6.113
  192    H    GLY  24           H        GLY  24 -26.605  12.342  -5.617
  193   1HA   GLY  24          2HA       GLY  24 -28.937  12.232  -5.213
  194   2HA   GLY  24          1HA       GLY  24 -29.047  13.406  -6.535
  195    H    HIS  25           H        HIS  25 -28.167   9.968  -6.270
  196    HA   HIS  25           HA       HIS  25 -29.913   9.410  -8.644
  197   1HB   HIS  25          2HB       HIS  25 -27.518   9.297  -9.026
  198   2HB   HIS  25          1HB       HIS  25 -27.303   8.266  -7.619
  199    HD1  HIS  25           HD1      HIS  25 -29.333   8.127 -10.868
  200    HD2  HIS  25           HD2      HIS  25 -27.045   5.658  -8.423
  201    HE1  HIS  25           HE1      HIS  25 -29.029   5.921 -12.082
  202    H    LYS  26           H        LYS  26 -28.441   6.732  -7.095
  203    HA   LYS  26           HA       LYS  26 -29.382   4.858  -6.069
  204   1HB   LYS  26          2HB       LYS  26 -29.361   7.026  -4.424
  205   2HB   LYS  26          1HB       LYS  26 -31.070   6.606  -4.361
  206   1HG   LYS  26          2HG       LYS  26 -30.441   4.256  -3.818
  207   2HG   LYS  26          1HG       LYS  26 -28.749   4.753  -3.771
  208   1HD   LYS  26          2HD       LYS  26 -30.680   6.332  -2.135
  209   2HD   LYS  26          1HD       LYS  26 -30.270   4.715  -1.564
  210   1HE   LYS  26          2HE       LYS  26 -27.785   5.580  -2.146
  211   2HE   LYS  26          1HE       LYS  26 -28.545   7.136  -1.761
  212   1HZ   LYS  26          1HZ       LYS  26 -28.868   4.715  -0.078
  213   2HZ   LYS  26          2HZ       LYS  26 -29.300   6.313   0.307
  214   3HZ   LYS  26          3HZ       LYS  26 -27.662   5.874   0.205
  215    H    ARG  27           H        ARG  27 -32.282   6.903  -5.602
  216    HA   ARG  27           HA       ARG  27 -34.069   4.862  -6.517
  217   1HB   ARG  27          2HB       ARG  27 -34.783   6.638  -5.038
  218   2HB   ARG  27          1HB       ARG  27 -34.286   7.872  -6.197
  219   1HG   ARG  27          2HG       ARG  27 -36.132   7.563  -7.528
  220   2HG   ARG  27          1HG       ARG  27 -36.238   5.841  -7.159
  221   1HD   ARG  27          2HD       ARG  27 -36.767   7.791  -4.940
  222   2HD   ARG  27          1HD       ARG  27 -38.032   7.520  -6.156
  223    HE   ARG  27           HE       ARG  27 -37.149   5.577  -4.179
  224   1HH1  ARG  27          1HH2      ARG  27 -39.813   6.016  -5.802
  225   2HH1  ARG  27          2HH2      ARG  27 -39.916   4.479  -6.595
  226   1HH2  ARG  27          1HH1      ARG  27 -36.644   3.589  -5.870
  227   2HH2  ARG  27          2HH1      ARG  27 -38.123   3.105  -6.630
  228    H    TYR  28           H        TYR  28 -32.148   7.220  -8.173
  229    HA   TYR  28           HA       TYR  28 -33.709   7.116 -10.678
  230   1HB   TYR  28          2HB       TYR  28 -31.115   8.395  -9.764
  231   2HB   TYR  28          1HB       TYR  28 -31.738   8.563 -11.408
  232    HD1  TYR  28           HD1      TYR  28 -31.700  10.057  -8.235
  233    HD2  TYR  28           HD2      TYR  28 -34.348   9.201 -11.507
  234    HE1  TYR  28           HE1      TYR  28 -33.211  11.878  -7.490
  235    HE2  TYR  28           HE2      TYR  28 -35.858  11.022 -10.761
  236    HH   TYR  28           HH       TYR  28 -35.412  13.296  -9.298
  237    H    CYS  29           H        CYS  29 -31.888   4.875  -9.235
  238    HA   CYS  29           HA       CYS  29 -29.909   4.219 -11.252
  239   1HB   CYS  29          2HB       CYS  29 -30.086   3.606  -8.710
  240   2HB   CYS  29          1HB       CYS  29 -31.123   2.305  -9.274
  241    H    LYS  30           H        LYS  30 -29.983   2.578 -12.784
  242    HA   LYS  30           HA       LYS  30 -32.712   1.678 -13.610
  243   1HB   LYS  30          2HB       LYS  30 -30.089   2.227 -14.854
  244   2HB   LYS  30          1HB       LYS  30 -30.842   0.744 -15.439
  245   1HG   LYS  30          2HG       LYS  30 -32.984   2.419 -15.461
  246   2HG   LYS  30          1HG       LYS  30 -31.684   3.559 -15.807
  247   1HD   LYS  30          2HD       LYS  30 -31.298   2.681 -17.867
  248   2HD   LYS  30          1HD       LYS  30 -31.494   1.023 -17.298
  249   1HE   LYS  30          2HE       LYS  30 -33.292   1.739 -18.920
  250   2HE   LYS  30          1HE       LYS  30 -33.938   1.266 -17.336
  251   1HZ   LYS  30          1HZ       LYS  30 -33.085   4.043 -17.726
  252   2HZ   LYS  30          2HZ       LYS  30 -34.310   3.420 -16.728
  253   3HZ   LYS  30          3HZ       LYS  30 -34.566   3.568 -18.401
  254    H    PHE  31           H        PHE  31 -30.510   0.812 -11.452
  255    HA   PHE  31           HA       PHE  31 -30.942  -2.125 -11.699
  256   1HB   PHE  31          2HB       PHE  31 -28.329  -0.636 -11.201
  257   2HB   PHE  31          1HB       PHE  31 -28.481  -2.394 -11.323
  258    HD1  PHE  31           HD1      PHE  31 -28.665   0.803 -13.154
  259    HD2  PHE  31           HD2      PHE  31 -28.906  -3.469 -13.452
  260    HE1  PHE  31           HE1      PHE  31 -28.567   0.977 -15.612
  261    HE2  PHE  31           HE2      PHE  31 -28.803  -3.304 -15.913
  262    HZ   PHE  31           HZ       PHE  31 -28.630  -1.079 -17.009
  263    H    ARG  32           H        ARG  32 -31.563   0.495  -9.971
  264    HA   ARG  32           HA       ARG  32 -30.550   0.345  -7.392
  265   1HB   ARG  32          2HB       ARG  32 -33.121   0.999  -6.867
  266   2HB   ARG  32          1HB       ARG  32 -31.970   2.123  -7.573
  267   1HG   ARG  32          2HG       ARG  32 -34.245   1.954  -8.727
  268   2HG   ARG  32          1HG       ARG  32 -32.836   1.790  -9.758
  269   1HD   ARG  32          2HD       ARG  32 -33.201  -0.482 -10.134
  270   2HD   ARG  32          1HD       ARG  32 -34.063  -0.688  -8.598
  271    HE   ARG  32           HE       ARG  32 -35.872   0.796  -9.674
  272   1HH1  ARG  32          1HH2      ARG  32 -34.821  -2.093 -10.838
  273   2HH1  ARG  32          2HH2      ARG  32 -35.365  -1.875 -12.468
  274   1HH2  ARG  32          1HH1      ARG  32 -36.090   1.492 -12.056
  275   2HH2  ARG  32          2HH1      ARG  32 -36.082   0.155 -13.157
  276    H    TYR  33           H        TYR  33 -32.623  -1.926  -8.968
  277    HA   TYR  33           HA       TYR  33 -32.896  -3.425  -6.381
  278   1HB   TYR  33          2HB       TYR  33 -34.916  -2.930  -8.586
  279   2HB   TYR  33          1HB       TYR  33 -35.169  -4.074  -7.267
  280    HD1  TYR  33           HD1      TYR  33 -36.294  -1.077  -8.206
  281    HD2  TYR  33           HD2      TYR  33 -34.060  -2.751  -4.943
  282    HE1  TYR  33           HE1      TYR  33 -37.043   0.779  -6.742
  283    HE2  TYR  33           HE2      TYR  33 -34.807  -0.895  -3.477
  284    HH   TYR  33           HH       TYR  33 -37.134   0.780  -3.682
  285    H    CYS  34           H        CYS  34 -31.645  -3.474  -9.482
  286    HA   CYS  34           HA       CYS  34 -32.209  -5.941 -10.636
  287   1HB   CYS  34          2HB       CYS  34 -30.585  -4.203 -11.452
  288   2HB   CYS  34          1HB       CYS  34 -29.480  -4.711 -10.172
  289    H    THR  35           H        THR  35 -30.774  -7.992 -10.452
  290    HA   THR  35           HA       THR  35 -29.881  -8.470  -7.638
  291    HB   THR  35           HB       THR  35 -31.134 -10.667  -7.816
  292    HG1  THR  35           HG1      THR  35 -31.264 -10.116 -10.269
  293   1HG2  THR  35          1HG2      THR  35 -33.254  -9.698  -7.239
  294   2HG2  THR  35          2HG2      THR  35 -32.905  -8.239  -8.166
  295   3HG2  THR  35          3HG2      THR  35 -32.012  -8.575  -6.683
  296    H    CYS  36           H        CYS  36 -28.897  -8.460 -10.763
  297    HA   CYS  36           HA       CYS  36 -27.791 -10.977 -11.343
  298   1HB   CYS  36          2HB       CYS  36 -26.279  -9.741 -12.753
  299   2HB   CYS  36          1HB       CYS  36 -27.809  -8.864 -12.729
  300    H    GLU  37           H        GLU  37 -25.127 -11.161 -11.241
  301    HA   GLU  37           HA       GLU  37 -24.543 -11.330  -8.359
  302   1HB   GLU  37          2HB       GLU  37 -22.750 -12.731  -9.084
  303   2HB   GLU  37          1HB       GLU  37 -24.085 -13.062 -10.189
  304   1HG   GLU  37          2HG       GLU  37 -22.941 -11.044 -11.537
  305   2HG   GLU  37          1HG       GLU  37 -21.513 -11.645 -10.696
  306    H    LYS  38           H        LYS  38 -24.162  -8.882 -10.596
  307    HA   LYS  38           HA       LYS  38 -21.577  -7.905  -9.448
  308   1HB   LYS  38          2HB       LYS  38 -22.673  -7.990 -12.016
  309   2HB   LYS  38          1HB       LYS  38 -22.918  -6.314 -11.523
  310   1HG   LYS  38          2HG       LYS  38 -20.736  -5.864 -11.825
  311   2HG   LYS  38          1HG       LYS  38 -20.285  -7.170 -10.727
  312   1HD   LYS  38          2HD       LYS  38 -21.065  -8.559 -12.970
  313   2HD   LYS  38          1HD       LYS  38 -20.312  -7.126 -13.670
  314   1HE   LYS  38          2HE       LYS  38 -18.944  -8.657 -11.452
  315   2HE   LYS  38          1HE       LYS  38 -18.755  -9.131 -13.151
  316   1HZ   LYS  38          1HZ       LYS  38 -17.194  -7.329 -12.120
  317   2HZ   LYS  38          2HZ       LYS  38 -18.508  -6.296 -12.425
  318   3HZ   LYS  38          3HZ       LYS  38 -17.780  -7.148 -13.702
  319    H    CYS  39           H        CYS  39 -24.973  -7.535  -9.355
  320    HA   CYS  39           HA       CYS  39 -24.952  -4.801  -8.250
  321   1HB   CYS  39          2HB       CYS  39 -26.856  -6.841  -9.267
  322   2HB   CYS  39          1HB       CYS  39 -27.467  -5.831  -7.970
  323    H    ARG  40           H        ARG  40 -25.466  -8.186  -7.320
  324    HA   ARG  40           HA       ARG  40 -26.015  -7.611  -4.512
  325   1HB   ARG  40          2HB       ARG  40 -25.504  -9.995  -6.271
  326   2HB   ARG  40          1HB       ARG  40 -25.428 -10.201  -4.520
  327   1HG   ARG  40          2HG       ARG  40 -27.690  -9.544  -4.234
  328   2HG   ARG  40          1HG       ARG  40 -27.778  -8.856  -5.856
  329   1HD   ARG  40          2HD       ARG  40 -28.934 -11.021  -5.839
  330   2HD   ARG  40          1HD       ARG  40 -27.442 -11.177  -6.787
  331    HE   ARG  40           HE       ARG  40 -26.498 -11.856  -4.368
  332   1HH1  ARG  40          1HH2      ARG  40 -29.604 -12.183  -3.871
  333   2HH1  ARG  40          2HH2      ARG  40 -29.714 -13.910  -3.957
  334   1HH2  ARG  40          1HH1      ARG  40 -26.573 -14.306  -5.367
  335   2HH2  ARG  40          2HH1      ARG  40 -27.999 -15.111  -4.802
  336    H    LEU  41           H        LEU  41 -23.268  -8.341  -6.541
  337    HA   LEU  41           HA       LEU  41 -21.347  -8.831  -4.424
  338   1HB   LEU  41          2HB       LEU  41 -20.757  -9.710  -6.503
  339   2HB   LEU  41          1HB       LEU  41 -21.395  -8.320  -7.375
  340    HG   LEU  41           HG       LEU  41 -19.510  -6.975  -6.802
  341   1HD1  LEU  41          1HD1      LEU  41 -19.395  -8.671  -4.531
  342   2HD1  LEU  41          2HD1      LEU  41 -18.387  -7.264  -4.865
  343   3HD1  LEU  41          3HD1      LEU  41 -17.862  -8.868  -5.377
  344   1HD2  LEU  41          1HD2      LEU  41 -18.854  -9.781  -7.679
  345   2HD2  LEU  41          2HD2      LEU  41 -17.577  -8.576  -7.517
  346   3HD2  LEU  41          3HD2      LEU  41 -18.907  -8.306  -8.643
  347    H    THR  42           H        THR  42 -22.676  -6.029  -5.997
  348    HA   THR  42           HA       THR  42 -20.602  -4.164  -5.118
  349    HB   THR  42           HB       THR  42 -23.374  -3.936  -6.288
  350    HG1  THR  42           HG1      THR  42 -20.753  -3.949  -7.220
  351   1HG2  THR  42          1HG2      THR  42 -22.835  -1.973  -4.850
  352   2HG2  THR  42          2HG2      THR  42 -22.954  -1.547  -6.557
  353   3HG2  THR  42          3HG2      THR  42 -21.371  -1.716  -5.798
  354    H    ALA  43           H        ALA  43 -24.076  -4.353  -4.383
  355    HA   ALA  43           HA       ALA  43 -24.244  -2.717  -2.150
  356   1HB   ALA  43          1HB       ALA  43 -25.565  -5.223  -3.090
  357   2HB   ALA  43          2HB       ALA  43 -26.278  -3.647  -2.743
  358   3HB   ALA  43          3HB       ALA  43 -25.880  -4.746  -1.422
  359    H    ASP  44           H        ASP  44 -22.787  -5.874  -2.451
  360    HA   ASP  44           HA       ASP  44 -22.417  -6.409   0.376
  361   1HB   ASP  44          2HB       ASP  44 -22.433  -7.965  -1.695
  362   2HB   ASP  44          1HB       ASP  44 -20.777  -7.418  -1.958
  363    H    ARG  45           H        ARG  45 -20.262  -5.278  -2.250
  364    HA   ARG  45           HA       ARG  45 -17.939  -4.799  -0.679
  365   1HB   ARG  45          2HB       ARG  45 -18.589  -4.708  -3.289
  366   2HB   ARG  45          1HB       ARG  45 -18.651  -2.980  -2.941
  367   1HG   ARG  45          2HG       ARG  45 -16.387  -2.887  -2.332
  368   2HG   ARG  45          1HG       ARG  45 -16.299  -4.623  -2.027
  369   1HD   ARG  45          2HD       ARG  45 -17.006  -3.826  -4.808
  370   2HD   ARG  45          1HD       ARG  45 -15.336  -3.516  -4.296
  371    HE   ARG  45           HE       ARG  45 -16.612  -6.201  -3.928
  372   1HH1  ARG  45          1HH2      ARG  45 -15.222  -5.865  -6.528
  373   2HH1  ARG  45          2HH2      ARG  45 -13.610  -6.385  -6.167
  374   1HH2  ARG  45          1HH1      ARG  45 -14.013  -6.130  -2.733
  375   2HH2  ARG  45          2HH1      ARG  45 -12.927  -6.538  -4.019
  376    H    GLN  46           H        GLN  46 -20.958  -3.134  -0.763
  377    HA   GLN  46           HA       GLN  46 -19.798  -0.634   0.364
  378   1HB   GLN  46          2HB       GLN  46 -21.703  -1.066  -1.491
  379   2HB   GLN  46          1HB       GLN  46 -22.721  -1.051  -0.051
  380   1HG   GLN  46          2HG       GLN  46 -22.701   1.207  -0.381
  381   2HG   GLN  46          1HG       GLN  46 -21.146   1.106   0.446
  382   1HE2  GLN  46          1HE2      GLN  46 -19.224   0.595  -1.146
  383   2HE2  GLN  46          2HE2      GLN  46 -19.257   1.409  -2.635
  384    H    ARG  47           H        ARG  47 -20.442  -3.503   1.668
  385    HA   ARG  47           HA       ARG  47 -22.383  -3.301   3.660
  386   1HB   ARG  47          2HB       ARG  47 -19.973  -4.785   3.094
  387   2HB   ARG  47          1HB       ARG  47 -20.067  -4.454   4.824
  388   1HG   ARG  47          2HG       ARG  47 -22.446  -5.292   4.773
  389   2HG   ARG  47          1HG       ARG  47 -22.170  -5.798   3.106
  390   1HD   ARG  47          2HD       ARG  47 -19.973  -6.809   4.566
  391   2HD   ARG  47          1HD       ARG  47 -21.412  -7.161   5.544
  392    HE   ARG  47           HE       ARG  47 -21.274  -7.838   2.628
  393   1HH1  ARG  47          1HH2      ARG  47 -23.911  -8.175   3.897
  394   2HH1  ARG  47          2HH2      ARG  47 -23.880  -9.822   4.432
  395   1HH2  ARG  47          1HH1      ARG  47 -20.433 -10.114   4.191
  396   2HH2  ARG  47          2HH1      ARG  47 -21.910 -10.919   4.601
  397    H    VAL  48           H        VAL  48 -21.986  -2.847   6.056
  398    HA   VAL  48           HA       VAL  48 -20.096  -0.550   6.436
  399    HB   VAL  48           HB       VAL  48 -22.428   0.192   6.059
  400   1HG1  VAL  48          1HG1      VAL  48 -23.074  -2.131   7.438
  401   2HG1  VAL  48          2HG1      VAL  48 -24.204  -0.853   6.990
  402   3HG1  VAL  48          3HG1      VAL  48 -23.461  -0.853   8.590
  403   1HG2  VAL  48          1HG2      VAL  48 -21.471   1.741   7.471
  404   2HG2  VAL  48          2HG2      VAL  48 -21.045   0.529   8.680
  405   3HG2  VAL  48          3HG2      VAL  48 -22.703   1.120   8.569
  406    H    MET  49           H        MET  49 -18.604  -1.779   7.677
  407    HA   MET  49           HA       MET  49 -19.688  -2.930  10.230
  408   1HB   MET  49          2HB       MET  49 -18.733  -4.461   8.388
  409   2HB   MET  49          1HB       MET  49 -17.163  -3.768   8.795
  410   1HG   MET  49          2HG       MET  49 -17.029  -4.911  10.752
  411   2HG   MET  49          1HG       MET  49 -18.732  -4.649  11.128
  412   1HE   MET  49          1HE       MET  49 -20.494  -5.507   9.435
  413   2HE   MET  49          2HE       MET  49 -20.581  -6.566  10.840
  414   3HE   MET  49          3HE       MET  49 -20.647  -7.257   9.221
  415    H    ALA  50           H        ALA  50 -18.580  -0.162   9.522
  416    HA   ALA  50           HA       ALA  50 -16.290  -0.155  11.464
  417   1HB   ALA  50          1HB       ALA  50 -15.226   0.757   9.681
  418   2HB   ALA  50          2HB       ALA  50 -16.207   2.195   9.969
  419   3HB   ALA  50          3HB       ALA  50 -16.741   0.982   8.806
  420    H    LEU  51           H        LEU  51 -19.434   1.103  10.668
  421    HA   LEU  51           HA       LEU  51 -19.390   2.715  13.182
  422   1HB   LEU  51          2HB       LEU  51 -18.859   4.183  11.271
  423   2HB   LEU  51          1HB       LEU  51 -20.317   3.638  10.442
  424    HG   LEU  51           HG       LEU  51 -21.474   4.406  12.709
  425   1HD1  LEU  51          1HD1      LEU  51 -20.381   6.289  13.741
  426   2HD1  LEU  51          2HD1      LEU  51 -19.103   6.282  12.525
  427   3HD1  LEU  51          3HD1      LEU  51 -19.211   4.970  13.698
  428   1HD2  LEU  51          1HD2      LEU  51 -21.953   6.548  11.643
  429   2HD2  LEU  51          2HD2      LEU  51 -21.877   5.296  10.404
  430   3HD2  LEU  51          3HD2      LEU  51 -20.519   6.397  10.628
  431    H    GLN  52           H        GLN  52 -21.294   2.474  14.330
  432    HA   GLN  52           HA       GLN  52 -23.625   1.234  12.902
  433   1HB   GLN  52          2HB       GLN  52 -22.314   0.637  15.559
  434   2HB   GLN  52          1HB       GLN  52 -23.959   0.108  15.202
  435   1HG   GLN  52          2HG       GLN  52 -22.346  -0.553  12.950
  436   2HG   GLN  52          1HG       GLN  52 -21.492  -1.104  14.392
  437   1HE2  GLN  52          1HE2      GLN  52 -23.535  -1.884  16.093
  438   2HE2  GLN  52          2HE2      GLN  52 -24.458  -3.121  15.384
  Start of MODEL    6
    1   1H    SER   1          1H        SER   1 -13.740   8.963   2.252
    2   2H    SER   1          2H        SER   1 -14.836   8.763   0.970
    3   3H    SER   1          3H        SER   1 -15.158   9.892   2.199
    4    HA   SER   1           HA       SER   1 -12.846  10.869   1.403
    5   1HB   SER   1          2HB       SER   1 -12.687   8.894  -0.160
    6   2HB   SER   1          1HB       SER   1 -14.075   9.537  -1.031
    7    HG   SER   1           HG       SER   1 -12.783  10.893  -1.967
    8    H    ILE   2           H        ILE   2 -14.023  12.735   2.039
    9    HA   ILE   2           HA       ILE   2 -16.561  13.516   0.929
   10    HB   ILE   2           HB       ILE   2 -14.318  15.084   2.244
   11   1HG1  ILE   2          2HG1      ILE   2 -15.343  13.124   3.507
   12   2HG1  ILE   2          1HG1      ILE   2 -15.485  14.690   4.306
   13   1HG2  ILE   2          1HG2      ILE   2 -16.301  16.593   2.879
   14   2HG2  ILE   2          2HG2      ILE   2 -17.193  15.762   1.605
   15   3HG2  ILE   2          3HG2      ILE   2 -15.742  16.683   1.208
   16   1HD1  ILE   2          1HD1      ILE   2 -17.645  13.489   2.552
   17   2HD1  ILE   2          2HD1      ILE   2 -17.771  14.940   3.546
   18   3HD1  ILE   2          3HD1      ILE   2 -17.619  13.358   4.310
   19    H    SER   3           H        SER   3 -13.215  14.052  -0.060
   20    HA   SER   3           HA       SER   3 -14.236  15.519  -2.473
   21   1HB   SER   3          2HB       SER   3 -13.079  16.959  -0.802
   22   2HB   SER   3          1HB       SER   3 -11.659  15.923  -0.916
   23    HG   SER   3           HG       SER   3 -11.539  16.471  -3.126
   24    HA   PRO   4           HA       PRO   4 -11.852  11.759  -3.719
   25   1HB   PRO   4          2HB       PRO   4 -13.659  10.907  -5.587
   26   2HB   PRO   4          1HB       PRO   4 -13.768  10.473  -3.870
   27   1HG   PRO   4          2HG       PRO   4 -15.284  12.515  -5.406
   28   2HG   PRO   4          1HG       PRO   4 -15.823  11.458  -4.093
   29   1HD   PRO   4          2HD       PRO   4 -15.194  14.111  -3.778
   30   2HD   PRO   4          1HD       PRO   4 -15.128  12.906  -2.475
   31    H    ARG   5           H        ARG   5 -10.544  11.648  -5.595
   32    HA   ARG   5           HA       ARG   5 -10.473  14.051  -7.272
   33   1HB   ARG   5          2HB       ARG   5  -8.836  11.640  -6.692
   34   2HB   ARG   5          1HB       ARG   5  -8.618  12.350  -8.292
   35   1HG   ARG   5          2HG       ARG   5  -7.684  14.270  -7.464
   36   2HG   ARG   5          1HG       ARG   5  -8.688  14.255  -6.012
   37   1HD   ARG   5          2HD       ARG   5  -7.197  12.040  -5.539
   38   2HD   ARG   5          1HD       ARG   5  -6.033  12.998  -6.478
   39    HE   ARG   5           HE       ARG   5  -6.179  14.749  -4.817
   40   1HH1  ARG   5          1HH2      ARG   5  -9.094  14.329  -4.108
   41   2HH1  ARG   5          2HH2      ARG   5  -8.971  13.714  -2.493
   42   1HH2  ARG   5          1HH1      ARG   5  -5.600  12.949  -2.755
   43   2HH2  ARG   5          2HH1      ARG   5  -6.995  12.933  -1.728
   44    H    THR   6           H        THR   6 -12.346  11.317  -7.387
   45    HA   THR   6           HA       THR   6 -12.621  11.519 -10.362
   46    HB   THR   6           HB       THR   6 -12.916   9.009 -10.305
   47    HG1  THR   6           HG1      THR   6 -12.052   9.443  -7.641
   48   1HG2  THR   6          1HG2      THR   6 -10.254   9.331  -9.110
   49   2HG2  THR   6          2HG2      THR   6 -10.608  10.515 -10.368
   50   3HG2  THR   6          3HG2      THR   6 -10.703   8.791 -10.728
   51    HA   PRO   7           HA       PRO   7 -16.924  11.701  -9.533
   52   1HB   PRO   7          2HB       PRO   7 -17.969  10.404 -11.702
   53   2HB   PRO   7          1HB       PRO   7 -17.232  12.015 -11.803
   54   1HG   PRO   7          2HG       PRO   7 -16.107   9.371 -12.550
   55   2HG   PRO   7          1HG       PRO   7 -15.896  10.948 -13.323
   56   1HD   PRO   7          2HD       PRO   7 -14.036   9.767 -11.683
   57   2HD   PRO   7          1HD       PRO   7 -14.154  11.517 -11.968
   58    HA   PRO   8           HA       PRO   8 -17.478   7.690  -7.572
   59   1HB   PRO   8          2HB       PRO   8 -19.386   8.534  -5.803
   60   2HB   PRO   8          1HB       PRO   8 -17.650   8.818  -5.559
   61   1HG   PRO   8          2HG       PRO   8 -19.754  10.678  -6.534
   62   2HG   PRO   8          1HG       PRO   8 -18.356  10.996  -5.494
   63   1HD   PRO   8          2HD       PRO   8 -18.460  11.615  -8.164
   64   2HD   PRO   8          1HD       PRO   8 -16.956  11.326  -7.265
   65    H    ASN   9           H        ASN   9 -18.500   7.183  -9.790
   66    HA   ASN   9           HA       ASN   9 -21.298   7.638 -10.294
   67   1HB   ASN   9          2HB       ASN   9 -20.920   6.150 -12.113
   68   2HB   ASN   9          1HB       ASN   9 -19.384   6.981 -11.868
   69   1HD2  ASN   9          1HD2      ASN   9 -20.644   3.926 -12.360
   70   2HD2  ASN   9          2HD2      ASN   9 -19.420   3.003 -11.631
   71    H    CYS  10           H        CYS  10 -22.961   5.946 -10.315
   72    HA   CYS  10           HA       CYS  10 -23.145   4.541  -7.783
   73   1HB   CYS  10          2HB       CYS  10 -25.119   5.471  -8.911
   74   2HB   CYS  10          1HB       CYS  10 -24.778   4.534 -10.333
   75    H    ALA  11           H        ALA  11 -22.980   2.286  -7.435
   76    HA   ALA  11           HA       ALA  11 -21.480   0.800  -9.493
   77   1HB   ALA  11          1HB       ALA  11 -21.874  -0.905  -7.395
   78   2HB   ALA  11          2HB       ALA  11 -22.005   0.663  -6.598
   79   3HB   ALA  11          3HB       ALA  11 -20.544   0.250  -7.496
   80    H    ARG  12           H        ARG  12 -24.594   0.574  -7.788
   81    HA   ARG  12           HA       ARG  12 -25.576  -1.877  -8.632
   82   1HB   ARG  12          2HB       ARG  12 -26.672  -0.103  -7.249
   83   2HB   ARG  12          1HB       ARG  12 -26.965   0.817  -8.711
   84   1HG   ARG  12          2HG       ARG  12 -28.872  -0.316  -8.973
   85   2HG   ARG  12          1HG       ARG  12 -27.910  -1.766  -9.263
   86   1HD   ARG  12          2HD       ARG  12 -28.066  -1.165  -6.413
   87   2HD   ARG  12          1HD       ARG  12 -29.678  -1.381  -7.121
   88    HE   ARG  12           HE       ARG  12 -28.292  -3.443  -8.259
   89   1HH1  ARG  12          1HH2      ARG  12 -26.564  -2.938  -5.701
   90   2HH1  ARG  12          2HH2      ARG  12 -27.188  -4.186  -4.675
   91   1HH2  ARG  12          1HH1      ARG  12 -29.975  -4.781  -6.653
   92   2HH2  ARG  12          2HH1      ARG  12 -29.123  -5.228  -5.212
   93    H    CYS  13           H        CYS  13 -25.587   1.142 -10.446
   94    HA   CYS  13           HA       CYS  13 -26.531  -0.282 -12.866
   95   1HB   CYS  13          2HB       CYS  13 -26.691   2.035 -13.741
   96   2HB   CYS  13          1HB       CYS  13 -27.399   1.932 -12.149
   97    H    ARG  14           H        ARG  14 -23.480   0.570 -11.464
   98    HA   ARG  14           HA       ARG  14 -21.902   0.905 -13.870
   99   1HB   ARG  14          2HB       ARG  14 -20.403   1.356 -12.236
  100   2HB   ARG  14          1HB       ARG  14 -21.644   0.941 -11.073
  101   1HG   ARG  14          2HG       ARG  14 -19.865  -1.178 -12.311
  102   2HG   ARG  14          1HG       ARG  14 -19.384  -0.300 -10.867
  103   1HD   ARG  14          2HD       ARG  14 -21.322  -1.156  -9.655
  104   2HD   ARG  14          1HD       ARG  14 -21.909  -1.963 -11.114
  105    HE   ARG  14           HE       ARG  14 -20.377  -3.671 -10.604
  106   1HH1  ARG  14          1HH2      ARG  14 -19.578  -0.942  -8.756
  107   2HH1  ARG  14          2HH2      ARG  14 -17.927  -1.400  -8.500
  108   1HH2  ARG  14          1HH1      ARG  14 -18.082  -4.141 -10.619
  109   2HH2  ARG  14          2HH1      ARG  14 -17.081  -3.215  -9.552
  110    H    ASN  15           H        ASN  15 -23.369  -1.799 -12.395
  111    HA   ASN  15           HA       ASN  15 -21.539  -3.876 -13.131
  112   1HB   ASN  15          2HB       ASN  15 -24.454  -3.650 -12.411
  113   2HB   ASN  15          1HB       ASN  15 -23.672  -5.206 -12.635
  114   1HD2  ASN  15          1HD2      ASN  15 -24.298  -2.741 -10.427
  115   2HD2  ASN  15          2HD2      ASN  15 -23.088  -3.055  -9.287
  116    H    HIS  16           H        HIS  16 -24.318  -2.429 -14.706
  117    HA   HIS  16           HA       HIS  16 -24.146  -4.349 -16.955
  118   1HB   HIS  16          2HB       HIS  16 -26.071  -2.128 -16.216
  119   2HB   HIS  16          1HB       HIS  16 -26.324  -3.326 -17.464
  120    HD1  HIS  16           HD1      HIS  16 -27.327  -5.524 -16.781
  121    HD2  HIS  16           HD2      HIS  16 -25.739  -3.391 -13.579
  122    HE1  HIS  16           HE1      HIS  16 -27.909  -6.840 -14.678
  123    H    GLY  17           H        GLY  17 -22.913  -1.287 -16.130
  124   1HA   GLY  17          2HA       GLY  17 -21.294  -0.327 -17.764
  125   2HA   GLY  17          1HA       GLY  17 -22.458  -0.712 -19.034
  126    H    LEU  18           H        LEU  18 -23.334   0.642 -15.918
  127    HA   LEU  18           HA       LEU  18 -24.364   3.050 -17.357
  128   1HB   LEU  18          2HB       LEU  18 -25.534   1.221 -15.680
  129   2HB   LEU  18          1HB       LEU  18 -25.105   2.509 -14.552
  130    HG   LEU  18           HG       LEU  18 -27.356   2.884 -15.453
  131   1HD1  LEU  18          1HD1      LEU  18 -27.033   5.129 -15.674
  132   2HD1  LEU  18          2HD1      LEU  18 -25.824   4.932 -16.943
  133   3HD1  LEU  18          3HD1      LEU  18 -25.372   4.721 -15.252
  134   1HD2  LEU  18          1HD2      LEU  18 -25.991   2.162 -17.940
  135   2HD2  LEU  18          2HD2      LEU  18 -26.943   3.639 -18.101
  136   3HD2  LEU  18          3HD2      LEU  18 -27.715   2.147 -17.563
  137    H    LYS  19           H        LYS  19 -23.945   5.139 -16.432
  138    HA   LYS  19           HA       LYS  19 -22.047   5.357 -14.177
  139   1HB   LYS  19          2HB       LYS  19 -21.100   5.159 -16.739
  140   2HB   LYS  19          1HB       LYS  19 -21.302   6.905 -16.591
  141   1HG   LYS  19          2HG       LYS  19 -19.057   6.288 -15.859
  142   2HG   LYS  19          1HG       LYS  19 -19.993   6.845 -14.472
  143   1HD   LYS  19          2HD       LYS  19 -19.133   4.901 -13.571
  144   2HD   LYS  19          1HD       LYS  19 -20.592   4.241 -14.310
  145   1HE   LYS  19          2HE       LYS  19 -18.466   4.370 -16.277
  146   2HE   LYS  19          1HE       LYS  19 -17.942   3.450 -14.852
  147   1HZ   LYS  19          1HZ       LYS  19 -19.976   2.179 -14.934
  148   2HZ   LYS  19          2HZ       LYS  19 -19.188   2.065 -16.436
  149   3HZ   LYS  19          3HZ       LYS  19 -20.538   3.082 -16.255
  150    H    ILE  20           H        ILE  20 -23.804   6.405 -13.166
  151    HA   ILE  20           HA       ILE  20 -24.840   8.900 -14.413
  152    HB   ILE  20           HB       ILE  20 -26.788   8.348 -13.345
  153   1HG1  ILE  20          2HG1      ILE  20 -25.511   8.808 -11.100
  154   2HG1  ILE  20          1HG1      ILE  20 -27.076   8.054 -11.139
  155   1HG2  ILE  20          1HG2      ILE  20 -26.070   6.253 -14.420
  156   2HG2  ILE  20          2HG2      ILE  20 -27.172   6.015 -13.068
  157   3HG2  ILE  20          3HG2      ILE  20 -25.448   5.716 -12.864
  158   1HD1  ILE  20          1HD1      ILE  20 -25.510   6.824  -9.724
  159   2HD1  ILE  20          2HD1      ILE  20 -24.470   6.568 -11.115
  160   3HD1  ILE  20          3HD1      ILE  20 -26.076   5.848 -11.069
  161    H    THR  21           H        THR  21 -22.449   7.982 -12.231
  162    HA   THR  21           HA       THR  21 -21.028   9.385 -10.904
  163    HB   THR  21           HB       THR  21 -23.091  11.557 -11.049
  164    HG1  THR  21           HG1      THR  21 -22.876  11.747 -13.123
  165   1HG2  THR  21          1HG2      THR  21 -21.358  12.815 -10.355
  166   2HG2  THR  21          2HG2      THR  21 -20.358  12.254 -11.695
  167   3HG2  THR  21          3HG2      THR  21 -20.416  11.333 -10.193
  168    H    LEU  22           H        LEU  22 -23.991   8.235 -10.285
  169    HA   LEU  22           HA       LEU  22 -25.353   7.886  -8.383
  170   1HB   LEU  22          2HB       LEU  22 -23.172   6.737  -7.959
  171   2HB   LEU  22          1HB       LEU  22 -22.632   8.162  -7.085
  172    HG   LEU  22           HG       LEU  22 -23.781   6.060  -5.864
  173   1HD1  LEU  22          1HD1      LEU  22 -23.489   7.393  -4.080
  174   2HD1  LEU  22          2HD1      LEU  22 -24.767   8.486  -4.611
  175   3HD1  LEU  22          3HD1      LEU  22 -23.121   8.697  -5.209
  176   1HD2  LEU  22          1HD2      LEU  22 -26.116   6.328  -5.501
  177   2HD2  LEU  22          2HD2      LEU  22 -25.908   6.517  -7.241
  178   3HD2  LEU  22          3HD2      LEU  22 -26.125   7.939  -6.220
  179    H    LYS  23           H        LYS  23 -24.733  10.794  -9.165
  180    HA   LYS  23           HA       LYS  23 -24.836  12.175  -6.557
  181   1HB   LYS  23          2HB       LYS  23 -24.394  12.780  -9.391
  182   2HB   LYS  23          1HB       LYS  23 -25.438  13.970  -8.612
  183   1HG   LYS  23          2HG       LYS  23 -23.795  14.450  -6.938
  184   2HG   LYS  23          1HG       LYS  23 -22.815  13.061  -7.410
  185   1HD   LYS  23          2HD       LYS  23 -22.858  14.315  -9.772
  186   2HD   LYS  23          1HD       LYS  23 -23.094  15.721  -8.733
  187   1HE   LYS  23          2HE       LYS  23 -21.077  14.996  -7.401
  188   2HE   LYS  23          1HE       LYS  23 -20.793  13.741  -8.623
  189   1HZ   LYS  23          1HZ       LYS  23 -21.209  15.818 -10.196
  190   2HZ   LYS  23          2HZ       LYS  23 -19.663  15.419  -9.613
  191   3HZ   LYS  23          3HZ       LYS  23 -20.570  16.641  -8.857
  192    H    GLY  24           H        GLY  24 -26.830  12.093  -5.493
  193   1HA   GLY  24          2HA       GLY  24 -29.182  11.975  -5.231
  194   2HA   GLY  24          1HA       GLY  24 -29.221  13.170  -6.536
  195    H    HIS  25           H        HIS  25 -28.399   9.721  -6.221
  196    HA   HIS  25           HA       HIS  25 -29.981   9.193  -8.716
  197   1HB   HIS  25          2HB       HIS  25 -27.575   9.165  -9.012
  198   2HB   HIS  25          1HB       HIS  25 -27.376   8.114  -7.616
  199    HD1  HIS  25           HD1      HIS  25 -29.340   7.964 -10.897
  200    HD2  HIS  25           HD2      HIS  25 -26.952   5.543  -8.494
  201    HE1  HIS  25           HE1      HIS  25 -28.923   5.817 -12.169
  202    H    LYS  26           H        LYS  26 -28.449   6.560  -7.118
  203    HA   LYS  26           HA       LYS  26 -29.397   4.611  -6.213
  204   1HB   LYS  26          2HB       LYS  26 -30.505   6.983  -4.713
  205   2HB   LYS  26          1HB       LYS  26 -30.970   5.348  -4.241
  206   1HG   LYS  26          2HG       LYS  26 -28.552   4.758  -4.054
  207   2HG   LYS  26          1HG       LYS  26 -28.147   6.440  -4.401
  208   1HD   LYS  26          2HD       LYS  26 -29.897   6.854  -2.411
  209   2HD   LYS  26          1HD       LYS  26 -29.341   5.245  -1.944
  210   1HE   LYS  26          2HE       LYS  26 -27.186   7.121  -2.741
  211   2HE   LYS  26          1HE       LYS  26 -28.032   7.528  -1.233
  212   1HZ   LYS  26          1HZ       LYS  26 -26.945   4.846  -1.919
  213   2HZ   LYS  26          2HZ       LYS  26 -27.733   5.265  -0.473
  214   3HZ   LYS  26          3HZ       LYS  26 -26.221   5.944  -0.847
  215    H    ARG  27           H        ARG  27 -32.373   6.316  -5.507
  216    HA   ARG  27           HA       ARG  27 -34.121   4.450  -6.645
  217   1HB   ARG  27          2HB       ARG  27 -34.739   6.323  -5.152
  218   2HB   ARG  27          1HB       ARG  27 -34.392   7.471  -6.445
  219   1HG   ARG  27          2HG       ARG  27 -36.256   6.842  -7.691
  220   2HG   ARG  27          1HG       ARG  27 -36.333   5.241  -6.956
  221   1HD   ARG  27          2HD       ARG  27 -36.827   7.739  -5.320
  222   2HD   ARG  27          1HD       ARG  27 -38.136   6.928  -6.205
  223    HE   ARG  27           HE       ARG  27 -37.458   4.826  -4.947
  224   1HH1  ARG  27          1HH2      ARG  27 -38.163   7.661  -3.445
  225   2HH1  ARG  27          2HH2      ARG  27 -37.355   7.317  -1.952
  226   1HH2  ARG  27          1HH1      ARG  27 -35.744   4.497  -3.168
  227   2HH2  ARG  27          2HH1      ARG  27 -35.984   5.527  -1.797
  228    H    TYR  28           H        TYR  28 -32.343   7.062  -8.193
  229    HA   TYR  28           HA       TYR  28 -33.745   6.925 -10.745
  230   1HB   TYR  28          2HB       TYR  28 -31.170   8.124  -9.698
  231   2HB   TYR  28          1HB       TYR  28 -31.640   8.272 -11.395
  232    HD1  TYR  28           HD1      TYR  28 -33.021   8.787  -7.945
  233    HD2  TYR  28           HD2      TYR  28 -33.034  10.027 -12.057
  234    HE1  TYR  28           HE1      TYR  28 -34.542  10.661  -7.376
  235    HE2  TYR  28           HE2      TYR  28 -34.556  11.901 -11.488
  236    HH   TYR  28           HH       TYR  28 -35.658  12.949  -9.879
  237    H    CYS  29           H        CYS  29 -31.596   4.852  -9.204
  238    HA   CYS  29           HA       CYS  29 -29.891   4.063 -11.398
  239   1HB   CYS  29          2HB       CYS  29 -29.645   3.719  -8.853
  240   2HB   CYS  29          1HB       CYS  29 -30.772   2.380  -9.047
  241    H    LYS  30           H        LYS  30 -30.745   3.099 -13.254
  242    HA   LYS  30           HA       LYS  30 -33.277   1.836 -13.471
  243   1HB   LYS  30          2HB       LYS  30 -31.400   2.495 -15.213
  244   2HB   LYS  30          1HB       LYS  30 -30.845   0.841 -14.946
  245   1HG   LYS  30          2HG       LYS  30 -33.656   0.698 -15.265
  246   2HG   LYS  30          1HG       LYS  30 -33.061   1.756 -16.545
  247   1HD   LYS  30          2HD       LYS  30 -31.527  -0.746 -16.015
  248   2HD   LYS  30          1HD       LYS  30 -33.088  -0.907 -16.820
  249   1HE   LYS  30          2HE       LYS  30 -31.237   1.220 -17.826
  250   2HE   LYS  30          1HE       LYS  30 -30.869  -0.467 -18.238
  251   1HZ   LYS  30          1HZ       LYS  30 -32.525   0.838 -19.710
  252   2HZ   LYS  30          2HZ       LYS  30 -33.628   0.543 -18.451
  253   3HZ   LYS  30          3HZ       LYS  30 -32.898  -0.757 -19.266
  254    H    PHE  31           H        PHE  31 -30.301   0.841 -12.049
  255    HA   PHE  31           HA       PHE  31 -31.148  -1.994 -11.714
  256   1HB   PHE  31          2HB       PHE  31 -28.567  -0.525 -11.053
  257   2HB   PHE  31          1HB       PHE  31 -28.758  -2.277 -11.170
  258    HD1  PHE  31           HD1      PHE  31 -28.725   0.903 -13.053
  259    HD2  PHE  31           HD2      PHE  31 -28.910  -3.378 -13.322
  260    HE1  PHE  31           HE1      PHE  31 -28.334   1.045 -15.491
  261    HE2  PHE  31           HE2      PHE  31 -28.518  -3.239 -15.764
  262    HZ   PHE  31           HZ       PHE  31 -28.225  -1.028 -16.853
  263    H    ARG  32           H        ARG  32 -31.873   0.759 -10.209
  264    HA   ARG  32           HA       ARG  32 -31.046   0.799  -7.574
  265   1HB   ARG  32          2HB       ARG  32 -33.096   1.957  -7.152
  266   2HB   ARG  32          1HB       ARG  32 -32.724   2.267  -8.844
  267   1HG   ARG  32          2HG       ARG  32 -34.482  -0.060  -8.064
  268   2HG   ARG  32          1HG       ARG  32 -35.150   1.560  -8.226
  269   1HD   ARG  32          2HD       ARG  32 -34.380   1.694 -10.545
  270   2HD   ARG  32          1HD       ARG  32 -33.597   0.108 -10.399
  271    HE   ARG  32           HE       ARG  32 -35.924  -0.791  -9.877
  272   1HH1  ARG  32          1HH2      ARG  32 -35.161   1.502 -12.251
  273   2HH1  ARG  32          2HH2      ARG  32 -36.795   1.740 -12.775
  274   1HH2  ARG  32          1HH1      ARG  32 -38.167  -0.207 -10.257
  275   2HH2  ARG  32          2HH1      ARG  32 -38.496   0.773 -11.647
  276    H    TYR  33           H        TYR  33 -33.084  -1.535  -9.141
  277    HA   TYR  33           HA       TYR  33 -33.308  -3.039  -6.551
  278   1HB   TYR  33          2HB       TYR  33 -35.299  -2.620  -8.797
  279   2HB   TYR  33          1HB       TYR  33 -35.530  -3.806  -7.513
  280    HD1  TYR  33           HD1      TYR  33 -36.954  -0.985  -8.338
  281    HD2  TYR  33           HD2      TYR  33 -34.365  -2.345  -5.190
  282    HE1  TYR  33           HE1      TYR  33 -37.829   0.794  -6.849
  283    HE2  TYR  33           HE2      TYR  33 -35.240  -0.567  -3.703
  284    HH   TYR  33           HH       TYR  33 -37.258   0.825  -3.492
  285    H    CYS  34           H        CYS  34 -31.678  -3.091  -9.340
  286    HA   CYS  34           HA       CYS  34 -32.177  -5.516 -10.673
  287   1HB   CYS  34          2HB       CYS  34 -30.473  -3.733 -11.232
  288   2HB   CYS  34          1HB       CYS  34 -29.485  -4.352  -9.906
  289    H    THR  35           H        THR  35 -30.780  -7.562 -10.414
  290    HA   THR  35           HA       THR  35 -30.100  -8.132  -7.564
  291    HB   THR  35           HB       THR  35 -31.397 -10.316  -7.920
  292    HG1  THR  35           HG1      THR  35 -33.043 -10.049  -9.570
  293   1HG2  THR  35          1HG2      THR  35 -33.255  -7.975  -8.161
  294   2HG2  THR  35          2HG2      THR  35 -32.168  -8.066  -6.775
  295   3HG2  THR  35          3HG2      THR  35 -33.334  -9.357  -7.068
  296    H    CYS  36           H        CYS  36 -29.068  -8.190 -10.731
  297    HA   CYS  36           HA       CYS  36 -27.972 -10.714 -11.223
  298   1HB   CYS  36          2HB       CYS  36 -26.439  -9.551 -12.641
  299   2HB   CYS  36          1HB       CYS  36 -27.909  -8.580 -12.612
  300    H    GLU  37           H        GLU  37 -25.412 -11.133 -10.957
  301    HA   GLU  37           HA       GLU  37 -24.913 -11.078  -8.054
  302   1HB   GLU  37          2HB       GLU  37 -24.594 -13.036  -9.625
  303   2HB   GLU  37          1HB       GLU  37 -23.216 -12.176 -10.311
  304   1HG   GLU  37          2HG       GLU  37 -21.931 -12.427  -8.405
  305   2HG   GLU  37          1HG       GLU  37 -23.337 -12.501  -7.342
  306    H    LYS  38           H        LYS  38 -24.292  -8.853 -10.435
  307    HA   LYS  38           HA       LYS  38 -21.611  -8.072  -9.359
  308   1HB   LYS  38          2HB       LYS  38 -22.545  -8.269 -11.903
  309   2HB   LYS  38          1HB       LYS  38 -22.974  -6.592 -11.564
  310   1HG   LYS  38          2HG       LYS  38 -20.802  -6.341 -12.367
  311   2HG   LYS  38          1HG       LYS  38 -20.510  -6.461 -10.632
  312   1HD   LYS  38          2HD       LYS  38 -20.243  -8.977 -10.989
  313   2HD   LYS  38          1HD       LYS  38 -20.203  -8.631 -12.718
  314   1HE   LYS  38          2HE       LYS  38 -18.415  -6.899 -11.137
  315   2HE   LYS  38          1HE       LYS  38 -17.981  -8.621 -11.092
  316   1HZ   LYS  38          1HZ       LYS  38 -17.009  -7.691 -13.044
  317   2HZ   LYS  38          2HZ       LYS  38 -18.470  -6.954 -13.502
  318   3HZ   LYS  38          3HZ       LYS  38 -18.319  -8.645 -13.543
  319    H    CYS  39           H        CYS  39 -24.952  -7.362  -9.273
  320    HA   CYS  39           HA       CYS  39 -24.650  -4.593  -8.282
  321   1HB   CYS  39          2HB       CYS  39 -26.757  -6.474  -9.223
  322   2HB   CYS  39          1HB       CYS  39 -27.259  -5.333  -7.995
  323    H    ARG  40           H        ARG  40 -25.777  -7.824  -7.254
  324    HA   ARG  40           HA       ARG  40 -26.216  -7.141  -4.480
  325   1HB   ARG  40          2HB       ARG  40 -26.047  -9.547  -6.230
  326   2HB   ARG  40          1HB       ARG  40 -25.761  -9.822  -4.510
  327   1HG   ARG  40          2HG       ARG  40 -27.911  -9.204  -3.910
  328   2HG   ARG  40          1HG       ARG  40 -28.107  -8.141  -5.304
  329   1HD   ARG  40          2HD       ARG  40 -29.280  -9.826  -6.278
  330   2HD   ARG  40          1HD       ARG  40 -27.745 -10.709  -6.403
  331    HE   ARG  40           HE       ARG  40 -28.346 -11.961  -4.468
  332   1HH1  ARG  40          1HH2      ARG  40 -31.050 -10.544  -5.698
  333   2HH1  ARG  40          2HH2      ARG  40 -31.937 -10.461  -4.213
  334   1HH2  ARG  40          1HH1      ARG  40 -29.219 -11.312  -2.234
  335   2HH2  ARG  40          2HH1      ARG  40 -30.901 -10.898  -2.253
  336    H    LEU  41           H        LEU  41 -23.535  -8.247  -6.433
  337    HA   LEU  41           HA       LEU  41 -21.676  -8.892  -4.347
  338   1HB   LEU  41          2HB       LEU  41 -21.168  -9.647  -6.522
  339   2HB   LEU  41          1HB       LEU  41 -21.587  -8.098  -7.250
  340    HG   LEU  41           HG       LEU  41 -19.081  -8.721  -7.075
  341   1HD1  LEU  41          1HD1      LEU  41 -18.722  -6.522  -7.410
  342   2HD1  LEU  41          2HD1      LEU  41 -19.285  -6.107  -5.791
  343   3HD1  LEU  41          3HD1      LEU  41 -20.446  -6.307  -7.103
  344   1HD2  LEU  41          1HD2      LEU  41 -18.126  -8.924  -5.037
  345   2HD2  LEU  41          2HD2      LEU  41 -19.763  -9.012  -4.387
  346   3HD2  LEU  41          3HD2      LEU  41 -18.920  -7.464  -4.445
  347    H    THR  42           H        THR  42 -22.312  -5.956  -6.211
  348    HA   THR  42           HA       THR  42 -20.394  -4.196  -5.193
  349    HB   THR  42           HB       THR  42 -23.284  -3.942  -5.996
  350    HG1  THR  42           HG1      THR  42 -21.167  -4.222  -7.340
  351   1HG2  THR  42          1HG2      THR  42 -21.424  -1.641  -5.337
  352   2HG2  THR  42          2HG2      THR  42 -22.758  -2.171  -4.312
  353   3HG2  THR  42          3HG2      THR  42 -23.086  -1.514  -5.916
  354    H    ALA  43           H        ALA  43 -23.713  -4.426  -3.947
  355    HA   ALA  43           HA       ALA  43 -23.443  -3.052  -1.535
  356   1HB   ALA  43          1HB       ALA  43 -25.595  -3.791  -1.644
  357   2HB   ALA  43          2HB       ALA  43 -25.014  -5.312  -0.965
  358   3HB   ALA  43          3HB       ALA  43 -25.142  -5.118  -2.713
  359    H    ASP  44           H        ASP  44 -22.230  -6.184  -2.465
  360    HA   ASP  44           HA       ASP  44 -21.443  -7.022   0.231
  361   1HB   ASP  44          2HB       ASP  44 -22.076  -8.297  -2.040
  362   2HB   ASP  44          1HB       ASP  44 -20.336  -8.169  -2.302
  363    H    ARG  45           H        ARG  45 -19.711  -6.102  -2.771
  364    HA   ARG  45           HA       ARG  45 -17.074  -6.099  -2.069
  365   1HB   ARG  45          2HB       ARG  45 -18.755  -4.823  -3.926
  366   2HB   ARG  45          1HB       ARG  45 -17.794  -3.525  -3.218
  367   1HG   ARG  45          2HG       ARG  45 -16.167  -5.876  -3.767
  368   2HG   ARG  45          1HG       ARG  45 -16.967  -5.286  -5.224
  369   1HD   ARG  45          2HD       ARG  45 -16.059  -2.971  -3.891
  370   2HD   ARG  45          1HD       ARG  45 -14.717  -4.130  -3.814
  371    HE   ARG  45           HE       ARG  45 -15.766  -2.916  -6.243
  372   1HH1  ARG  45          1HH2      ARG  45 -14.435  -5.788  -4.867
  373   2HH1  ARG  45          2HH2      ARG  45 -13.658  -6.285  -6.334
  374   1HH2  ARG  45          1HH1      ARG  45 -14.702  -3.518  -8.143
  375   2HH2  ARG  45          2HH1      ARG  45 -13.811  -5.003  -8.187
  376    H    GLN  46           H        GLN  46 -19.519  -3.935  -0.734
  377    HA   GLN  46           HA       GLN  46 -17.857  -1.947   0.431
  378   1HB   GLN  46          2HB       GLN  46 -20.505  -3.206   1.188
  379   2HB   GLN  46          1HB       GLN  46 -19.841  -1.816   2.050
  380   1HG   GLN  46          2HG       GLN  46 -19.568  -1.076  -0.601
  381   2HG   GLN  46          1HG       GLN  46 -21.107  -1.939  -0.593
  382   1HE2  GLN  46          1HE2      GLN  46 -22.501  -1.276   1.514
  383   2HE2  GLN  46          2HE2      GLN  46 -22.579   0.393   1.805
  384    H    ARG  47           H        ARG  47 -18.996  -5.057   1.803
  385    HA   ARG  47           HA       ARG  47 -17.772  -4.819   4.359
  386   1HB   ARG  47          2HB       ARG  47 -18.011  -7.293   4.351
  387   2HB   ARG  47          1HB       ARG  47 -19.451  -6.505   3.705
  388   1HG   ARG  47          2HG       ARG  47 -19.204  -7.585   1.747
  389   2HG   ARG  47          1HG       ARG  47 -17.573  -6.936   1.569
  390   1HD   ARG  47          2HD       ARG  47 -16.842  -9.074   1.833
  391   2HD   ARG  47          1HD       ARG  47 -17.315  -8.920   3.537
  392    HE   ARG  47           HE       ARG  47 -19.436  -9.638   1.587
  393   1HH1  ARG  47          1HH2      ARG  47 -18.653  -9.867   4.762
  394   2HH1  ARG  47          2HH2      ARG  47 -18.900 -11.574   4.921
  395   1HH2  ARG  47          1HH1      ARG  47 -19.180 -12.120   1.509
  396   2HH2  ARG  47          2HH1      ARG  47 -19.199 -12.849   3.080
  397    H    VAL  48           H        VAL  48 -15.647  -3.834   3.841
  398    HA   VAL  48           HA       VAL  48 -13.603  -5.920   3.287
  399    HB   VAL  48           HB       VAL  48 -12.557  -4.307   1.625
  400   1HG1  VAL  48          1HG1      VAL  48 -15.351  -5.274   0.948
  401   2HG1  VAL  48          2HG1      VAL  48 -13.916  -6.300   0.964
  402   3HG1  VAL  48          3HG1      VAL  48 -14.040  -4.975  -0.194
  403   1HG2  VAL  48          1HG2      VAL  48 -13.571  -2.334   1.087
  404   2HG2  VAL  48          2HG2      VAL  48 -14.347  -2.517   2.660
  405   3HG2  VAL  48          3HG2      VAL  48 -15.189  -3.026   1.197
  406    H    MET  49           H        MET  49 -13.192  -5.502   5.613
  407    HA   MET  49           HA       MET  49 -11.882  -2.857   6.146
  408   1HB   MET  49          2HB       MET  49 -13.147  -4.957   7.937
  409   2HB   MET  49          1HB       MET  49 -12.344  -3.504   8.536
  410   1HG   MET  49          2HG       MET  49 -13.926  -2.095   7.290
  411   2HG   MET  49          1HG       MET  49 -14.719  -3.534   6.650
  412   1HE   MET  49          1HE       MET  49 -14.784  -1.237  10.256
  413   2HE   MET  49          2HE       MET  49 -13.319  -1.834   9.480
  414   3HE   MET  49          3HE       MET  49 -13.936  -2.640  10.920
  415    H    ALA  50           H        ALA  50  -9.871  -2.937   7.416
  416    HA   ALA  50           HA       ALA  50  -8.457  -5.579   7.293
  417   1HB   ALA  50          1HB       ALA  50  -7.179  -4.658   5.673
  418   2HB   ALA  50          2HB       ALA  50  -6.594  -3.498   6.866
  419   3HB   ALA  50          3HB       ALA  50  -7.992  -3.104   5.866
  420    H    LEU  51           H        LEU  51  -6.503  -5.590   8.754
  421    HA   LEU  51           HA       LEU  51  -6.753  -3.680  11.048
  422   1HB   LEU  51          2HB       LEU  51  -7.306  -6.529  10.891
  423   2HB   LEU  51          1HB       LEU  51  -6.042  -6.200  12.076
  424    HG   LEU  51           HG       LEU  51  -7.595  -4.322  12.932
  425   1HD1  LEU  51          1HD1      LEU  51  -9.917  -5.882  12.023
  426   2HD1  LEU  51          2HD1      LEU  51  -9.077  -5.040  10.720
  427   3HD1  LEU  51          3HD1      LEU  51  -9.698  -4.134  12.101
  428   1HD2  LEU  51          1HD2      LEU  51  -8.162  -5.775  14.585
  429   2HD2  LEU  51          2HD2      LEU  51  -7.266  -6.967  13.645
  430   3HD2  LEU  51          3HD2      LEU  51  -9.016  -6.844  13.471
  431    H    GLN  52           H        GLN  52  -4.762  -2.928  11.723
  432    HA   GLN  52           HA       GLN  52  -2.321  -4.454  10.890
  433   1HB   GLN  52          2HB       GLN  52  -3.171  -2.311   9.553
  434   2HB   GLN  52          1HB       GLN  52  -2.367  -1.461  10.874
  435   1HG   GLN  52          2HG       GLN  52  -0.535  -3.423  10.198
  436   2HG   GLN  52          1HG       GLN  52  -1.200  -2.949   8.634
  437   1HE2  GLN  52          1HE2      GLN  52  -0.683  -0.935  11.571
  438   2HE2  GLN  52          2HE2      GLN  52   0.352   0.175  10.810
  Start of MODEL    7
    1   1H    SER   1          1H        SER   1 -26.095  12.581 -24.411
    2   2H    SER   1          2H        SER   1 -24.950  12.935 -25.616
    3   3H    SER   1          3H        SER   1 -25.445  14.143 -24.528
    4    HA   SER   1           HA       SER   1 -23.182  13.004 -24.126
    5   1HB   SER   1          2HB       SER   1 -23.712  13.240 -21.664
    6   2HB   SER   1          1HB       SER   1 -24.241  14.604 -22.646
    7    HG   SER   1           HG       SER   1 -26.320  13.558 -22.721
    8    H    ILE   2           H        ILE   2 -22.463  10.904 -24.303
    9    HA   ILE   2           HA       ILE   2 -24.224   8.636 -23.669
   10    HB   ILE   2           HB       ILE   2 -21.292   8.727 -24.447
   11   1HG1  ILE   2          2HG1      ILE   2 -23.810   8.740 -26.138
   12   2HG1  ILE   2          1HG1      ILE   2 -22.550   9.974 -26.100
   13   1HG2  ILE   2          1HG2      ILE   2 -21.629   6.469 -25.193
   14   2HG2  ILE   2          2HG2      ILE   2 -23.374   6.590 -24.960
   15   3HG2  ILE   2          3HG2      ILE   2 -22.297   6.563 -23.563
   16   1HD1  ILE   2          1HD1      ILE   2 -20.916   8.311 -26.948
   17   2HD1  ILE   2          2HD1      ILE   2 -22.260   8.531 -28.068
   18   3HD1  ILE   2          3HD1      ILE   2 -22.201   7.107 -27.029
   19    H    SER   3           H        SER   3 -20.865   9.377 -22.641
   20    HA   SER   3           HA       SER   3 -21.581   8.878 -19.816
   21   1HB   SER   3          2HB       SER   3 -21.238   6.640 -20.288
   22   2HB   SER   3          1HB       SER   3 -20.160   6.986 -21.637
   23    HG   SER   3           HG       SER   3 -19.437   7.607 -18.981
   24    HA   PRO   4           HA       PRO   4 -18.255  11.899 -19.957
   25   1HB   PRO   4          2HB       PRO   4 -18.646  12.814 -17.406
   26   2HB   PRO   4          1HB       PRO   4 -19.634  13.340 -18.784
   27   1HG   PRO   4          2HG       PRO   4 -20.258  11.370 -16.650
   28   2HG   PRO   4          1HG       PRO   4 -21.318  12.527 -17.468
   29   1HD   PRO   4          2HD       PRO   4 -21.225   9.845 -18.042
   30   2HD   PRO   4          1HD       PRO   4 -21.768  11.095 -19.182
   31    H    ARG   5           H        ARG   5 -16.824  12.383 -17.552
   32    HA   ARG   5           HA       ARG   5 -15.746   9.660 -16.898
   33   1HB   ARG   5          2HB       ARG   5 -13.514  10.684 -17.015
   34   2HB   ARG   5          1HB       ARG   5 -14.376  10.950 -18.529
   35   1HG   ARG   5          2HG       ARG   5 -15.142  13.186 -17.448
   36   2HG   ARG   5          1HG       ARG   5 -13.814  12.918 -16.318
   37   1HD   ARG   5          2HD       ARG   5 -12.216  13.353 -17.900
   38   2HD   ARG   5          1HD       ARG   5 -13.138  12.552 -19.188
   39    HE   ARG   5           HE       ARG   5 -14.461  14.963 -18.261
   40   1HH1  ARG   5          1HH2      ARG   5 -11.365  14.694 -19.420
   41   2HH1  ARG   5          2HH2      ARG   5 -11.626  15.580 -20.885
   42   1HH2  ARG   5          1HH1      ARG   5 -15.075  15.684 -20.517
   43   2HH2  ARG   5          2HH1      ARG   5 -13.730  16.141 -21.509
   44    H    THR   6           H        THR   6 -16.555   9.458 -14.803
   45    HA   THR   6           HA       THR   6 -15.445  11.286 -12.768
   46    HB   THR   6           HB       THR   6 -17.663  12.184 -13.739
   47    HG1  THR   6           HG1      THR   6 -16.836  12.856 -11.742
   48   1HG2  THR   6          1HG2      THR   6 -18.772   9.952 -13.815
   49   2HG2  THR   6          2HG2      THR   6 -19.701  11.145 -12.907
   50   3HG2  THR   6          3HG2      THR   6 -18.762   9.921 -12.051
   51    HA   PRO   7           HA       PRO   7 -15.398   7.257 -10.952
   52   1HB   PRO   7          2HB       PRO   7 -14.185   7.965  -8.603
   53   2HB   PRO   7          1HB       PRO   7 -13.321   7.749 -10.136
   54   1HG   PRO   7          2HG       PRO   7 -14.122  10.240  -8.756
   55   2HG   PRO   7          1HG       PRO   7 -12.712   9.908  -9.768
   56   1HD   PRO   7          2HD       PRO   7 -14.964  11.284 -10.599
   57   2HD   PRO   7          1HD       PRO   7 -13.788  10.502 -11.676
   58    HA   PRO   8           HA       PRO   8 -18.070   8.522  -7.176
   59   1HB   PRO   8          2HB       PRO   8 -19.460  10.863  -7.376
   60   2HB   PRO   8          1HB       PRO   8 -17.862  10.751  -6.614
   61   1HG   PRO   8          2HG       PRO   8 -18.607  11.737  -9.312
   62   2HG   PRO   8          1HG       PRO   8 -17.355  12.315  -8.202
   63   1HD   PRO   8          2HD       PRO   8 -16.876  10.738 -10.391
   64   2HD   PRO   8          1HD       PRO   8 -15.815  10.829  -8.975
   65    H    ASN   9           H        ASN   9 -18.717   7.053  -9.356
   66    HA   ASN   9           HA       ASN   9 -21.428   7.901 -10.275
   67   1HB   ASN   9          2HB       ASN   9 -21.037   6.448 -12.087
   68   2HB   ASN   9          1HB       ASN   9 -19.430   7.083 -11.744
   69   1HD2  ASN   9          1HD2      ASN   9 -17.877   5.640 -10.687
   70   2HD2  ASN   9          2HD2      ASN   9 -18.140   3.965 -10.619
   71    H    CYS  10           H        CYS  10 -23.002   5.951 -10.446
   72    HA   CYS  10           HA       CYS  10 -23.278   4.775  -7.769
   73   1HB   CYS  10          2HB       CYS  10 -25.233   5.637  -8.965
   74   2HB   CYS  10          1HB       CYS  10 -24.862   4.657 -10.345
   75    H    ALA  11           H        ALA  11 -23.148   2.520  -7.324
   76    HA   ALA  11           HA       ALA  11 -21.567   0.952  -9.262
   77   1HB   ALA  11          1HB       ALA  11 -21.455  -0.633  -7.347
   78   2HB   ALA  11          2HB       ALA  11 -22.543   0.426  -6.449
   79   3HB   ALA  11          3HB       ALA  11 -20.937   0.994  -6.908
   80    H    ARG  12           H        ARG  12 -24.735   0.792  -7.662
   81    HA   ARG  12           HA       ARG  12 -25.669  -1.702  -8.446
   82   1HB   ARG  12          2HB       ARG  12 -26.788   0.134  -7.141
   83   2HB   ARG  12          1HB       ARG  12 -27.090   0.971  -8.652
   84   1HG   ARG  12          2HG       ARG  12 -29.001  -0.177  -8.768
   85   2HG   ARG  12          1HG       ARG  12 -28.020  -1.594  -9.139
   86   1HD   ARG  12          2HD       ARG  12 -28.941  -0.704  -6.377
   87   2HD   ARG  12          1HD       ARG  12 -29.457  -2.160  -7.245
   88    HE   ARG  12           HE       ARG  12 -26.549  -1.881  -6.834
   89   1HH1  ARG  12          1HH2      ARG  12 -29.168  -3.954  -6.840
   90   2HH1  ARG  12          2HH2      ARG  12 -28.646  -4.913  -5.496
   91   1HH2  ARG  12          1HH1      ARG  12 -26.031  -2.799  -4.656
   92   2HH2  ARG  12          2HH1      ARG  12 -26.873  -4.261  -4.262
   93    H    CYS  13           H        CYS  13 -25.663   1.259 -10.356
   94    HA   CYS  13           HA       CYS  13 -26.522  -0.247 -12.758
   95   1HB   CYS  13          2HB       CYS  13 -26.631   2.038 -13.723
   96   2HB   CYS  13          1HB       CYS  13 -27.408   1.994 -12.162
   97    H    ARG  14           H        ARG  14 -23.512   0.686 -11.294
   98    HA   ARG  14           HA       ARG  14 -21.862   0.938 -13.653
   99   1HB   ARG  14          2HB       ARG  14 -20.416   1.446 -11.989
  100   2HB   ARG  14          1HB       ARG  14 -21.688   1.055 -10.853
  101   1HG   ARG  14          2HG       ARG  14 -19.860  -1.084 -11.977
  102   2HG   ARG  14          1HG       ARG  14 -19.433  -0.167 -10.542
  103   1HD   ARG  14          2HD       ARG  14 -21.395  -1.005  -9.369
  104   2HD   ARG  14          1HD       ARG  14 -21.943  -1.841 -10.825
  105    HE   ARG  14           HE       ARG  14 -20.402  -3.531 -10.289
  106   1HH1  ARG  14          1HH2      ARG  14 -19.826  -0.928  -8.225
  107   2HH1  ARG  14          2HH2      ARG  14 -18.171  -1.331  -7.905
  108   1HH2  ARG  14          1HH1      ARG  14 -18.055  -3.873 -10.260
  109   2HH2  ARG  14          2HH1      ARG  14 -17.171  -2.998  -9.054
  110    H    ASN  15           H        ASN  15 -23.355  -1.731 -12.140
  111    HA   ASN  15           HA       ASN  15 -21.489  -3.809 -12.765
  112   1HB   ASN  15          2HB       ASN  15 -24.425  -3.586 -12.136
  113   2HB   ASN  15          1HB       ASN  15 -23.631  -5.143 -12.301
  114   1HD2  ASN  15          1HD2      ASN  15 -24.366  -2.687 -10.148
  115   2HD2  ASN  15          2HD2      ASN  15 -23.165  -2.929  -8.985
  116    H    HIS  16           H        HIS  16 -24.214  -2.404 -14.445
  117    HA   HIS  16           HA       HIS  16 -24.010  -4.349 -16.664
  118   1HB   HIS  16          2HB       HIS  16 -25.870  -2.045 -16.013
  119   2HB   HIS  16          1HB       HIS  16 -26.120  -3.226 -17.279
  120    HD1  HIS  16           HD1      HIS  16 -27.279  -5.357 -16.653
  121    HD2  HIS  16           HD2      HIS  16 -25.667  -3.355 -13.375
  122    HE1  HIS  16           HE1      HIS  16 -27.990  -6.670 -14.590
  123    H    GLY  17           H        GLY  17 -22.718  -1.320 -15.813
  124   1HA   GLY  17          2HA       GLY  17 -21.002  -0.384 -17.335
  125   2HA   GLY  17          1HA       GLY  17 -22.057  -0.807 -18.685
  126    H    LEU  18           H        LEU  18 -23.200   0.622 -15.694
  127    HA   LEU  18           HA       LEU  18 -24.161   2.963 -17.273
  128   1HB   LEU  18          2HB       LEU  18 -25.374   1.204 -15.554
  129   2HB   LEU  18          1HB       LEU  18 -25.003   2.546 -14.473
  130    HG   LEU  18           HG       LEU  18 -27.218   2.857 -15.465
  131   1HD1  LEU  18          1HD1      LEU  18 -25.276   4.727 -15.292
  132   2HD1  LEU  18          2HD1      LEU  18 -26.916   5.090 -15.829
  133   3HD1  LEU  18          3HD1      LEU  18 -25.636   4.828 -17.015
  134   1HD2  LEU  18          1HD2      LEU  18 -25.779   1.987 -17.852
  135   2HD2  LEU  18          2HD2      LEU  18 -26.708   3.458 -18.142
  136   3HD2  LEU  18          3HD2      LEU  18 -27.515   2.010 -17.539
  137    H    LYS  19           H        LYS  19 -23.810   5.102 -16.424
  138    HA   LYS  19           HA       LYS  19 -22.001   5.448 -14.114
  139   1HB   LYS  19          2HB       LYS  19 -21.388   6.124 -17.003
  140   2HB   LYS  19          1HB       LYS  19 -20.543   6.904 -15.665
  141   1HG   LYS  19          2HG       LYS  19 -20.657   3.922 -16.212
  142   2HG   LYS  19          1HG       LYS  19 -19.253   4.969 -16.430
  143   1HD   LYS  19          2HD       LYS  19 -20.185   5.399 -13.783
  144   2HD   LYS  19          1HD       LYS  19 -20.153   3.654 -14.033
  145   1HE   LYS  19          2HE       LYS  19 -17.780   4.727 -15.210
  146   2HE   LYS  19          1HE       LYS  19 -17.931   5.395 -13.572
  147   1HZ   LYS  19          1HZ       LYS  19 -17.778   2.588 -14.424
  148   2HZ   LYS  19          2HZ       LYS  19 -18.677   2.969 -13.034
  149   3HZ   LYS  19          3HZ       LYS  19 -17.024   3.355 -13.113
  150    H    ILE  20           H        ILE  20 -23.796   6.507 -13.202
  151    HA   ILE  20           HA       ILE  20 -24.877   8.900 -14.598
  152    HB   ILE  20           HB       ILE  20 -26.824   8.358 -13.517
  153   1HG1  ILE  20          2HG1      ILE  20 -25.553   8.910 -11.274
  154   2HG1  ILE  20          1HG1      ILE  20 -27.120   8.160 -11.308
  155   1HG2  ILE  20          1HG2      ILE  20 -26.032   6.246 -14.516
  156   2HG2  ILE  20          2HG2      ILE  20 -27.157   6.028 -13.179
  157   3HG2  ILE  20          3HG2      ILE  20 -25.431   5.774 -12.930
  158   1HD1  ILE  20          1HD1      ILE  20 -24.516   6.679 -11.183
  159   2HD1  ILE  20          2HD1      ILE  20 -26.120   5.954 -11.158
  160   3HD1  ILE  20          3HD1      ILE  20 -25.591   6.976  -9.830
  161    H    THR  21           H        THR  21 -22.560   8.145 -12.243
  162    HA   THR  21           HA       THR  21 -21.200   9.675 -10.980
  163    HB   THR  21           HB       THR  21 -23.368  11.730 -11.302
  164    HG1  THR  21           HG1      THR  21 -21.683  10.637 -13.234
  165   1HG2  THR  21          1HG2      THR  21 -20.354  11.995 -11.346
  166   2HG2  THR  21          2HG2      THR  21 -21.314  12.101  -9.871
  167   3HG2  THR  21          3HG2      THR  21 -21.540  13.287 -11.157
  168    H    LEU  22           H        LEU  22 -24.060   8.354 -10.362
  169    HA   LEU  22           HA       LEU  22 -25.483   8.075  -8.479
  170   1HB   LEU  22          2HB       LEU  22 -23.316   6.942  -8.008
  171   2HB   LEU  22          1HB       LEU  22 -22.751   8.403  -7.207
  172    HG   LEU  22           HG       LEU  22 -23.899   6.359  -5.879
  173   1HD1  LEU  22          1HD1      LEU  22 -24.842   8.750  -4.611
  174   2HD1  LEU  22          2HD1      LEU  22 -23.289   9.088  -5.376
  175   3HD1  LEU  22          3HD1      LEU  22 -23.430   7.773  -4.208
  176   1HD2  LEU  22          1HD2      LEU  22 -26.052   6.607  -7.107
  177   2HD2  LEU  22          2HD2      LEU  22 -26.200   8.246  -6.473
  178   3HD2  LEU  22          3HD2      LEU  22 -26.239   6.871  -5.373
  179    H    LYS  23           H        LYS  23 -24.948  10.944  -9.348
  180    HA   LYS  23           HA       LYS  23 -25.028  12.433  -6.802
  181   1HB   LYS  23          2HB       LYS  23 -24.328  12.920  -9.491
  182   2HB   LYS  23          1HB       LYS  23 -25.771  13.894  -9.207
  183   1HG   LYS  23          2HG       LYS  23 -24.277  14.288  -6.901
  184   2HG   LYS  23          1HG       LYS  23 -23.057  14.255  -8.176
  185   1HD   LYS  23          2HD       LYS  23 -25.567  15.855  -8.581
  186   2HD   LYS  23          1HD       LYS  23 -24.265  16.519  -7.594
  187   1HE   LYS  23          2HE       LYS  23 -22.760  16.593  -9.396
  188   2HE   LYS  23          1HE       LYS  23 -23.658  15.371 -10.317
  189   1HZ   LYS  23          1HZ       LYS  23 -24.127  17.576 -11.178
  190   2HZ   LYS  23          2HZ       LYS  23 -24.622  18.100  -9.640
  191   3HZ   LYS  23          3HZ       LYS  23 -25.520  16.920 -10.468
  192    H    GLY  24           H        GLY  24 -27.006  12.323  -5.698
  193   1HA   GLY  24          2HA       GLY  24 -29.348  12.160  -5.391
  194   2HA   GLY  24          1HA       GLY  24 -29.432  13.330  -6.716
  195    H    HIS  25           H        HIS  25 -28.359   9.951  -6.512
  196    HA   HIS  25           HA       HIS  25 -30.064   9.329  -8.896
  197   1HB   HIS  25          2HB       HIS  25 -27.675   9.325  -9.276
  198   2HB   HIS  25          1HB       HIS  25 -27.409   8.327  -7.855
  199    HD1  HIS  25           HD1      HIS  25 -29.393   8.051 -11.112
  200    HD2  HIS  25           HD2      HIS  25 -27.031   5.711  -8.607
  201    HE1  HIS  25           HE1      HIS  25 -28.969   5.861 -12.304
  202    H    LYS  26           H        LYS  26 -28.438   6.756  -7.270
  203    HA   LYS  26           HA       LYS  26 -29.353   4.800  -6.322
  204   1HB   LYS  26          2HB       LYS  26 -29.105   6.439  -4.469
  205   2HB   LYS  26          1HB       LYS  26 -30.746   7.006  -4.762
  206   1HG   LYS  26          2HG       LYS  26 -31.493   5.391  -3.384
  207   2HG   LYS  26          1HG       LYS  26 -30.919   4.193  -4.547
  208   1HD   LYS  26          2HD       LYS  26 -28.643   5.151  -3.132
  209   2HD   LYS  26          1HD       LYS  26 -29.882   4.775  -1.936
  210   1HE   LYS  26          2HE       LYS  26 -28.869   2.679  -2.206
  211   2HE   LYS  26          1HE       LYS  26 -30.167   2.576  -3.413
  212   1HZ   LYS  26          1HZ       LYS  26 -27.600   2.236  -4.022
  213   2HZ   LYS  26          2HZ       LYS  26 -27.726   3.914  -4.257
  214   3HZ   LYS  26          3HZ       LYS  26 -28.736   2.853  -5.120
  215    H    ARG  27           H        ARG  27 -32.313   6.510  -5.536
  216    HA   ARG  27           HA       ARG  27 -34.089   4.623  -6.586
  217   1HB   ARG  27          2HB       ARG  27 -34.788   6.419  -5.129
  218   2HB   ARG  27          1HB       ARG  27 -34.268   7.637  -6.294
  219   1HG   ARG  27          2HG       ARG  27 -36.061   7.230  -7.727
  220   2HG   ARG  27          1HG       ARG  27 -36.305   5.593  -7.118
  221   1HD   ARG  27          2HD       ARG  27 -38.110   7.055  -6.306
  222   2HD   ARG  27          1HD       ARG  27 -37.085   6.575  -4.939
  223    HE   ARG  27           HE       ARG  27 -36.055   8.972  -6.153
  224   1HH1  ARG  27          1HH2      ARG  27 -36.754   8.095  -3.197
  225   2HH1  ARG  27          2HH2      ARG  27 -37.789   9.413  -2.758
  226   1HH2  ARG  27          1HH1      ARG  27 -38.183  10.541  -6.012
  227   2HH2  ARG  27          2HH1      ARG  27 -38.596  10.798  -4.350
  228    H    TYR  28           H        TYR  28 -32.359   7.200  -8.244
  229    HA   TYR  28           HA       TYR  28 -33.854   7.011 -10.745
  230   1HB   TYR  28          2HB       TYR  28 -31.259   8.252  -9.805
  231   2HB   TYR  28          1HB       TYR  28 -31.786   8.368 -11.485
  232    HD1  TYR  28           HD1      TYR  28 -33.109   8.896  -8.008
  233    HD2  TYR  28           HD2      TYR  28 -33.161  10.137 -12.121
  234    HE1  TYR  28           HE1      TYR  28 -34.622  10.773  -7.424
  235    HE2  TYR  28           HE2      TYR  28 -34.674  12.013 -11.536
  236    HH   TYR  28           HH       TYR  28 -35.630  12.618  -8.160
  237    H    CYS  29           H        CYS  29 -31.644   4.974  -9.244
  238    HA   CYS  29           HA       CYS  29 -29.971   4.172 -11.451
  239   1HB   CYS  29          2HB       CYS  29 -29.717   3.826  -8.906
  240   2HB   CYS  29          1HB       CYS  29 -30.842   2.487  -9.101
  241    H    LYS  30           H        LYS  30 -30.611   2.976 -13.233
  242    HA   LYS  30           HA       LYS  30 -33.229   1.797 -13.479
  243   1HB   LYS  30          2HB       LYS  30 -31.225   2.426 -15.177
  244   2HB   LYS  30          1HB       LYS  30 -30.888   0.705 -14.987
  245   1HG   LYS  30          2HG       LYS  30 -33.443   0.401 -15.421
  246   2HG   LYS  30          1HG       LYS  30 -33.354   2.029 -16.094
  247   1HD   LYS  30          2HD       LYS  30 -32.047   1.374 -17.877
  248   2HD   LYS  30          1HD       LYS  30 -31.290   0.061 -16.975
  249   1HE   LYS  30          2HE       LYS  30 -34.022  -0.622 -17.090
  250   2HE   LYS  30          1HE       LYS  30 -33.605  -0.048 -18.718
  251   1HZ   LYS  30          1HZ       LYS  30 -33.065  -2.438 -18.296
  252   2HZ   LYS  30          2HZ       LYS  30 -31.914  -1.925 -17.158
  253   3HZ   LYS  30          3HZ       LYS  30 -31.744  -1.499 -18.795
  254    H    PHE  31           H        PHE  31 -30.343   0.892 -11.889
  255    HA   PHE  31           HA       PHE  31 -31.145  -1.972 -11.597
  256   1HB   PHE  31          2HB       PHE  31 -28.569  -0.498 -10.920
  257   2HB   PHE  31          1HB       PHE  31 -28.764  -2.251 -11.039
  258    HD1  PHE  31           HD1      PHE  31 -28.765   0.928 -12.930
  259    HD2  PHE  31           HD2      PHE  31 -28.851  -3.355 -13.178
  260    HE1  PHE  31           HE1      PHE  31 -28.369   1.067 -15.364
  261    HE2  PHE  31           HE2      PHE  31 -28.465  -3.221 -15.617
  262    HZ   PHE  31           HZ       PHE  31 -28.215  -1.010 -16.719
  263    H    ARG  32           H        ARG  32 -31.738   0.880 -10.115
  264    HA   ARG  32           HA       ARG  32 -30.978   0.904  -7.485
  265   1HB   ARG  32          2HB       ARG  32 -32.891   2.220  -7.143
  266   2HB   ARG  32          1HB       ARG  32 -32.682   2.319  -8.887
  267   1HG   ARG  32          2HG       ARG  32 -34.472   0.266  -7.569
  268   2HG   ARG  32          1HG       ARG  32 -35.052   1.841  -8.091
  269   1HD   ARG  32          2HD       ARG  32 -33.528   0.581 -10.221
  270   2HD   ARG  32          1HD       ARG  32 -34.855  -0.463  -9.692
  271    HE   ARG  32           HE       ARG  32 -36.123   1.922  -9.782
  272   1HH1  ARG  32          1HH2      ARG  32 -36.607   0.079 -12.032
  273   2HH1  ARG  32          2HH2      ARG  32 -36.082   0.996 -13.404
  274   1HH2  ARG  32          1HH1      ARG  32 -34.269   3.274 -11.521
  275   2HH2  ARG  32          2HH1      ARG  32 -34.757   2.805 -13.115
  276    H    TYR  33           H        TYR  33 -33.102  -1.379  -9.029
  277    HA   TYR  33           HA       TYR  33 -33.309  -2.886  -6.436
  278   1HB   TYR  33          2HB       TYR  33 -35.341  -2.474  -8.651
  279   2HB   TYR  33          1HB       TYR  33 -35.560  -3.617  -7.326
  280    HD1  TYR  33           HD1      TYR  33 -37.038  -0.870  -8.182
  281    HD2  TYR  33           HD2      TYR  33 -34.268  -2.028  -5.108
  282    HE1  TYR  33           HE1      TYR  33 -37.865   0.972  -6.741
  283    HE2  TYR  33           HE2      TYR  33 -35.092  -0.185  -3.671
  284    HH   TYR  33           HH       TYR  33 -36.346   1.682  -3.615
  285    H    CYS  34           H        CYS  34 -31.534  -3.015  -9.002
  286    HA   CYS  34           HA       CYS  34 -32.158  -5.404 -10.438
  287   1HB   CYS  34          2HB       CYS  34 -30.453  -3.618 -11.014
  288   2HB   CYS  34          1HB       CYS  34 -29.439  -4.270  -9.728
  289    H    THR  35           H        THR  35 -30.791  -7.449 -10.229
  290    HA   THR  35           HA       THR  35 -29.946  -8.053  -7.437
  291    HB   THR  35           HB       THR  35 -31.370 -10.262  -7.937
  292    HG1  THR  35           HG1      THR  35 -33.270  -9.605  -9.068
  293   1HG2  THR  35          1HG2      THR  35 -31.613  -8.218  -6.228
  294   2HG2  THR  35          2HG2      THR  35 -32.869  -9.445  -6.394
  295   3HG2  THR  35          3HG2      THR  35 -33.035  -7.896  -7.218
  296    H    CYS  36           H        CYS  36 -29.147  -8.120 -10.647
  297    HA   CYS  36           HA       CYS  36 -28.235 -10.676 -11.291
  298   1HB   CYS  36          2HB       CYS  36 -26.676  -9.537 -12.720
  299   2HB   CYS  36          1HB       CYS  36 -28.106  -8.512 -12.608
  300    H    GLU  37           H        GLU  37 -25.777 -11.379 -11.122
  301    HA   GLU  37           HA       GLU  37 -25.093 -11.424  -8.272
  302   1HB   GLU  37          2HB       GLU  37 -24.944 -13.248 -10.150
  303   2HB   GLU  37          1HB       GLU  37 -23.390 -12.494 -10.508
  304   1HG   GLU  37          2HG       GLU  37 -22.464 -13.617  -8.795
  305   2HG   GLU  37          1HG       GLU  37 -23.554 -12.791  -7.681
  306    H    LYS  38           H        LYS  38 -24.530  -9.073 -10.499
  307    HA   LYS  38           HA       LYS  38 -21.736  -8.512  -9.571
  308   1HB   LYS  38          2HB       LYS  38 -23.304  -7.107 -11.752
  309   2HB   LYS  38          1HB       LYS  38 -21.553  -7.208 -11.564
  310   1HG   LYS  38          2HG       LYS  38 -22.459  -9.876 -11.678
  311   2HG   LYS  38          1HG       LYS  38 -23.333  -9.019 -12.948
  312   1HD   LYS  38          2HD       LYS  38 -20.410  -8.472 -12.672
  313   2HD   LYS  38          1HD       LYS  38 -20.890 -10.018 -13.369
  314   1HE   LYS  38          2HE       LYS  38 -22.554  -8.088 -14.597
  315   2HE   LYS  38          1HE       LYS  38 -20.912  -7.412 -14.616
  316   1HZ   LYS  38          1HZ       LYS  38 -21.541  -9.053 -16.464
  317   2HZ   LYS  38          2HZ       LYS  38 -21.399 -10.251 -15.268
  318   3HZ   LYS  38          3HZ       LYS  38 -20.061  -9.284 -15.669
  319    H    CYS  39           H        CYS  39 -25.023  -7.570  -9.337
  320    HA   CYS  39           HA       CYS  39 -24.470  -4.878  -8.244
  321   1HB   CYS  39          2HB       CYS  39 -26.772  -6.565  -9.129
  322   2HB   CYS  39          1HB       CYS  39 -27.109  -5.433  -7.832
  323    H    ARG  40           H        ARG  40 -25.499  -8.139  -7.325
  324    HA   ARG  40           HA       ARG  40 -25.842  -7.570  -4.495
  325   1HB   ARG  40          2HB       ARG  40 -25.707  -9.968  -6.309
  326   2HB   ARG  40          1HB       ARG  40 -25.644 -10.205  -4.563
  327   1HG   ARG  40          2HG       ARG  40 -27.744  -8.765  -4.421
  328   2HG   ARG  40          1HG       ARG  40 -27.854  -8.915  -6.176
  329   1HD   ARG  40          2HD       ARG  40 -29.166 -10.734  -5.469
  330   2HD   ARG  40          1HD       ARG  40 -27.577 -11.506  -5.654
  331    HE   ARG  40           HE       ARG  40 -28.618 -10.490  -3.035
  332   1HH1  ARG  40          1HH2      ARG  40 -28.605 -13.452  -3.899
  333   2HH1  ARG  40          2HH2      ARG  40 -27.204 -14.020  -3.051
  334   1HH2  ARG  40          1HH1      ARG  40 -25.981 -10.840  -2.403
  335   2HH2  ARG  40          2HH1      ARG  40 -25.716 -12.541  -2.209
  336    H    LEU  41           H        LEU  41 -23.326  -8.788  -6.620
  337    HA   LEU  41           HA       LEU  41 -21.409  -9.573  -4.639
  338   1HB   LEU  41          2HB       LEU  41 -20.912 -10.370  -6.754
  339   2HB   LEU  41          1HB       LEU  41 -21.542  -8.927  -7.544
  340    HG   LEU  41           HG       LEU  41 -19.551  -7.679  -7.019
  341   1HD1  LEU  41          1HD1      LEU  41 -19.361  -9.371  -4.832
  342   2HD1  LEU  41          2HD1      LEU  41 -18.132  -8.208  -5.329
  343   3HD1  LEU  41          3HD1      LEU  41 -18.016  -9.890  -5.847
  344   1HD2  LEU  41          1HD2      LEU  41 -19.508  -9.302  -8.957
  345   2HD2  LEU  41          2HD2      LEU  41 -18.669 -10.440  -7.904
  346   3HD2  LEU  41          3HD2      LEU  41 -17.917  -8.898  -8.313
  347    H    THR  42           H        THR  42 -22.256  -6.512  -6.130
  348    HA   THR  42           HA       THR  42 -19.981  -5.003  -5.152
  349    HB   THR  42           HB       THR  42 -22.734  -4.378  -6.210
  350    HG1  THR  42           HG1      THR  42 -20.455  -4.994  -7.321
  351   1HG2  THR  42          1HG2      THR  42 -22.038  -2.617  -4.599
  352   2HG2  THR  42          2HG2      THR  42 -22.100  -2.014  -6.255
  353   3HG2  THR  42          3HG2      THR  42 -20.546  -2.398  -5.513
  354    H    ALA  43           H        ALA  43 -23.403  -4.673  -4.282
  355    HA   ALA  43           HA       ALA  43 -23.243  -3.239  -1.924
  356   1HB   ALA  43          1HB       ALA  43 -24.939  -5.697  -2.504
  357   2HB   ALA  43          2HB       ALA  43 -25.316  -4.052  -3.013
  358   3HB   ALA  43          3HB       ALA  43 -25.315  -4.466  -1.299
  359    H    ASP  44           H        ASP  44 -22.342  -6.571  -2.492
  360    HA   ASP  44           HA       ASP  44 -22.019  -7.336   0.295
  361   1HB   ASP  44          2HB       ASP  44 -22.403  -8.737  -1.848
  362   2HB   ASP  44          1HB       ASP  44 -20.679  -8.515  -2.148
  363    H    ARG  45           H        ARG  45 -19.827  -6.316  -2.330
  364    HA   ARG  45           HA       ARG  45 -17.345  -6.525  -1.014
  365   1HB   ARG  45          2HB       ARG  45 -18.425  -5.497  -3.392
  366   2HB   ARG  45          1HB       ARG  45 -17.607  -4.124  -2.645
  367   1HG   ARG  45          2HG       ARG  45 -15.795  -6.160  -2.250
  368   2HG   ARG  45          1HG       ARG  45 -16.466  -6.561  -3.830
  369   1HD   ARG  45          2HD       ARG  45 -15.415  -3.807  -3.091
  370   2HD   ARG  45          1HD       ARG  45 -14.486  -5.025  -3.988
  371    HE   ARG  45           HE       ARG  45 -16.925  -4.870  -5.332
  372   1HH1  ARG  45          1HH2      ARG  45 -14.372  -4.119  -6.661
  373   2HH1  ARG  45          2HH2      ARG  45 -14.615  -2.442  -7.023
  374   1HH2  ARG  45          1HH1      ARG  45 -17.273  -2.082  -4.826
  375   2HH2  ARG  45          2HH1      ARG  45 -16.256  -1.289  -5.981
  376    H    GLN  46           H        GLN  46 -19.751  -3.896  -0.890
  377    HA   GLN  46           HA       GLN  46 -18.082  -2.198   0.811
  378   1HB   GLN  46          2HB       GLN  46 -20.008  -1.676  -0.915
  379   2HB   GLN  46          1HB       GLN  46 -21.057  -1.939   0.478
  380   1HG   GLN  46          2HG       GLN  46 -19.146  -0.335   1.579
  381   2HG   GLN  46          1HG       GLN  46 -19.177   0.278  -0.074
  382   1HE2  GLN  46          1HE2      GLN  46 -20.834   1.739  -0.557
  383   2HE2  GLN  46          2HE2      GLN  46 -22.224   1.970   0.390
  384    H    ARG  47           H        ARG  47 -20.382  -4.767   1.314
  385    HA   ARG  47           HA       ARG  47 -21.352  -4.130   3.913
  386   1HB   ARG  47          2HB       ARG  47 -21.954  -5.989   2.191
  387   2HB   ARG  47          1HB       ARG  47 -20.665  -6.911   2.968
  388   1HG   ARG  47          2HG       ARG  47 -22.647  -7.526   4.128
  389   2HG   ARG  47          1HG       ARG  47 -21.833  -6.374   5.188
  390   1HD   ARG  47          2HD       ARG  47 -23.362  -4.655   4.712
  391   2HD   ARG  47          1HD       ARG  47 -23.867  -5.401   3.182
  392    HE   ARG  47           HE       ARG  47 -25.219  -6.952   4.416
  393   1HH1  ARG  47          1HH2      ARG  47 -23.025  -7.055   6.656
  394   2HH1  ARG  47          2HH2      ARG  47 -23.969  -6.520   8.006
  395   1HH2  ARG  47          1HH1      ARG  47 -26.574  -5.329   6.053
  396   2HH2  ARG  47          2HH1      ARG  47 -25.978  -5.543   7.665
  397    H    VAL  48           H        VAL  48 -19.927  -3.554   5.544
  398    HA   VAL  48           HA       VAL  48 -17.856  -5.552   6.311
  399    HB   VAL  48           HB       VAL  48 -17.405  -2.599   5.764
  400   1HG1  VAL  48          1HG1      VAL  48 -14.961  -3.396   6.268
  401   2HG1  VAL  48          2HG1      VAL  48 -15.755  -4.694   7.158
  402   3HG1  VAL  48          3HG1      VAL  48 -16.030  -3.013   7.617
  403   1HG2  VAL  48          1HG2      VAL  48 -16.627  -5.172   4.408
  404   2HG2  VAL  48          2HG2      VAL  48 -15.600  -3.747   4.248
  405   3HG2  VAL  48          3HG2      VAL  48 -17.273  -3.695   3.693
  406    H    MET  49           H        MET  49 -18.601  -6.015   8.369
  407    HA   MET  49           HA       MET  49 -19.229  -3.685  10.157
  408   1HB   MET  49          2HB       MET  49 -20.982  -5.030  11.110
  409   2HB   MET  49          1HB       MET  49 -21.148  -5.157   9.358
  410   1HG   MET  49          2HG       MET  49 -19.859  -7.283   9.414
  411   2HG   MET  49          1HG       MET  49 -19.779  -7.168  11.173
  412   1HE   MET  49          1HE       MET  49 -20.839  -9.432   9.249
  413   2HE   MET  49          2HE       MET  49 -22.331 -10.023   9.978
  414   3HE   MET  49          3HE       MET  49 -20.912  -9.754  10.988
  415    H    ALA  50           H        ALA  50 -17.086  -6.208   9.600
  416    HA   ALA  50           HA       ALA  50 -16.365  -6.327  12.513
  417   1HB   ALA  50          1HB       ALA  50 -17.310  -8.363  10.874
  418   2HB   ALA  50          2HB       ALA  50 -16.428  -8.593  12.384
  419   3HB   ALA  50          3HB       ALA  50 -15.563  -8.603  10.847
  420    H    LEU  51           H        LEU  51 -15.110  -6.767   9.185
  421    HA   LEU  51           HA       LEU  51 -12.329  -6.447  10.038
  422   1HB   LEU  51          2HB       LEU  51 -13.832  -6.693   7.428
  423   2HB   LEU  51          1HB       LEU  51 -12.093  -6.397   7.456
  424    HG   LEU  51           HG       LEU  51 -12.090  -8.421   9.155
  425   1HD1  LEU  51          1HD1      LEU  51 -13.882 -10.073   8.164
  426   2HD1  LEU  51          2HD1      LEU  51 -14.740  -8.590   7.745
  427   3HD1  LEU  51          3HD1      LEU  51 -14.352  -8.939   9.431
  428   1HD2  LEU  51          1HD2      LEU  51 -11.893  -9.970   7.149
  429   2HD2  LEU  51          2HD2      LEU  51 -10.895  -8.518   7.069
  430   3HD2  LEU  51          3HD2      LEU  51 -12.395  -8.610   6.147
  431    H    GLN  52           H        GLN  52 -12.391  -4.303  11.041
  432    HA   GLN  52           HA       GLN  52 -13.122  -1.994   9.339
  433   1HB   GLN  52          2HB       GLN  52 -13.450  -2.473  11.937
  434   2HB   GLN  52          1HB       GLN  52 -11.823  -1.797  12.034
  435   1HG   GLN  52          2HG       GLN  52 -12.706   0.152  10.626
  436   2HG   GLN  52          1HG       GLN  52 -14.321  -0.478  10.955
  437   1HE2  GLN  52          1HE2      GLN  52 -11.380   0.770  12.580
  438   2HE2  GLN  52          2HE2      GLN  52 -12.178   1.246  14.001
  Start of MODEL    8
    1   1H    SER   1          1H        SER   1 -22.044  10.673 -20.819
    2   2H    SER   1          2H        SER   1 -20.670  11.664 -20.934
    3   3H    SER   1          3H        SER   1 -20.496   9.991 -20.699
    4    HA   SER   1           HA       SER   1 -21.939  10.025 -22.965
    5   1HB   SER   1          2HB       SER   1 -20.193  12.491 -22.756
    6   2HB   SER   1          1HB       SER   1 -20.767  11.858 -24.295
    7    HG   SER   1           HG       SER   1 -22.786  12.391 -23.778
    8    H    ILE   2           H        ILE   2 -20.527   8.067 -22.193
    9    HA   ILE   2           HA       ILE   2 -18.701   6.625 -22.605
   10    HB   ILE   2           HB       ILE   2 -18.456   8.462 -25.010
   11   1HG1  ILE   2          2HG1      ILE   2 -20.789   7.619 -24.567
   12   2HG1  ILE   2          1HG1      ILE   2 -20.100   7.031 -26.082
   13   1HG2  ILE   2          1HG2      ILE   2 -17.271   5.885 -24.207
   14   2HG2  ILE   2          2HG2      ILE   2 -16.723   7.046 -25.417
   15   3HG2  ILE   2          3HG2      ILE   2 -17.982   5.878 -25.821
   16   1HD1  ILE   2          1HD1      ILE   2 -19.664   4.884 -25.184
   17   2HD1  ILE   2          2HD1      ILE   2 -21.264   5.294 -24.567
   18   3HD1  ILE   2          3HD1      ILE   2 -19.850   5.448 -23.524
   19    H    SER   3           H        SER   3 -18.199   9.075 -21.009
   20    HA   SER   3           HA       SER   3 -15.257   9.044 -21.160
   21   1HB   SER   3          2HB       SER   3 -15.547  11.714 -21.190
   22   2HB   SER   3          1HB       SER   3 -15.425  10.778 -22.677
   23    HG   SER   3           HG       SER   3 -17.914  11.207 -21.422
   24    HA   PRO   4           HA       PRO   4 -17.379   9.767 -17.040
   25   1HB   PRO   4          2HB       PRO   4 -16.595   7.428 -15.855
   26   2HB   PRO   4          1HB       PRO   4 -18.104   7.590 -16.776
   27   1HG   PRO   4          2HG       PRO   4 -15.499   6.412 -17.600
   28   2HG   PRO   4          1HG       PRO   4 -17.146   5.883 -17.974
   29   1HD   PRO   4          2HD       PRO   4 -15.568   7.265 -19.722
   30   2HD   PRO   4          1HD       PRO   4 -17.344   7.316 -19.744
   31    H    ARG   5           H        ARG   5 -15.569  11.376 -17.041
   32    HA   ARG   5           HA       ARG   5 -12.925  10.447 -16.112
   33   1HB   ARG   5          2HB       ARG   5 -13.289  12.281 -17.779
   34   2HB   ARG   5          1HB       ARG   5 -14.073  13.229 -16.513
   35   1HG   ARG   5          2HG       ARG   5 -11.704  12.442 -15.315
   36   2HG   ARG   5          1HG       ARG   5 -11.219  12.755 -16.983
   37   1HD   ARG   5          2HD       ARG   5 -12.917  14.886 -16.402
   38   2HD   ARG   5          1HD       ARG   5 -11.985  14.665 -14.907
   39    HE   ARG   5           HE       ARG   5 -10.495  14.624 -17.475
   40   1HH1  ARG   5          1HH2      ARG   5  -9.986  15.136 -14.306
   41   2HH1  ARG   5          2HH2      ARG   5  -9.296  16.718 -14.439
   42   1HH2  ARG   5          1HH1      ARG   5 -10.204  17.126 -17.759
   43   2HH2  ARG   5          2HH1      ARG   5  -9.415  17.843 -16.393
   44    H    THR   6           H        THR   6 -15.103   9.865 -14.314
   45    HA   THR   6           HA       THR   6 -14.204  11.429 -11.947
   46    HB   THR   6           HB       THR   6 -16.299  12.363 -13.152
   47    HG1  THR   6           HG1      THR   6 -15.691  12.802 -10.962
   48   1HG2  THR   6          1HG2      THR   6 -18.356  11.225 -12.894
   49   2HG2  THR   6          2HG2      THR   6 -17.683  10.105 -11.710
   50   3HG2  THR   6          3HG2      THR   6 -17.226   9.972 -13.408
   51    HA   PRO   7           HA       PRO   7 -14.299   7.276 -10.438
   52   1HB   PRO   7          2HB       PRO   7 -13.611   7.838  -7.847
   53   2HB   PRO   7          1HB       PRO   7 -12.453   7.788  -9.189
   54   1HG   PRO   7          2HG       PRO   7 -13.651  10.118  -7.818
   55   2HG   PRO   7          1HG       PRO   7 -12.056   9.932  -8.552
   56   1HD   PRO   7          2HD       PRO   7 -14.179  11.276  -9.711
   57   2HD   PRO   7          1HD       PRO   7 -12.775  10.633 -10.588
   58    HA   PRO   8           HA       PRO   8 -17.723   8.098  -7.182
   59   1HB   PRO   8          2HB       PRO   8 -19.179  10.394  -7.481
   60   2HB   PRO   8          1HB       PRO   8 -17.759  10.280  -6.421
   61   1HG   PRO   8          2HG       PRO   8 -18.006  11.458  -9.133
   62   2HG   PRO   8          1HG       PRO   8 -17.035  11.990  -7.754
   63   1HD   PRO   8          2HD       PRO   8 -16.043  10.627  -9.906
   64   2HD   PRO   8          1HD       PRO   8 -15.294  10.634  -8.302
   65    H    ASN   9           H        ASN   9 -19.515   6.939  -7.746
   66    HA   ASN   9           HA       ASN   9 -21.422   7.655  -9.776
   67   1HB   ASN   9          2HB       ASN   9 -20.757   6.003 -11.476
   68   2HB   ASN   9          1HB       ASN   9 -19.470   7.184 -11.221
   69   1HD2  ASN   9          1HD2      ASN   9 -17.714   5.760 -11.779
   70   2HD2  ASN   9          2HD2      ASN   9 -17.304   4.408 -10.837
   71    H    CYS  10           H        CYS  10 -23.067   6.019  -9.968
   72    HA   CYS  10           HA       CYS  10 -23.453   4.469  -7.551
   73   1HB   CYS  10          2HB       CYS  10 -25.274   5.520  -8.843
   74   2HB   CYS  10          1HB       CYS  10 -24.870   4.551 -10.224
   75    H    ALA  11           H        ALA  11 -22.837   2.330  -7.216
   76    HA   ALA  11           HA       ALA  11 -21.486   0.956  -9.411
   77   1HB   ALA  11          1HB       ALA  11 -20.539   0.890  -7.177
   78   2HB   ALA  11          2HB       ALA  11 -21.040  -0.742  -7.619
   79   3HB   ALA  11          3HB       ALA  11 -22.038   0.222  -6.531
   80    H    ARG  12           H        ARG  12 -24.600   0.907  -7.924
   81    HA   ARG  12           HA       ARG  12 -25.495  -1.734  -8.514
   82   1HB   ARG  12          2HB       ARG  12 -26.602   0.098  -7.184
   83   2HB   ARG  12          1HB       ARG  12 -26.960   0.916  -8.696
   84   1HG   ARG  12          2HG       ARG  12 -28.779  -0.338  -8.964
   85   2HG   ARG  12          1HG       ARG  12 -27.786  -1.795  -8.956
   86   1HD   ARG  12          2HD       ARG  12 -29.093  -0.429  -6.583
   87   2HD   ARG  12          1HD       ARG  12 -29.307  -2.101  -7.136
   88    HE   ARG  12           HE       ARG  12 -26.784  -2.339  -6.615
   89   1HH1  ARG  12          1HH2      ARG  12 -27.917   0.596  -5.484
   90   2HH1  ARG  12          2HH2      ARG  12 -27.425   0.362  -3.839
   91   1HH2  ARG  12          1HH1      ARG  12 -26.558  -2.965  -4.295
   92   2HH2  ARG  12          2HH1      ARG  12 -26.655  -1.654  -3.167
   93    H    CYS  13           H        CYS  13 -25.650   1.227 -10.428
   94    HA   CYS  13           HA       CYS  13 -26.671  -0.243 -12.741
   95   1HB   CYS  13          2HB       CYS  13 -26.700   2.070 -13.716
   96   2HB   CYS  13          1HB       CYS  13 -27.482   1.977 -12.155
   97    H    ARG  14           H        ARG  14 -23.385   0.737 -11.709
   98    HA   ARG  14           HA       ARG  14 -22.275   0.757 -14.398
   99   1HB   ARG  14          2HB       ARG  14 -20.120   0.216 -13.176
  100   2HB   ARG  14          1HB       ARG  14 -20.968   1.634 -12.566
  101   1HG   ARG  14          2HG       ARG  14 -20.293   0.341 -10.660
  102   2HG   ARG  14          1HG       ARG  14 -22.020   0.153 -10.846
  103   1HD   ARG  14          2HD       ARG  14 -21.820  -2.083 -11.000
  104   2HD   ARG  14          1HD       ARG  14 -20.646  -1.921 -12.317
  105    HE   ARG  14           HE       ARG  14 -19.703  -1.395  -9.548
  106   1HH1  ARG  14          1HH2      ARG  14 -18.753  -2.309 -12.595
  107   2HH1  ARG  14          2HH2      ARG  14 -17.797  -3.666 -12.102
  108   1HH2  ARG  14          1HH1      ARG  14 -18.900  -3.594  -8.818
  109   2HH2  ARG  14          2HH1      ARG  14 -17.881  -4.393  -9.968
  110    H    ASN  15           H        ASN  15 -23.198  -1.747 -12.201
  111    HA   ASN  15           HA       ASN  15 -21.741  -3.972 -12.910
  112   1HB   ASN  15          2HB       ASN  15 -24.661  -3.486 -12.351
  113   2HB   ASN  15          1HB       ASN  15 -24.014  -5.116 -12.477
  114   1HD2  ASN  15          1HD2      ASN  15 -24.816  -2.893 -10.247
  115   2HD2  ASN  15          2HD2      ASN  15 -23.631  -3.158  -9.067
  116    H    HIS  16           H        HIS  16 -24.331  -2.427 -14.649
  117    HA   HIS  16           HA       HIS  16 -24.182  -4.416 -16.848
  118   1HB   HIS  16          2HB       HIS  16 -26.082  -2.171 -16.126
  119   2HB   HIS  16          1HB       HIS  16 -26.343  -3.348 -17.395
  120    HD1  HIS  16           HD1      HIS  16 -27.124  -5.679 -16.758
  121    HD2  HIS  16           HD2      HIS  16 -26.002  -3.346 -13.497
  122    HE1  HIS  16           HE1      HIS  16 -27.738  -7.010 -14.676
  123    H    GLY  17           H        GLY  17 -22.986  -1.307 -16.056
  124   1HA   GLY  17          2HA       GLY  17 -21.300  -0.427 -17.692
  125   2HA   GLY  17          1HA       GLY  17 -22.464  -0.801 -18.964
  126    H    LEU  18           H        LEU  18 -23.384   0.591 -15.886
  127    HA   LEU  18           HA       LEU  18 -24.336   3.007 -17.356
  128   1HB   LEU  18          2HB       LEU  18 -25.551   1.213 -15.677
  129   2HB   LEU  18          1HB       LEU  18 -25.120   2.500 -14.552
  130    HG   LEU  18           HG       LEU  18 -27.367   2.852 -15.531
  131   1HD1  LEU  18          1HD1      LEU  18 -27.023   5.087 -15.547
  132   2HD1  LEU  18          2HD1      LEU  18 -25.875   4.990 -16.882
  133   3HD1  LEU  18          3HD1      LEU  18 -25.338   4.677 -15.232
  134   1HD2  LEU  18          1HD2      LEU  18 -26.596   3.688 -18.158
  135   2HD2  LEU  18          2HD2      LEU  18 -27.715   2.402 -17.711
  136   3HD2  LEU  18          3HD2      LEU  18 -25.999   2.047 -17.910
  137    H    LYS  19           H        LYS  19 -23.940   5.108 -16.390
  138    HA   LYS  19           HA       LYS  19 -22.011   5.309 -14.160
  139   1HB   LYS  19          2HB       LYS  19 -21.086   5.139 -16.722
  140   2HB   LYS  19          1HB       LYS  19 -21.327   6.881 -16.583
  141   1HG   LYS  19          2HG       LYS  19 -19.050   6.247 -15.873
  142   2HG   LYS  19          1HG       LYS  19 -19.972   6.912 -14.525
  143   1HD   LYS  19          2HD       LYS  19 -19.990   4.934 -13.396
  144   2HD   LYS  19          1HD       LYS  19 -20.233   3.990 -14.866
  145   1HE   LYS  19          2HE       LYS  19 -17.643   5.091 -15.105
  146   2HE   LYS  19          1HE       LYS  19 -17.765   4.489 -13.441
  147   1HZ   LYS  19          1HZ       LYS  19 -18.338   2.376 -14.152
  148   2HZ   LYS  19          2HZ       LYS  19 -17.175   2.829 -15.306
  149   3HZ   LYS  19          3HZ       LYS  19 -18.829   2.902 -15.688
  150    H    ILE  20           H        ILE  20 -23.733   6.374 -13.093
  151    HA   ILE  20           HA       ILE  20 -24.779   8.872 -14.335
  152    HB   ILE  20           HB       ILE  20 -26.746   8.272 -13.367
  153   1HG1  ILE  20          2HG1      ILE  20 -25.561   8.862 -11.084
  154   2HG1  ILE  20          1HG1      ILE  20 -27.128   8.107 -11.157
  155   1HG2  ILE  20          1HG2      ILE  20 -25.933   6.142 -14.290
  156   2HG2  ILE  20          2HG2      ILE  20 -27.092   5.944 -12.981
  157   3HG2  ILE  20          3HG2      ILE  20 -25.372   5.699 -12.683
  158   1HD1  ILE  20          1HD1      ILE  20 -25.654   6.939  -9.617
  159   2HD1  ILE  20          2HD1      ILE  20 -24.525   6.633 -10.925
  160   3HD1  ILE  20          3HD1      ILE  20 -26.127   5.904 -10.952
  161    H    THR  21           H        THR  21 -22.423   7.935 -12.105
  162    HA   THR  21           HA       THR  21 -21.025   9.336 -10.755
  163    HB   THR  21           HB       THR  21 -23.081  11.517 -10.998
  164    HG1  THR  21           HG1      THR  21 -21.235  10.667 -12.975
  165   1HG2  THR  21          1HG2      THR  21 -21.083  11.902  -9.621
  166   2HG2  THR  21          2HG2      THR  21 -21.043  12.921 -11.060
  167   3HG2  THR  21          3HG2      THR  21 -20.050  11.466 -10.982
  168    H    LEU  22           H        LEU  22 -24.073   8.289 -10.182
  169    HA   LEU  22           HA       LEU  22 -25.398   7.904  -8.255
  170   1HB   LEU  22          2HB       LEU  22 -23.554   6.666  -7.529
  171   2HB   LEU  22          1HB       LEU  22 -22.530   8.090  -7.370
  172    HG   LEU  22           HG       LEU  22 -23.748   8.815  -5.399
  173   1HD1  LEU  22          1HD1      LEU  22 -25.457   6.334  -5.604
  174   2HD1  LEU  22          2HD1      LEU  22 -25.958   7.854  -6.345
  175   3HD1  LEU  22          3HD1      LEU  22 -25.714   7.761  -4.600
  176   1HD2  LEU  22          1HD2      LEU  22 -21.976   7.098  -5.100
  177   2HD2  LEU  22          2HD2      LEU  22 -23.199   5.836  -5.247
  178   3HD2  LEU  22          3HD2      LEU  22 -23.245   6.954  -3.884
  179    H    LYS  23           H        LYS  23 -24.565  10.881  -9.079
  180    HA   LYS  23           HA       LYS  23 -24.791  12.343  -6.571
  181   1HB   LYS  23          2HB       LYS  23 -24.925  12.953  -9.522
  182   2HB   LYS  23          1HB       LYS  23 -25.331  14.202  -8.344
  183   1HG   LYS  23          2HG       LYS  23 -22.762  12.622  -8.167
  184   2HG   LYS  23          1HG       LYS  23 -22.882  14.105  -9.116
  185   1HD   LYS  23          2HD       LYS  23 -22.387  15.177  -7.181
  186   2HD   LYS  23          1HD       LYS  23 -24.057  14.833  -6.726
  187   1HE   LYS  23          2HE       LYS  23 -22.956  13.874  -4.913
  188   2HE   LYS  23          1HE       LYS  23 -22.964  12.481  -6.014
  189   1HZ   LYS  23          1HZ       LYS  23 -20.727  12.738  -5.434
  190   2HZ   LYS  23          2HZ       LYS  23 -20.791  14.432  -5.539
  191   3HZ   LYS  23          3HZ       LYS  23 -20.841  13.490  -6.951
  192    H    GLY  24           H        GLY  24 -26.726  12.143  -5.416
  193   1HA   GLY  24          2HA       GLY  24 -29.053  11.910  -5.044
  194   2HA   GLY  24          1HA       GLY  24 -29.190  13.160  -6.292
  195    H    HIS  25           H        HIS  25 -28.307   9.711  -6.154
  196    HA   HIS  25           HA       HIS  25 -29.958   9.274  -8.620
  197   1HB   HIS  25          2HB       HIS  25 -27.562   9.182  -8.948
  198   2HB   HIS  25          1HB       HIS  25 -27.374   8.101  -7.573
  199    HD1  HIS  25           HD1      HIS  25 -29.346   8.062 -10.859
  200    HD2  HIS  25           HD2      HIS  25 -27.065   5.538  -8.465
  201    HE1  HIS  25           HE1      HIS  25 -28.999   5.911 -12.150
  202    H    LYS  26           H        LYS  26 -28.506   6.536  -7.115
  203    HA   LYS  26           HA       LYS  26 -29.538   4.593  -6.265
  204   1HB   LYS  26          2HB       LYS  26 -30.697   6.881  -4.641
  205   2HB   LYS  26          1HB       LYS  26 -30.822   5.187  -4.164
  206   1HG   LYS  26          2HG       LYS  26 -28.271   5.094  -4.382
  207   2HG   LYS  26          1HG       LYS  26 -28.319   6.855  -4.461
  208   1HD   LYS  26          2HD       LYS  26 -27.954   6.223  -2.153
  209   2HD   LYS  26          1HD       LYS  26 -29.598   6.849  -2.295
  210   1HE   LYS  26          2HE       LYS  26 -29.591   4.005  -2.841
  211   2HE   LYS  26          1HE       LYS  26 -28.845   4.331  -1.262
  212   1HZ   LYS  26          1HZ       LYS  26 -31.484   5.275  -2.240
  213   2HZ   LYS  26          2HZ       LYS  26 -30.728   5.902  -0.853
  214   3HZ   LYS  26          3HZ       LYS  26 -31.179   4.265  -0.913
  215    H    ARG  27           H        ARG  27 -32.386   6.449  -5.426
  216    HA   ARG  27           HA       ARG  27 -34.295   4.750  -6.546
  217   1HB   ARG  27          2HB       ARG  27 -34.465   6.878  -5.063
  218   2HB   ARG  27          1HB       ARG  27 -34.548   7.762  -6.587
  219   1HG   ARG  27          2HG       ARG  27 -36.779   7.363  -6.470
  220   2HG   ARG  27          1HG       ARG  27 -36.357   5.738  -7.012
  221   1HD   ARG  27          2HD       ARG  27 -37.367   5.042  -5.087
  222   2HD   ARG  27          1HD       ARG  27 -35.896   5.615  -4.275
  223    HE   ARG  27           HE       ARG  27 -38.477   6.961  -4.243
  224   1HH1  ARG  27          1HH2      ARG  27 -36.338   7.042  -2.088
  225   2HH1  ARG  27          2HH2      ARG  27 -35.818   8.692  -2.186
  226   1HH2  ARG  27          1HH1      ARG  27 -37.260   9.238  -5.293
  227   2HH2  ARG  27          2HH1      ARG  27 -36.338   9.935  -4.002
  228    H    TYR  28           H        TYR  28 -32.206   7.033  -8.160
  229    HA   TYR  28           HA       TYR  28 -33.731   6.915 -10.702
  230   1HB   TYR  28          2HB       TYR  28 -31.105   8.238  -9.939
  231   2HB   TYR  28          1HB       TYR  28 -32.061   8.578 -11.385
  232    HD1  TYR  28           HD1      TYR  28 -31.312  10.722  -9.454
  233    HD2  TYR  28           HD2      TYR  28 -34.705   8.092  -9.526
  234    HE1  TYR  28           HE1      TYR  28 -32.633  12.392  -8.183
  235    HE2  TYR  28           HE2      TYR  28 -36.026   9.763  -8.256
  236    HH   TYR  28           HH       TYR  28 -34.806  12.986  -7.640
  237    H    CYS  29           H        CYS  29 -32.058   4.630  -9.327
  238    HA   CYS  29           HA       CYS  29 -29.994   4.130 -11.389
  239   1HB   CYS  29          2HB       CYS  29 -29.743   3.744  -8.885
  240   2HB   CYS  29          1HB       CYS  29 -30.886   2.417  -9.060
  241    H    LYS  30           H        LYS  30 -30.713   3.150 -13.291
  242    HA   LYS  30           HA       LYS  30 -33.160   1.764 -13.652
  243   1HB   LYS  30          2HB       LYS  30 -30.794   2.357 -15.086
  244   2HB   LYS  30          1HB       LYS  30 -30.973   0.604 -15.174
  245   1HG   LYS  30          2HG       LYS  30 -33.537   1.891 -15.555
  246   2HG   LYS  30          1HG       LYS  30 -32.357   2.527 -16.702
  247   1HD   LYS  30          2HD       LYS  30 -31.745   0.182 -17.309
  248   2HD   LYS  30          1HD       LYS  30 -33.031  -0.395 -16.248
  249   1HE   LYS  30          2HE       LYS  30 -33.712   1.651 -18.340
  250   2HE   LYS  30          1HE       LYS  30 -33.531  -0.048 -18.821
  251   1HZ   LYS  30          1HZ       LYS  30 -35.786   0.323 -18.109
  252   2HZ   LYS  30          2HZ       LYS  30 -35.260   0.999 -16.643
  253   3HZ   LYS  30          3HZ       LYS  30 -35.005  -0.650 -16.962
  254    H    PHE  31           H        PHE  31 -30.235   0.883 -12.067
  255    HA   PHE  31           HA       PHE  31 -30.999  -1.990 -11.807
  256   1HB   PHE  31          2HB       PHE  31 -28.448  -0.436 -11.189
  257   2HB   PHE  31          1HB       PHE  31 -28.568  -2.200 -11.264
  258    HD1  PHE  31           HD1      PHE  31 -28.753   0.935 -13.214
  259    HD2  PHE  31           HD2      PHE  31 -28.745  -3.353 -13.382
  260    HE1  PHE  31           HE1      PHE  31 -28.497   1.039 -15.668
  261    HE2  PHE  31           HE2      PHE  31 -28.504  -3.255 -15.841
  262    HZ   PHE  31           HZ       PHE  31 -28.368  -1.060 -16.994
  263    H    ARG  32           H        ARG  32 -31.940   0.635 -10.350
  264    HA   ARG  32           HA       ARG  32 -31.153   0.792  -7.687
  265   1HB   ARG  32          2HB       ARG  32 -33.309   1.820  -7.350
  266   2HB   ARG  32          1HB       ARG  32 -32.806   2.202  -8.993
  267   1HG   ARG  32          2HG       ARG  32 -34.283  -0.316  -8.871
  268   2HG   ARG  32          1HG       ARG  32 -35.227   1.028  -8.241
  269   1HD   ARG  32          2HD       ARG  32 -34.379   2.275 -10.403
  270   2HD   ARG  32          1HD       ARG  32 -34.122   0.627 -11.009
  271    HE   ARG  32           HE       ARG  32 -36.713   1.858 -10.506
  272   1HH1  ARG  32          1HH2      ARG  32 -34.867  -1.049 -10.742
  273   2HH1  ARG  32          2HH2      ARG  32 -36.257  -2.072 -10.887
  274   1HH2  ARG  32          1HH1      ARG  32 -38.538   0.519 -10.587
  275   2HH2  ARG  32          2HH1      ARG  32 -38.331  -1.187 -10.799
  276    H    TYR  33           H        TYR  33 -32.878  -1.770  -9.247
  277    HA   TYR  33           HA       TYR  33 -33.174  -3.131  -6.594
  278   1HB   TYR  33          2HB       TYR  33 -35.174  -2.716  -8.821
  279   2HB   TYR  33          1HB       TYR  33 -35.375  -4.001  -7.629
  280    HD1  TYR  33           HD1      TYR  33 -36.361  -0.769  -8.349
  281    HD2  TYR  33           HD2      TYR  33 -34.765  -3.082  -5.101
  282    HE1  TYR  33           HE1      TYR  33 -37.279   0.871  -6.728
  283    HE2  TYR  33           HE2      TYR  33 -35.681  -1.443  -3.482
  284    HH   TYR  33           HH       TYR  33 -36.913   1.611  -4.454
  285    H    CYS  34           H        CYS  34 -31.773  -3.254  -9.603
  286    HA   CYS  34           HA       CYS  34 -32.178  -5.771 -10.711
  287   1HB   CYS  34          2HB       CYS  34 -30.531  -3.992 -11.439
  288   2HB   CYS  34          1HB       CYS  34 -29.492  -4.509 -10.111
  289    H    THR  35           H        THR  35 -30.761  -7.769 -10.391
  290    HA   THR  35           HA       THR  35 -29.908  -8.164  -7.558
  291    HB   THR  35           HB       THR  35 -31.220 -10.522  -8.360
  292    HG1  THR  35           HG1      THR  35 -32.932  -8.327  -8.789
  293   1HG2  THR  35          1HG2      THR  35 -31.718  -8.268  -6.467
  294   2HG2  THR  35          2HG2      THR  35 -31.451  -9.978  -6.130
  295   3HG2  THR  35          3HG2      THR  35 -33.018  -9.431  -6.727
  296    H    CYS  36           H        CYS  36 -29.055  -8.373 -10.768
  297    HA   CYS  36           HA       CYS  36 -27.940 -10.881 -11.230
  298   1HB   CYS  36          2HB       CYS  36 -26.427  -9.738 -12.688
  299   2HB   CYS  36          1HB       CYS  36 -27.905  -8.778 -12.662
  300    H    GLU  37           H        GLU  37 -25.592 -11.585 -10.856
  301    HA   GLU  37           HA       GLU  37 -24.934 -11.370  -8.039
  302   1HB   GLU  37          2HB       GLU  37 -23.339 -13.021  -8.571
  303   2HB   GLU  37          1HB       GLU  37 -24.584 -13.268  -9.793
  304   1HG   GLU  37          2HG       GLU  37 -22.915 -13.080 -11.311
  305   2HG   GLU  37          1HG       GLU  37 -22.953 -11.353 -10.955
  306    H    LYS  38           H        LYS  38 -24.425  -9.178 -10.491
  307    HA   LYS  38           HA       LYS  38 -21.746  -8.288  -9.537
  308   1HB   LYS  38          2HB       LYS  38 -23.572  -7.502 -11.834
  309   2HB   LYS  38          1HB       LYS  38 -22.013  -6.737 -11.521
  310   1HG   LYS  38          2HG       LYS  38 -21.761  -9.627 -11.503
  311   2HG   LYS  38          1HG       LYS  38 -22.464  -9.069 -13.021
  312   1HD   LYS  38          2HD       LYS  38 -20.593  -7.332 -13.092
  313   2HD   LYS  38          1HD       LYS  38 -19.838  -8.234 -11.779
  314   1HE   LYS  38          2HE       LYS  38 -18.936  -9.609 -13.338
  315   2HE   LYS  38          1HE       LYS  38 -20.579 -10.156 -13.730
  316   1HZ   LYS  38          1HZ       LYS  38 -19.649  -7.559 -14.743
  317   2HZ   LYS  38          2HZ       LYS  38 -20.803  -8.619 -15.400
  318   3HZ   LYS  38          3HZ       LYS  38 -19.146  -8.971 -15.538
  319    H    CYS  39           H        CYS  39 -25.096  -7.651  -9.271
  320    HA   CYS  39           HA       CYS  39 -24.764  -4.880  -8.314
  321   1HB   CYS  39          2HB       CYS  39 -26.880  -6.747  -9.217
  322   2HB   CYS  39          1HB       CYS  39 -27.367  -5.670  -7.926
  323    H    ARG  40           H        ARG  40 -25.432  -8.159  -7.191
  324    HA   ARG  40           HA       ARG  40 -25.987  -7.439  -4.432
  325   1HB   ARG  40          2HB       ARG  40 -25.077 -10.043  -5.707
  326   2HB   ARG  40          1HB       ARG  40 -25.831  -9.883  -4.120
  327   1HG   ARG  40          2HG       ARG  40 -27.793  -8.768  -5.360
  328   2HG   ARG  40          1HG       ARG  40 -27.072  -9.416  -6.831
  329   1HD   ARG  40          2HD       ARG  40 -27.971 -11.027  -4.417
  330   2HD   ARG  40          1HD       ARG  40 -28.720 -11.022  -6.024
  331    HE   ARG  40           HE       ARG  40 -25.907 -11.629  -6.223
  332   1HH1  ARG  40          1HH2      ARG  40 -27.466 -13.336  -4.041
  333   2HH1  ARG  40          2HH2      ARG  40 -27.715 -14.782  -4.962
  334   1HH2  ARG  40          1HH1      ARG  40 -26.880 -13.316  -7.990
  335   2HH2  ARG  40          2HH1      ARG  40 -27.384 -14.770  -7.196
  336    H    LEU  41           H        LEU  41 -23.180  -8.641  -6.239
  337    HA   LEU  41           HA       LEU  41 -21.384  -8.766  -3.995
  338   1HB   LEU  41          2HB       LEU  41 -19.890  -9.447  -5.613
  339   2HB   LEU  41          1HB       LEU  41 -21.356  -9.595  -6.575
  340    HG   LEU  41           HG       LEU  41 -20.939  -7.127  -7.236
  341   1HD1  LEU  41          1HD1      LEU  41 -18.632  -7.711  -5.545
  342   2HD1  LEU  41          2HD1      LEU  41 -19.208  -6.159  -6.152
  343   3HD1  LEU  41          3HD1      LEU  41 -18.150  -7.157  -7.148
  344   1HD2  LEU  41          1HD2      LEU  41 -20.486  -9.326  -8.570
  345   2HD2  LEU  41          2HD2      LEU  41 -18.790  -9.002  -8.212
  346   3HD2  LEU  41          3HD2      LEU  41 -19.735  -7.833  -9.133
  347    H    THR  42           H        THR  42 -22.385  -6.240  -6.195
  348    HA   THR  42           HA       THR  42 -20.425  -4.249  -5.564
  349    HB   THR  42           HB       THR  42 -23.279  -4.276  -6.530
  350    HG1  THR  42           HG1      THR  42 -20.984  -4.689  -7.671
  351   1HG2  THR  42          1HG2      THR  42 -22.645  -1.810  -7.191
  352   2HG2  THR  42          2HG2      THR  42 -21.532  -1.941  -5.831
  353   3HG2  THR  42          3HG2      THR  42 -23.263  -2.153  -5.575
  354    H    ALA  43           H        ALA  43 -23.815  -4.289  -4.542
  355    HA   ALA  43           HA       ALA  43 -23.779  -2.477  -2.442
  356   1HB   ALA  43          1HB       ALA  43 -25.173  -5.044  -1.908
  357   2HB   ALA  43          2HB       ALA  43 -25.507  -4.331  -3.486
  358   3HB   ALA  43          3HB       ALA  43 -25.839  -3.414  -2.017
  359    H    ASP  44           H        ASP  44 -22.458  -5.706  -2.583
  360    HA   ASP  44           HA       ASP  44 -21.891  -5.948   0.275
  361   1HB   ASP  44          2HB       ASP  44 -22.187  -7.605  -1.899
  362   2HB   ASP  44          1HB       ASP  44 -20.433  -7.581  -1.709
  363    H    ARG  45           H        ARG  45 -20.064  -5.203  -2.692
  364    HA   ARG  45           HA       ARG  45 -17.445  -5.073  -1.630
  365   1HB   ARG  45          2HB       ARG  45 -18.772  -4.583  -4.022
  366   2HB   ARG  45          1HB       ARG  45 -18.123  -3.000  -3.596
  367   1HG   ARG  45          2HG       ARG  45 -16.452  -5.524  -3.567
  368   2HG   ARG  45          1HG       ARG  45 -16.566  -4.462  -4.971
  369   1HD   ARG  45          2HD       ARG  45 -15.521  -2.658  -3.838
  370   2HD   ARG  45          1HD       ARG  45 -15.796  -3.392  -2.246
  371    HE   ARG  45           HE       ARG  45 -14.256  -5.169  -3.911
  372   1HH1  ARG  45          1HH2      ARG  45 -13.995  -2.072  -2.439
  373   2HH1  ARG  45          2HH2      ARG  45 -12.362  -2.308  -1.914
  374   1HH2  ARG  45          1HH1      ARG  45 -12.179  -5.573  -3.068
  375   2HH2  ARG  45          2HH1      ARG  45 -11.336  -4.291  -2.266
  376    H    GLN  46           H        GLN  46 -20.058  -2.669  -1.588
  377    HA   GLN  46           HA       GLN  46 -18.308  -0.844   0.021
  378   1HB   GLN  46          2HB       GLN  46 -20.099  -0.534  -2.201
  379   2HB   GLN  46          1HB       GLN  46 -20.744   0.375  -0.835
  380   1HG   GLN  46          2HG       GLN  46 -18.656   1.573  -0.569
  381   2HG   GLN  46          1HG       GLN  46 -17.873   0.565  -1.786
  382   1HE2  GLN  46          1HE2      GLN  46 -18.482   0.901  -4.053
  383   2HE2  GLN  46          2HE2      GLN  46 -19.300   2.305  -4.541
  384    H    ARG  47           H        ARG  47 -21.824  -1.452  -0.254
  385    HA   ARG  47           HA       ARG  47 -22.386  -0.772   2.475
  386   1HB   ARG  47          2HB       ARG  47 -24.364  -0.711   1.369
  387   2HB   ARG  47          1HB       ARG  47 -23.714  -1.681   0.053
  388   1HG   ARG  47          2HG       ARG  47 -25.576  -2.891   0.991
  389   2HG   ARG  47          1HG       ARG  47 -24.104  -3.727   1.487
  390   1HD   ARG  47          2HD       ARG  47 -25.351  -3.581   3.499
  391   2HD   ARG  47          1HD       ARG  47 -24.249  -2.194   3.612
  392    HE   ARG  47           HE       ARG  47 -26.147  -0.810   3.442
  393   1HH1  ARG  47          1HH2      ARG  47 -27.340  -3.889   3.302
  394   2HH1  ARG  47          2HH2      ARG  47 -28.686  -3.538   2.270
  395   1HH2  ARG  47          1HH1      ARG  47 -27.615  -0.326   1.523
  396   2HH2  ARG  47          2HH1      ARG  47 -28.843  -1.520   1.266
  397    H    VAL  48           H        VAL  48 -22.355  -2.047   4.317
  398    HA   VAL  48           HA       VAL  48 -21.641  -4.942   3.966
  399    HB   VAL  48           HB       VAL  48 -20.948  -3.018   6.212
  400   1HG1  VAL  48          1HG1      VAL  48 -20.892  -5.849   6.038
  401   2HG1  VAL  48          2HG1      VAL  48 -20.208  -4.838   7.310
  402   3HG1  VAL  48          3HG1      VAL  48 -19.219  -5.303   5.926
  403   1HG2  VAL  48          1HG2      VAL  48 -19.163  -2.340   5.005
  404   2HG2  VAL  48          2HG2      VAL  48 -19.904  -3.120   3.608
  405   3HG2  VAL  48          3HG2      VAL  48 -18.738  -4.001   4.595
  406    H    MET  49           H        MET  49 -23.162  -6.329   4.779
  407    HA   MET  49           HA       MET  49 -25.456  -5.286   6.288
  408   1HB   MET  49          2HB       MET  49 -26.356  -7.469   5.862
  409   2HB   MET  49          1HB       MET  49 -25.437  -7.035   4.420
  410   1HG   MET  49          2HG       MET  49 -23.455  -8.220   5.697
  411   2HG   MET  49          1HG       MET  49 -24.765  -9.019   6.565
  412   1HE   MET  49          1HE       MET  49 -22.827 -11.002   3.779
  413   2HE   MET  49          2HE       MET  49 -22.385  -9.562   4.694
  414   3HE   MET  49          3HE       MET  49 -22.721  -9.433   2.970
  415    H    ALA  50           H        ALA  50 -25.946  -5.818   8.458
  416    HA   ALA  50           HA       ALA  50 -23.809  -7.262   9.992
  417   1HB   ALA  50          1HB       ALA  50 -23.441  -5.348  11.133
  418   2HB   ALA  50          2HB       ALA  50 -25.153  -5.232  11.539
  419   3HB   ALA  50          3HB       ALA  50 -24.553  -4.523  10.039
  420    H    LEU  51           H        LEU  51 -26.893  -7.496   8.987
  421    HA   LEU  51           HA       LEU  51 -27.825  -8.733  11.559
  422   1HB   LEU  51          2HB       LEU  51 -29.116  -6.926   9.546
  423   2HB   LEU  51          1HB       LEU  51 -30.130  -8.097  10.389
  424    HG   LEU  51           HG       LEU  51 -28.253  -6.599  12.115
  425   1HD1  LEU  51          1HD1      LEU  51 -30.581  -5.255  10.710
  426   2HD1  LEU  51          2HD1      LEU  51 -28.884  -4.782  10.631
  427   3HD1  LEU  51          3HD1      LEU  51 -29.779  -4.603  12.140
  428   1HD2  LEU  51          1HD2      LEU  51 -30.562  -6.385  13.342
  429   2HD2  LEU  51          2HD2      LEU  51 -29.780  -7.963  13.261
  430   3HD2  LEU  51          3HD2      LEU  51 -31.102  -7.574  12.158
  431    H    GLN  52           H        GLN  52 -26.532 -10.534  10.177
  432    HA   GLN  52           HA       GLN  52 -28.226 -11.755   8.076
  433   1HB   GLN  52          2HB       GLN  52 -26.280 -13.209   7.795
  434   2HB   GLN  52          1HB       GLN  52 -25.738 -11.536   7.911
  435   1HG   GLN  52          2HG       GLN  52 -25.956 -12.957  10.496
  436   2HG   GLN  52          1HG       GLN  52 -24.709 -13.571   9.410
  437   1HE2  GLN  52          1HE2      GLN  52 -23.781 -12.351  11.704
  438   2HE2  GLN  52          2HE2      GLN  52 -23.149 -10.814  11.354
  Start of MODEL    9
    1   1H    SER   1          1H        SER   1 -27.761   1.176   3.480
    2   2H    SER   1          2H        SER   1 -29.405   1.261   3.059
    3   3H    SER   1          3H        SER   1 -28.786   2.268   4.279
    4    HA   SER   1           HA       SER   1 -27.917   2.393   1.436
    5   1HB   SER   1          2HB       SER   1 -30.390   2.855   2.061
    6   2HB   SER   1          1HB       SER   1 -29.772   4.272   2.904
    7    HG   SER   1           HG       SER   1 -28.607   4.530   0.718
    8    H    ILE   2           H        ILE   2 -25.802   2.433   2.881
    9    HA   ILE   2           HA       ILE   2 -25.331   5.266   3.759
   10    HB   ILE   2           HB       ILE   2 -23.559   4.064   5.234
   11   1HG1  ILE   2          2HG1      ILE   2 -25.417   1.718   4.784
   12   2HG1  ILE   2          1HG1      ILE   2 -23.900   1.892   3.901
   13   1HG2  ILE   2          1HG2      ILE   2 -26.238   4.758   5.627
   14   2HG2  ILE   2          2HG2      ILE   2 -25.055   4.403   6.888
   15   3HG2  ILE   2          3HG2      ILE   2 -26.110   3.125   6.284
   16   1HD1  ILE   2          1HD1      ILE   2 -24.095   1.944   6.924
   17   2HD1  ILE   2          2HD1      ILE   2 -22.623   1.881   5.954
   18   3HD1  ILE   2          3HD1      ILE   2 -23.714   0.495   5.994
   19    H    SER   3           H        SER   3 -23.669   6.290   2.683
   20    HA   SER   3           HA       SER   3 -21.783   4.585   1.085
   21   1HB   SER   3          2HB       SER   3 -23.431   7.002   0.449
   22   2HB   SER   3          1HB       SER   3 -21.872   6.832  -0.352
   23    HG   SER   3           HG       SER   3 -24.064   5.030  -0.357
   24    HA   PRO   4           HA       PRO   4 -19.408   7.330   3.955
   25   1HB   PRO   4          2HB       PRO   4 -17.721   5.377   4.861
   26   2HB   PRO   4          1HB       PRO   4 -19.300   5.707   5.598
   27   1HG   PRO   4          2HG       PRO   4 -18.499   3.544   3.726
   28   2HG   PRO   4          1HG       PRO   4 -19.634   3.502   5.084
   29   1HD   PRO   4          2HD       PRO   4 -20.381   3.659   2.445
   30   2HD   PRO   4          1HD       PRO   4 -21.381   4.213   3.805
   31    H    ARG   5           H        ARG   5 -18.591   5.053   1.437
   32    HA   ARG   5           HA       ARG   5 -16.446   6.827   0.469
   33   1HB   ARG   5          2HB       ARG   5 -16.015   4.377   2.036
   34   2HB   ARG   5          1HB       ARG   5 -15.142   4.382   0.503
   35   1HG   ARG   5          2HG       ARG   5 -15.071   6.873   2.151
   36   2HG   ARG   5          1HG       ARG   5 -14.101   5.501   2.689
   37   1HD   ARG   5          2HD       ARG   5 -13.141   5.380   0.338
   38   2HD   ARG   5          1HD       ARG   5 -13.940   6.933   0.020
   39    HE   ARG   5           HE       ARG   5 -11.890   6.521   2.163
   40   1HH1  ARG   5          1HH2      ARG   5 -13.763   8.861   2.484
   41   2HH1  ARG   5          2HH2      ARG   5 -12.869  10.136   1.723
   42   1HH2  ARG   5          1HH1      ARG   5 -10.683   7.990   0.096
   43   2HH2  ARG   5          2HH1      ARG   5 -11.123   9.643   0.375
   44    H    THR   6           H        THR   6 -17.371   6.953  -1.588
   45    HA   THR   6           HA       THR   6 -17.554   4.392  -3.120
   46    HB   THR   6           HB       THR   6 -19.674   5.752  -4.098
   47    HG1  THR   6           HG1      THR   6 -20.020   6.300  -1.406
   48   1HG2  THR   6          1HG2      THR   6 -20.408   3.727  -3.416
   49   2HG2  THR   6          2HG2      THR   6 -20.794   4.516  -1.887
   50   3HG2  THR   6          3HG2      THR   6 -19.257   3.673  -2.080
   51    HA   PRO   7           HA       PRO   7 -15.604   6.723  -6.294
   52   1HB   PRO   7          2HB       PRO   7 -16.662   5.569  -8.540
   53   2HB   PRO   7          1HB       PRO   7 -15.474   4.752  -7.505
   54   1HG   PRO   7          2HG       PRO   7 -18.422   4.399  -7.643
   55   2HG   PRO   7          1HG       PRO   7 -17.151   3.195  -7.390
   56   1HD   PRO   7          2HD       PRO   7 -18.707   4.215  -5.383
   57   2HD   PRO   7          1HD       PRO   7 -17.073   3.561  -5.138
   58    HA   PRO   8           HA       PRO   8 -18.295   9.870  -7.784
   59   1HB   PRO   8          2HB       PRO   8 -17.297  10.466 -10.257
   60   2HB   PRO   8          1HB       PRO   8 -16.453  10.882  -8.752
   61   1HG   PRO   8          2HG       PRO   8 -15.944   8.658 -10.651
   62   2HG   PRO   8          1HG       PRO   8 -14.800   9.625  -9.712
   63   1HD   PRO   8          2HD       PRO   8 -15.596   7.077  -9.050
   64   2HD   PRO   8          1HD       PRO   8 -14.957   8.264  -7.892
   65    H    ASN   9           H        ASN   9 -19.580   7.468  -8.081
   66    HA   ASN   9           HA       ASN   9 -21.500   7.920 -10.161
   67   1HB   ASN   9          2HB       ASN   9 -20.833   6.230 -11.760
   68   2HB   ASN   9          1HB       ASN   9 -19.442   7.278 -11.493
   69   1HD2  ASN   9          1HD2      ASN   9 -17.590   6.004 -11.411
   70   2HD2  ASN   9          2HD2      ASN   9 -17.465   4.514 -10.609
   71    H    CYS  10           H        CYS  10 -23.049   6.098 -10.284
   72    HA   CYS  10           HA       CYS  10 -23.389   4.818  -7.672
   73   1HB   CYS  10          2HB       CYS  10 -25.263   5.767  -8.950
   74   2HB   CYS  10          1HB       CYS  10 -24.886   4.750 -10.302
   75    H    ALA  11           H        ALA  11 -22.797   2.677  -7.205
   76    HA   ALA  11           HA       ALA  11 -21.440   1.174  -9.306
   77   1HB   ALA  11          1HB       ALA  11 -20.401   1.067  -7.196
   78   2HB   ALA  11          2HB       ALA  11 -21.226  -0.488  -7.322
   79   3HB   ALA  11          3HB       ALA  11 -21.937   0.813  -6.366
   80    H    ARG  12           H        ARG  12 -24.567   1.188  -7.857
   81    HA   ARG  12           HA       ARG  12 -25.423  -1.492  -8.357
   82   1HB   ARG  12          2HB       ARG  12 -26.520   0.409  -7.077
   83   2HB   ARG  12          1HB       ARG  12 -26.955   1.109  -8.628
   84   1HG   ARG  12          2HG       ARG  12 -28.725  -0.222  -8.762
   85   2HG   ARG  12          1HG       ARG  12 -27.681  -1.639  -8.679
   86   1HD   ARG  12          2HD       ARG  12 -29.016  -0.169  -6.389
   87   2HD   ARG  12          1HD       ARG  12 -29.128  -1.890  -6.802
   88    HE   ARG  12           HE       ARG  12 -27.026  -0.706  -5.230
   89   1HH1  ARG  12          1HH2      ARG  12 -28.107  -3.567  -6.519
   90   2HH1  ARG  12          2HH2      ARG  12 -26.549  -4.303  -6.692
   91   1HH2  ARG  12          1HH1      ARG  12 -24.802  -1.394  -5.972
   92   2HH2  ARG  12          2HH1      ARG  12 -24.677  -3.072  -6.384
   93    H    CYS  13           H        CYS  13 -25.662   1.416 -10.356
   94    HA   CYS  13           HA       CYS  13 -26.654  -0.141 -12.618
   95   1HB   CYS  13          2HB       CYS  13 -26.695   2.134 -13.677
   96   2HB   CYS  13          1HB       CYS  13 -27.476   2.101 -12.115
   97    H    ARG  14           H        ARG  14 -23.375   0.851 -11.599
   98    HA   ARG  14           HA       ARG  14 -22.263   0.801 -14.297
   99   1HB   ARG  14          2HB       ARG  14 -20.100   0.341 -13.059
  100   2HB   ARG  14          1HB       ARG  14 -20.970   1.766 -12.497
  101   1HG   ARG  14          2HG       ARG  14 -20.275   0.551 -10.549
  102   2HG   ARG  14          1HG       ARG  14 -21.999   0.326 -10.725
  103   1HD   ARG  14          2HD       ARG  14 -21.750  -1.909 -10.788
  104   2HD   ARG  14          1HD       ARG  14 -20.596  -1.772 -12.128
  105    HE   ARG  14           HE       ARG  14 -19.805  -1.413  -9.263
  106   1HH1  ARG  14          1HH2      ARG  14 -18.143  -0.617 -11.813
  107   2HH1  ARG  14          2HH2      ARG  14 -17.010  -1.927 -11.833
  108   1HH2  ARG  14          1HH1      ARG  14 -18.801  -3.858  -9.577
  109   2HH2  ARG  14          2HH1      ARG  14 -17.382  -3.762 -10.565
  110    H    ASN  15           H        ASN  15 -23.151  -1.614 -11.989
  111    HA   ASN  15           HA       ASN  15 -21.693  -3.859 -12.601
  112   1HB   ASN  15          2HB       ASN  15 -24.629  -3.368 -12.123
  113   2HB   ASN  15          1HB       ASN  15 -23.962  -4.994 -12.160
  114   1HD2  ASN  15          1HD2      ASN  15 -24.861  -2.733 -10.031
  115   2HD2  ASN  15          2HD2      ASN  15 -23.684  -2.898  -8.828
  116    H    HIS  16           H        HIS  16 -24.207  -2.340 -14.446
  117    HA   HIS  16           HA       HIS  16 -24.054  -4.388 -16.593
  118   1HB   HIS  16          2HB       HIS  16 -25.897  -2.072 -15.950
  119   2HB   HIS  16          1HB       HIS  16 -26.152  -3.225 -17.242
  120    HD1  HIS  16           HD1      HIS  16 -27.094  -5.495 -16.672
  121    HD2  HIS  16           HD2      HIS  16 -25.922  -3.299 -13.329
  122    HE1  HIS  16           HE1      HIS  16 -27.833  -6.834 -14.639
  123    H    GLY  17           H        GLY  17 -22.898  -1.233 -15.836
  124   1HA   GLY  17          2HA       GLY  17 -21.106  -0.405 -17.383
  125   2HA   GLY  17          1HA       GLY  17 -22.181  -0.832 -18.716
  126    H    LEU  18           H        LEU  18 -23.452   0.568 -15.808
  127    HA   LEU  18           HA       LEU  18 -24.321   2.942 -17.365
  128   1HB   LEU  18          2HB       LEU  18 -25.545   1.206 -15.633
  129   2HB   LEU  18          1HB       LEU  18 -25.142   2.544 -14.556
  130    HG   LEU  18           HG       LEU  18 -27.366   2.874 -15.536
  131   1HD1  LEU  18          1HD1      LEU  18 -25.805   4.857 -17.073
  132   2HD1  LEU  18          2HD1      LEU  18 -25.367   4.704 -15.372
  133   3HD1  LEU  18          3HD1      LEU  18 -27.025   5.103 -15.823
  134   1HD2  LEU  18          1HD2      LEU  18 -25.911   2.075 -17.958
  135   2HD2  LEU  18          2HD2      LEU  18 -26.911   3.509 -18.194
  136   3HD2  LEU  18          3HD2      LEU  18 -27.640   2.011 -17.617
  137    H    LYS  19           H        LYS  19 -23.923   5.081 -16.530
  138    HA   LYS  19           HA       LYS  19 -22.064   5.387 -14.247
  139   1HB   LYS  19          2HB       LYS  19 -21.506   5.974 -17.153
  140   2HB   LYS  19          1HB       LYS  19 -20.703   6.915 -15.893
  141   1HG   LYS  19          2HG       LYS  19 -20.654   3.890 -16.124
  142   2HG   LYS  19          1HG       LYS  19 -19.331   4.968 -16.567
  143   1HD   LYS  19          2HD       LYS  19 -20.240   5.584 -13.895
  144   2HD   LYS  19          1HD       LYS  19 -19.857   3.867 -14.016
  145   1HE   LYS  19          2HE       LYS  19 -17.744   4.734 -13.532
  146   2HE   LYS  19          1HE       LYS  19 -17.709   4.807 -15.305
  147   1HZ   LYS  19          1HZ       LYS  19 -18.951   7.056 -14.851
  148   2HZ   LYS  19          2HZ       LYS  19 -17.254   6.977 -14.816
  149   3HZ   LYS  19          3HZ       LYS  19 -18.140   6.964 -13.365
  150    H    ILE  20           H        ILE  20 -23.873   6.432 -13.297
  151    HA   ILE  20           HA       ILE  20 -24.929   8.869 -14.626
  152    HB   ILE  20           HB       ILE  20 -26.875   8.300 -13.585
  153   1HG1  ILE  20          2HG1      ILE  20 -25.667   8.982 -11.357
  154   2HG1  ILE  20          1HG1      ILE  20 -27.209   8.178 -11.371
  155   1HG2  ILE  20          1HG2      ILE  20 -27.203   5.992 -13.125
  156   2HG2  ILE  20          2HG2      ILE  20 -25.479   5.756 -12.846
  157   3HG2  ILE  20          3HG2      ILE  20 -26.066   6.144 -14.459
  158   1HD1  ILE  20          1HD1      ILE  20 -24.561   6.778 -11.155
  159   2HD1  ILE  20          2HD1      ILE  20 -26.150   6.015 -11.100
  160   3HD1  ILE  20          3HD1      ILE  20 -25.653   7.113  -9.822
  161    H    THR  21           H        THR  21 -22.513   8.100 -12.416
  162    HA   THR  21           HA       THR  21 -21.133   9.580 -11.137
  163    HB   THR  21           HB       THR  21 -23.232  11.708 -11.487
  164    HG1  THR  21           HG1      THR  21 -22.907  11.745 -13.548
  165   1HG2  THR  21          1HG2      THR  21 -20.202  11.771 -11.513
  166   2HG2  THR  21          2HG2      THR  21 -21.208  12.134 -10.111
  167   3HG2  THR  21          3HG2      THR  21 -21.275  13.171 -11.535
  168    H    LEU  22           H        LEU  22 -24.154   8.513 -10.496
  169    HA   LEU  22           HA       LEU  22 -25.500   8.256  -8.565
  170   1HB   LEU  22          2HB       LEU  22 -23.483   7.058  -7.958
  171   2HB   LEU  22          1HB       LEU  22 -22.697   8.554  -7.455
  172    HG   LEU  22           HG       LEU  22 -25.248   8.281  -6.130
  173   1HD1  LEU  22          1HD1      LEU  22 -24.836   5.856  -6.518
  174   2HD1  LEU  22          2HD1      LEU  22 -24.781   6.283  -4.807
  175   3HD1  LEU  22          3HD1      LEU  22 -23.282   6.015  -5.698
  176   1HD2  LEU  22          1HD2      LEU  22 -22.886   9.458  -5.611
  177   2HD2  LEU  22          2HD2      LEU  22 -22.650   7.967  -4.700
  178   3HD2  LEU  22          3HD2      LEU  22 -24.015   9.021  -4.329
  179    H    LYS  23           H        LYS  23 -25.083  11.075  -9.554
  180    HA   LYS  23           HA       LYS  23 -24.991  12.692  -7.087
  181   1HB   LYS  23          2HB       LYS  23 -24.818  13.039  -9.970
  182   2HB   LYS  23          1HB       LYS  23 -25.954  14.196  -9.274
  183   1HG   LYS  23          2HG       LYS  23 -23.507  13.893  -7.687
  184   2HG   LYS  23          1HG       LYS  23 -23.205  14.492  -9.317
  185   1HD   LYS  23          2HD       LYS  23 -25.437  15.680  -7.693
  186   2HD   LYS  23          1HD       LYS  23 -23.776  16.199  -7.405
  187   1HE   LYS  23          2HE       LYS  23 -24.338  16.103 -10.259
  188   2HE   LYS  23          1HE       LYS  23 -25.477  17.170  -9.414
  189   1HZ   LYS  23          1HZ       LYS  23 -23.079  17.996 -10.081
  190   2HZ   LYS  23          2HZ       LYS  23 -22.664  17.253  -8.610
  191   3HZ   LYS  23          3HZ       LYS  23 -23.818  18.499  -8.641
  192    H    GLY  24           H        GLY  24 -26.853  12.470  -5.801
  193   1HA   GLY  24          2HA       GLY  24 -29.154  12.248  -5.282
  194   2HA   GLY  24          1HA       GLY  24 -29.383  13.440  -6.571
  195    H    HIS  25           H        HIS  25 -28.177  10.113  -6.584
  196    HA   HIS  25           HA       HIS  25 -30.021   9.485  -8.850
  197   1HB   HIS  25          2HB       HIS  25 -27.646   9.417  -9.274
  198   2HB   HIS  25          1HB       HIS  25 -27.369   8.436  -7.842
  199    HD1  HIS  25           HD1      HIS  25 -29.446   8.138 -11.047
  200    HD2  HIS  25           HD2      HIS  25 -27.043   5.818  -8.568
  201    HE1  HIS  25           HE1      HIS  25 -29.064   5.926 -12.217
  202    H    LYS  26           H        LYS  26 -28.422   6.905  -7.204
  203    HA   LYS  26           HA       LYS  26 -29.352   4.980  -6.209
  204   1HB   LYS  26          2HB       LYS  26 -30.242   7.440  -4.755
  205   2HB   LYS  26          1HB       LYS  26 -30.954   5.904  -4.261
  206   1HG   LYS  26          2HG       LYS  26 -28.956   5.069  -3.476
  207   2HG   LYS  26          1HG       LYS  26 -27.997   5.975  -4.647
  208   1HD   LYS  26          2HD       LYS  26 -29.040   8.028  -3.216
  209   2HD   LYS  26          1HD       LYS  26 -28.966   6.789  -1.962
  210   1HE   LYS  26          2HE       LYS  26 -26.583   7.276  -3.749
  211   2HE   LYS  26          1HE       LYS  26 -26.856   8.276  -2.308
  212   1HZ   LYS  26          1HZ       LYS  26 -26.736   5.307  -2.389
  213   2HZ   LYS  26          2HZ       LYS  26 -27.110   6.228  -1.011
  214   3HZ   LYS  26          3HZ       LYS  26 -25.566   6.334  -1.714
  215    H    ARG  27           H        ARG  27 -32.300   6.684  -5.440
  216    HA   ARG  27           HA       ARG  27 -34.097   4.811  -6.455
  217   1HB   ARG  27          2HB       ARG  27 -34.405   7.832  -6.482
  218   2HB   ARG  27          1HB       ARG  27 -35.703   6.645  -6.348
  219   1HG   ARG  27          2HG       ARG  27 -33.815   6.039  -4.314
  220   2HG   ARG  27          1HG       ARG  27 -34.100   7.779  -4.253
  221   1HD   ARG  27          2HD       ARG  27 -35.906   7.114  -2.975
  222   2HD   ARG  27          1HD       ARG  27 -36.653   6.899  -4.570
  223    HE   ARG  27           HE       ARG  27 -35.500   4.507  -4.345
  224   1HH1  ARG  27          1HH2      ARG  27 -37.707   6.234  -2.420
  225   2HH1  ARG  27          2HH2      ARG  27 -37.923   4.969  -1.257
  226   1HH2  ARG  27          1HH1      ARG  27 -35.475   2.931  -2.626
  227   2HH2  ARG  27          2HH1      ARG  27 -36.657   3.101  -1.370
  228    H    TYR  28           H        TYR  28 -32.277   7.252  -8.197
  229    HA   TYR  28           HA       TYR  28 -33.816   6.951 -10.689
  230   1HB   TYR  28          2HB       TYR  28 -31.221   8.343  -9.944
  231   2HB   TYR  28          1HB       TYR  28 -32.038   8.519 -11.497
  232    HD1  TYR  28           HD1      TYR  28 -31.707  11.004 -10.357
  233    HD2  TYR  28           HD2      TYR  28 -34.621   8.055  -9.232
  234    HE1  TYR  28           HE1      TYR  28 -33.145  12.787  -9.407
  235    HE2  TYR  28           HE2      TYR  28 -36.058   9.838  -8.282
  236    HH   TYR  28           HH       TYR  28 -35.876  12.917  -8.981
  237    H    CYS  29           H        CYS  29 -32.023   4.752  -9.258
  238    HA   CYS  29           HA       CYS  29 -30.058   4.167 -11.379
  239   1HB   CYS  29          2HB       CYS  29 -29.781   3.854  -8.844
  240   2HB   CYS  29          1HB       CYS  29 -30.867   2.480  -9.006
  241    H    LYS  30           H        LYS  30 -30.658   2.993 -13.173
  242    HA   LYS  30           HA       LYS  30 -33.179   1.645 -13.459
  243   1HB   LYS  30          2HB       LYS  30 -30.746   2.135 -14.935
  244   2HB   LYS  30          1HB       LYS  30 -31.189   0.437 -15.109
  245   1HG   LYS  30          2HG       LYS  30 -33.623   1.600 -15.427
  246   2HG   LYS  30          1HG       LYS  30 -32.584   2.862 -16.090
  247   1HD   LYS  30          2HD       LYS  30 -31.511   0.544 -17.164
  248   2HD   LYS  30          1HD       LYS  30 -33.247   0.230 -17.191
  249   1HE   LYS  30          2HE       LYS  30 -32.511   1.366 -19.277
  250   2HE   LYS  30          1HE       LYS  30 -33.607   2.407 -18.347
  251   1HZ   LYS  30          1HZ       LYS  30 -31.957   3.804 -17.788
  252   2HZ   LYS  30          2HZ       LYS  30 -31.162   3.161 -19.144
  253   3HZ   LYS  30          3HZ       LYS  30 -30.816   2.567 -17.590
  254    H    PHE  31           H        PHE  31 -30.286   0.876 -11.813
  255    HA   PHE  31           HA       PHE  31 -30.962  -2.029 -11.544
  256   1HB   PHE  31          2HB       PHE  31 -28.415  -0.439 -11.016
  257   2HB   PHE  31          1HB       PHE  31 -28.516  -2.202 -11.080
  258    HD1  PHE  31           HD1      PHE  31 -28.784   0.924 -13.035
  259    HD2  PHE  31           HD2      PHE  31 -28.701  -3.364 -13.192
  260    HE1  PHE  31           HE1      PHE  31 -28.545   1.025 -15.493
  261    HE2  PHE  31           HE2      PHE  31 -28.476  -3.268 -15.655
  262    HZ   PHE  31           HZ       PHE  31 -28.392  -1.074 -16.813
  263    H    ARG  32           H        ARG  32 -31.851   0.639 -10.082
  264    HA   ARG  32           HA       ARG  32 -30.941   0.862  -7.479
  265   1HB   ARG  32          2HB       ARG  32 -32.957   2.004  -7.102
  266   2HB   ARG  32          1HB       ARG  32 -32.813   2.071  -8.853
  267   1HG   ARG  32          2HG       ARG  32 -34.377  -0.071  -7.390
  268   2HG   ARG  32          1HG       ARG  32 -35.103   1.406  -8.014
  269   1HD   ARG  32          2HD       ARG  32 -33.715   0.504 -10.216
  270   2HD   ARG  32          1HD       ARG  32 -34.257  -1.010  -9.471
  271    HE   ARG  32           HE       ARG  32 -36.087   1.235 -10.213
  272   1HH1  ARG  32          1HH2      ARG  32 -35.507  -1.855 -11.092
  273   2HH1  ARG  32          2HH2      ARG  32 -37.064  -2.498 -10.687
  274   1HH2  ARG  32          1HH1      ARG  32 -38.073   0.329  -8.952
  275   2HH2  ARG  32          2HH1      ARG  32 -38.513  -1.263  -9.470
  276    H    TYR  33           H        TYR  33 -32.724  -1.768  -8.857
  277    HA   TYR  33           HA       TYR  33 -32.678  -3.136  -6.199
  278   1HB   TYR  33          2HB       TYR  33 -35.009  -2.648  -8.054
  279   2HB   TYR  33          1HB       TYR  33 -35.024  -3.996  -6.917
  280    HD1  TYR  33           HD1      TYR  33 -36.557  -1.100  -7.156
  281    HD2  TYR  33           HD2      TYR  33 -33.572  -2.847  -4.607
  282    HE1  TYR  33           HE1      TYR  33 -37.210   0.446  -5.330
  283    HE2  TYR  33           HE2      TYR  33 -34.225  -1.302  -2.783
  284    HH   TYR  33           HH       TYR  33 -35.435   0.506  -2.253
  285    H    CYS  34           H        CYS  34 -31.554  -3.228  -9.229
  286    HA   CYS  34           HA       CYS  34 -32.165  -5.633 -10.478
  287   1HB   CYS  34          2HB       CYS  34 -30.465  -3.910 -11.171
  288   2HB   CYS  34          1HB       CYS  34 -29.403  -4.525  -9.902
  289    H    THR  35           H        THR  35 -30.807  -7.729 -10.345
  290    HA   THR  35           HA       THR  35 -29.933  -8.347  -7.561
  291    HB   THR  35           HB       THR  35 -31.328 -10.435  -7.722
  292    HG1  THR  35           HG1      THR  35 -31.414  -9.919 -10.181
  293   1HG2  THR  35          1HG2      THR  35 -33.162  -8.111  -8.172
  294   2HG2  THR  35          2HG2      THR  35 -32.046  -8.056  -6.807
  295   3HG2  THR  35          3HG2      THR  35 -33.226  -9.362  -6.931
  296    H    CYS  36           H        CYS  36 -28.984  -8.276 -10.674
  297    HA   CYS  36           HA       CYS  36 -28.042 -10.838 -11.372
  298   1HB   CYS  36          2HB       CYS  36 -26.506  -9.637 -12.782
  299   2HB   CYS  36          1HB       CYS  36 -27.984  -8.679 -12.684
  300    H    GLU  37           H        GLU  37 -25.353 -11.081 -11.374
  301    HA   GLU  37           HA       GLU  37 -24.714 -11.407  -8.508
  302   1HB   GLU  37          2HB       GLU  37 -23.027 -12.891  -9.329
  303   2HB   GLU  37          1HB       GLU  37 -24.426 -13.124 -10.379
  304   1HG   GLU  37          2HG       GLU  37 -23.413 -11.448 -11.969
  305   2HG   GLU  37          1HG       GLU  37 -21.962 -11.461 -10.965
  306    H    LYS  38           H        LYS  38 -24.242  -8.899 -10.659
  307    HA   LYS  38           HA       LYS  38 -21.564  -8.158  -9.543
  308   1HB   LYS  38          2HB       LYS  38 -22.752  -8.028 -12.095
  309   2HB   LYS  38          1HB       LYS  38 -22.743  -6.362 -11.516
  310   1HG   LYS  38          2HG       LYS  38 -20.521  -6.203 -11.835
  311   2HG   LYS  38          1HG       LYS  38 -20.237  -7.651 -10.868
  312   1HD   LYS  38          2HD       LYS  38 -20.521  -9.087 -12.756
  313   2HD   LYS  38          1HD       LYS  38 -21.184  -7.778 -13.737
  314   1HE   LYS  38          2HE       LYS  38 -18.404  -7.529 -12.597
  315   2HE   LYS  38          1HE       LYS  38 -18.678  -8.435 -14.099
  316   1HZ   LYS  38          1HZ       LYS  38 -20.026  -6.479 -14.853
  317   2HZ   LYS  38          2HZ       LYS  38 -18.357  -6.187 -14.725
  318   3HZ   LYS  38          3HZ       LYS  38 -19.416  -5.619 -13.524
  319    H    CYS  39           H        CYS  39 -24.923  -7.538  -9.403
  320    HA   CYS  39           HA       CYS  39 -24.693  -4.868  -8.171
  321   1HB   CYS  39          2HB       CYS  39 -26.768  -6.744  -9.205
  322   2HB   CYS  39          1HB       CYS  39 -27.267  -5.697  -7.892
  323    H    ARG  40           H        ARG  40 -25.541  -8.243  -7.385
  324    HA   ARG  40           HA       ARG  40 -25.969  -7.779  -4.551
  325   1HB   ARG  40          2HB       ARG  40 -25.860  -9.997  -6.497
  326   2HB   ARG  40          1HB       ARG  40 -25.323 -10.443  -4.876
  327   1HG   ARG  40          2HG       ARG  40 -27.401  -9.746  -3.901
  328   2HG   ARG  40          1HG       ARG  40 -27.914  -8.967  -5.397
  329   1HD   ARG  40          2HD       ARG  40 -29.042 -10.952  -5.705
  330   2HD   ARG  40          1HD       ARG  40 -27.462 -11.511  -6.291
  331    HE   ARG  40           HE       ARG  40 -27.055 -12.523  -4.128
  332   1HH1  ARG  40          1HH2      ARG  40 -28.681 -10.397  -2.610
  333   2HH1  ARG  40          2HH2      ARG  40 -29.989 -11.362  -2.011
  334   1HH2  ARG  40          1HH1      ARG  40 -29.354 -14.019  -4.146
  335   2HH2  ARG  40          2HH1      ARG  40 -30.369 -13.414  -2.880
  336    H    LEU  41           H        LEU  41 -23.301  -8.755  -6.615
  337    HA   LEU  41           HA       LEU  41 -21.369  -9.396  -4.610
  338   1HB   LEU  41          2HB       LEU  41 -20.735 -10.033  -6.747
  339   2HB   LEU  41          1HB       LEU  41 -21.481  -8.619  -7.486
  340    HG   LEU  41           HG       LEU  41 -19.645  -7.209  -6.794
  341   1HD1  LEU  41          1HD1      LEU  41 -19.337  -8.771  -4.659
  342   2HD1  LEU  41          2HD1      LEU  41 -17.987  -7.828  -5.292
  343   3HD1  LEU  41          3HD1      LEU  41 -18.128  -9.541  -5.685
  344   1HD2  LEU  41          1HD2      LEU  41 -18.913  -8.037  -8.795
  345   2HD2  LEU  41          2HD2      LEU  41 -19.147  -9.715  -8.301
  346   3HD2  LEU  41          3HD2      LEU  41 -17.708  -8.836  -7.784
  347    H    THR  42           H        THR  42 -22.392  -6.389  -6.110
  348    HA   THR  42           HA       THR  42 -20.391  -4.658  -4.987
  349    HB   THR  42           HB       THR  42 -23.221  -4.287  -5.978
  350    HG1  THR  42           HG1      THR  42 -21.141  -4.881  -7.259
  351   1HG2  THR  42          1HG2      THR  42 -22.453  -2.488  -4.367
  352   2HG2  THR  42          2HG2      THR  42 -22.844  -1.912  -5.988
  353   3HG2  THR  42          3HG2      THR  42 -21.160  -2.120  -5.508
  354    H    ALA  43           H        ALA  43 -23.836  -4.767  -4.139
  355    HA   ALA  43           HA       ALA  43 -23.792  -3.453  -1.690
  356   1HB   ALA  43          1HB       ALA  43 -25.429  -5.845  -1.540
  357   2HB   ALA  43          2HB       ALA  43 -25.512  -5.155  -3.160
  358   3HB   ALA  43          3HB       ALA  43 -25.944  -4.173  -1.761
  359    H    ASP  44           H        ASP  44 -22.886  -6.795  -2.413
  360    HA   ASP  44           HA       ASP  44 -22.442  -7.696   0.275
  361   1HB   ASP  44          2HB       ASP  44 -22.645  -8.978  -1.947
  362   2HB   ASP  44          1HB       ASP  44 -20.963  -8.532  -2.233
  363    H    ARG  45           H        ARG  45 -20.425  -6.025  -2.111
  364    HA   ARG  45           HA       ARG  45 -17.923  -6.189  -0.718
  365   1HB   ARG  45          2HB       ARG  45 -18.686  -5.420  -3.146
  366   2HB   ARG  45          1HB       ARG  45 -18.720  -3.826  -2.388
  367   1HG   ARG  45          2HG       ARG  45 -16.344  -4.673  -1.458
  368   2HG   ARG  45          1HG       ARG  45 -16.399  -5.603  -2.955
  369   1HD   ARG  45          2HD       ARG  45 -16.083  -3.750  -4.240
  370   2HD   ARG  45          1HD       ARG  45 -17.220  -2.787  -3.277
  371    HE   ARG  45           HE       ARG  45 -15.371  -2.013  -2.038
  372   1HH1  ARG  45          1HH2      ARG  45 -14.350  -4.444  -4.174
  373   2HH1  ARG  45          2HH2      ARG  45 -12.873  -4.782  -3.337
  374   1HH2  ARG  45          1HH1      ARG  45 -13.603  -2.698  -0.661
  375   2HH2  ARG  45          2HH1      ARG  45 -12.449  -3.793  -1.346
  376    H    GLN  46           H        GLN  46 -20.765  -4.228  -0.224
  377    HA   GLN  46           HA       GLN  46 -19.263  -2.580   1.788
  378   1HB   GLN  46          2HB       GLN  46 -20.320  -1.568  -0.370
  379   2HB   GLN  46          1HB       GLN  46 -21.860  -1.817   0.455
  380   1HG   GLN  46          2HG       GLN  46 -21.245   0.384   1.057
  381   2HG   GLN  46          1HG       GLN  46 -20.764  -0.586   2.449
  382   1HE2  GLN  46          1HE2      GLN  46 -19.582   2.005   1.344
  383   2HE2  GLN  46          2HE2      GLN  46 -17.935   1.660   1.125
  384    H    ARG  47           H        ARG  47 -20.298  -5.128   2.509
  385    HA   ARG  47           HA       ARG  47 -22.926  -4.688   3.790
  386   1HB   ARG  47          2HB       ARG  47 -21.321  -6.863   2.847
  387   2HB   ARG  47          1HB       ARG  47 -21.638  -7.124   4.563
  388   1HG   ARG  47          2HG       ARG  47 -24.099  -6.362   3.812
  389   2HG   ARG  47          1HG       ARG  47 -23.548  -7.031   2.276
  390   1HD   ARG  47          2HD       ARG  47 -22.782  -8.810   4.419
  391   2HD   ARG  47          1HD       ARG  47 -24.525  -8.483   4.497
  392    HE   ARG  47           HE       ARG  47 -23.103  -9.542   2.092
  393   1HH1  ARG  47          1HH2      ARG  47 -25.917  -7.915   2.758
  394   2HH1  ARG  47          2HH2      ARG  47 -26.993  -9.148   2.192
  395   1HH2  ARG  47          1HH1      ARG  47 -24.503 -11.534   1.844
  396   2HH2  ARG  47          2HH1      ARG  47 -26.192 -11.194   1.670
  397    H    VAL  48           H        VAL  48 -21.556  -2.831   5.011
  398    HA   VAL  48           HA       VAL  48 -20.307  -4.019   7.462
  399    HB   VAL  48           HB       VAL  48 -19.249  -1.786   7.646
  400   1HG1  VAL  48          1HG1      VAL  48 -19.042  -3.415   5.142
  401   2HG1  VAL  48          2HG1      VAL  48 -17.847  -3.160   6.414
  402   3HG1  VAL  48          3HG1      VAL  48 -18.154  -1.894   5.226
  403   1HG2  VAL  48          1HG2      VAL  48 -19.855  -0.731   5.067
  404   2HG2  VAL  48          2HG2      VAL  48 -20.229  -0.024   6.640
  405   3HG2  VAL  48          3HG2      VAL  48 -21.387  -1.101   5.858
  406    H    MET  49           H        MET  49 -21.140  -3.430   9.495
  407    HA   MET  49           HA       MET  49 -23.540  -1.627   9.502
  408   1HB   MET  49          2HB       MET  49 -23.487  -4.380   9.821
  409   2HB   MET  49          1HB       MET  49 -23.499  -3.793  11.485
  410   1HG   MET  49          2HG       MET  49 -25.400  -2.216  10.685
  411   2HG   MET  49          1HG       MET  49 -25.523  -3.307   9.305
  412   1HE   MET  49          1HE       MET  49 -24.670  -6.205  10.920
  413   2HE   MET  49          2HE       MET  49 -25.533  -5.725   9.460
  414   3HE   MET  49          3HE       MET  49 -26.357  -6.685  10.687
  415    H    ALA  50           H        ALA  50 -20.451  -1.852  10.488
  416    HA   ALA  50           HA       ALA  50 -20.946  -0.191  12.904
  417   1HB   ALA  50          1HB       ALA  50 -19.221  -1.675  14.085
  418   2HB   ALA  50          2HB       ALA  50 -19.446  -2.819  12.762
  419   3HB   ALA  50          3HB       ALA  50 -20.802  -2.407  13.812
  420    H    LEU  51           H        LEU  51 -18.988   1.020  13.519
  421    HA   LEU  51           HA       LEU  51 -16.624   0.861  11.772
  422   1HB   LEU  51          2HB       LEU  51 -16.974   3.169  10.912
  423   2HB   LEU  51          1HB       LEU  51 -18.276   2.086  10.417
  424    HG   LEU  51           HG       LEU  51 -18.727   3.405  13.012
  425   1HD1  LEU  51          1HD1      LEU  51 -19.115   5.600  12.190
  426   2HD1  LEU  51          2HD1      LEU  51 -18.958   5.086  10.510
  427   3HD1  LEU  51          3HD1      LEU  51 -17.534   5.153  11.549
  428   1HD2  LEU  51          1HD2      LEU  51 -20.626   2.352  12.243
  429   2HD2  LEU  51          2HD2      LEU  51 -20.209   2.607  10.549
  430   3HD2  LEU  51          3HD2      LEU  51 -20.885   3.930  11.499
  431    H    GLN  52           H        GLN  52 -14.874   2.169  12.609
  432    HA   GLN  52           HA       GLN  52 -15.366   3.234  15.372
  433   1HB   GLN  52          2HB       GLN  52 -13.691   1.178  14.368
  434   2HB   GLN  52          1HB       GLN  52 -12.627   2.512  14.816
  435   1HG   GLN  52          2HG       GLN  52 -13.052   2.266  17.034
  436   2HG   GLN  52          1HG       GLN  52 -14.771   1.968  16.766
  437   1HE2  GLN  52          1HE2      GLN  52 -13.142   0.376  18.573
  438   2HE2  GLN  52          2HE2      GLN  52 -13.080  -1.201  17.948
  Start of MODEL   10
    1   1H    SER   1          1H        SER   1 -17.013   8.032   3.206
    2   2H    SER   1          2H        SER   1 -15.786   8.493   2.125
    3   3H    SER   1          3H        SER   1 -15.432   7.456   3.424
    4    HA   SER   1           HA       SER   1 -16.613   5.662   2.466
    5   1HB   SER   1          2HB       SER   1 -18.588   6.832   1.828
    6   2HB   SER   1          1HB       SER   1 -17.692   7.927   0.779
    7    HG   SER   1           HG       SER   1 -18.109   6.542  -0.735
    8    H    ILE   2           H        ILE   2 -15.657   4.349   0.818
    9    HA   ILE   2           HA       ILE   2 -13.062   4.897  -0.063
   10    HB   ILE   2           HB       ILE   2 -14.426   2.734  -0.080
   11   1HG1  ILE   2          2HG1      ILE   2 -13.344   2.265  -2.569
   12   2HG1  ILE   2          1HG1      ILE   2 -12.432   3.676  -2.035
   13   1HG2  ILE   2          1HG2      ILE   2 -15.705   2.237  -2.089
   14   2HG2  ILE   2          2HG2      ILE   2 -15.281   3.800  -2.787
   15   3HG2  ILE   2          3HG2      ILE   2 -16.331   3.722  -1.371
   16   1HD1  ILE   2          1HD1      ILE   2 -12.776   1.686   0.085
   17   2HD1  ILE   2          2HD1      ILE   2 -11.305   2.481  -0.477
   18   3HD1  ILE   2          3HD1      ILE   2 -11.908   1.049  -1.311
   19    H    SER   3           H        SER   3 -12.206   5.648  -2.096
   20    HA   SER   3           HA       SER   3 -14.021   6.776  -4.121
   21   1HB   SER   3          2HB       SER   3 -13.598   8.328  -1.983
   22   2HB   SER   3          1HB       SER   3 -12.123   8.715  -2.861
   23    HG   SER   3           HG       SER   3 -14.815   8.999  -3.701
   24    HA   PRO   4           HA       PRO   4  -9.941   5.411  -5.725
   25   1HB   PRO   4          2HB       PRO   4 -10.961   4.182  -7.947
   26   2HB   PRO   4          1HB       PRO   4 -10.837   3.375  -6.370
   27   1HG   PRO   4          2HG       PRO   4 -13.204   4.592  -7.692
   28   2HG   PRO   4          1HG       PRO   4 -13.092   3.137  -6.690
   29   1HD   PRO   4          2HD       PRO   4 -14.031   5.551  -5.792
   30   2HD   PRO   4          1HD       PRO   4 -13.314   4.307  -4.744
   31    H    ARG   5           H        ARG   5 -12.716   6.714  -7.558
   32    HA   ARG   5           HA       ARG   5 -10.796   8.350  -9.181
   33   1HB   ARG   5          2HB       ARG   5 -13.669   7.585  -9.782
   34   2HB   ARG   5          1HB       ARG   5 -12.487   8.255 -10.908
   35   1HG   ARG   5          2HG       ARG   5 -11.065   6.167 -10.344
   36   2HG   ARG   5          1HG       ARG   5 -12.558   5.501  -9.681
   37   1HD   ARG   5          2HD       ARG   5 -13.191   6.635 -12.227
   38   2HD   ARG   5          1HD       ARG   5 -11.760   5.604 -12.428
   39    HE   ARG   5           HE       ARG   5 -14.367   4.700 -11.290
   40   1HH1  ARG   5          1HH2      ARG   5 -12.239   3.131 -10.059
   41   2HH1  ARG   5          2HH2      ARG   5 -11.965   1.852 -11.195
   42   1HH2  ARG   5          1HH1      ARG   5 -13.568   3.475 -13.806
   43   2HH2  ARG   5          2HH1      ARG   5 -12.719   2.048 -13.318
   44    H    THR   6           H        THR   6 -12.688  10.200 -10.143
   45    HA   THR   6           HA       THR   6 -13.033  11.897  -7.760
   46    HB   THR   6           HB       THR   6 -13.997  13.236  -9.997
   47    HG1  THR   6           HG1      THR   6 -11.722  11.797 -10.812
   48   1HG2  THR   6          1HG2      THR   6 -12.424  14.593  -9.142
   49   2HG2  THR   6          2HG2      THR   6 -11.191  13.596  -9.914
   50   3HG2  THR   6          3HG2      THR   6 -11.701  13.248  -8.262
   51    HA   PRO   7           HA       PRO   7 -17.587  11.820  -9.128
   52   1HB   PRO   7          2HB       PRO   7 -18.285  10.394 -11.355
   53   2HB   PRO   7          1HB       PRO   7 -17.760  12.089 -11.418
   54   1HG   PRO   7          2HG       PRO   7 -16.226   9.611 -12.016
   55   2HG   PRO   7          1HG       PRO   7 -16.193  11.182 -12.830
   56   1HD   PRO   7          2HD       PRO   7 -14.286  10.363 -11.056
   57   2HD   PRO   7          1HD       PRO   7 -14.698  12.067 -11.344
   58    HA   PRO   8           HA       PRO   8 -17.758   7.759  -7.207
   59   1HB   PRO   8          2HB       PRO   8 -19.848   8.346  -5.550
   60   2HB   PRO   8          1HB       PRO   8 -18.178   8.842  -5.210
   61   1HG   PRO   8          2HG       PRO   8 -20.448  10.437  -6.263
   62   2HG   PRO   8          1HG       PRO   8 -19.130  10.921  -5.187
   63   1HD   PRO   8          2HD       PRO   8 -19.253  11.498  -7.882
   64   2HD   PRO   8          1HD       PRO   8 -17.763  11.471  -6.917
   65    H    ASN   9           H        ASN   9 -18.748   7.706  -9.720
   66    HA   ASN   9           HA       ASN   9 -21.427   7.648 -10.359
   67   1HB   ASN   9          2HB       ASN   9 -20.828   6.084 -12.028
   68   2HB   ASN   9          1HB       ASN   9 -19.329   6.945 -11.683
   69   1HD2  ASN   9          1HD2      ASN   9 -20.897   3.831 -11.565
   70   2HD2  ASN   9          2HD2      ASN   9 -19.591   2.972 -10.906
   71    H    CYS  10           H        CYS  10 -23.027   5.936 -10.378
   72    HA   CYS  10           HA       CYS  10 -23.331   4.652  -7.775
   73   1HB   CYS  10          2HB       CYS  10 -25.228   5.611  -9.010
   74   2HB   CYS  10          1HB       CYS  10 -24.872   4.616 -10.390
   75    H    ALA  11           H        ALA  11 -22.670   2.532  -7.307
   76    HA   ALA  11           HA       ALA  11 -21.476   0.944  -9.475
   77   1HB   ALA  11          1HB       ALA  11 -21.837  -0.269  -6.817
   78   2HB   ALA  11          2HB       ALA  11 -20.958   1.260  -6.813
   79   3HB   ALA  11          3HB       ALA  11 -20.374  -0.093  -7.784
   80    H    ARG  12           H        ARG  12 -24.609   1.232  -8.190
   81    HA   ARG  12           HA       ARG  12 -25.372  -1.581  -8.439
   82   1HB   ARG  12          2HB       ARG  12 -26.532   0.246  -7.131
   83   2HB   ARG  12          1HB       ARG  12 -26.978   0.996  -8.655
   84   1HG   ARG  12          2HG       ARG  12 -28.778  -0.303  -8.720
   85   2HG   ARG  12          1HG       ARG  12 -27.723  -1.703  -8.887
   86   1HD   ARG  12          2HD       ARG  12 -28.798  -0.510  -6.307
   87   2HD   ARG  12          1HD       ARG  12 -29.092  -2.140  -6.949
   88    HE   ARG  12           HE       ARG  12 -26.572  -2.486  -6.703
   89   1HH1  ARG  12          1HH2      ARG  12 -28.524  -1.648  -4.220
   90   2HH1  ARG  12          2HH2      ARG  12 -27.305  -0.948  -3.208
   91   1HH2  ARG  12          1HH1      ARG  12 -24.881  -0.930  -5.686
   92   2HH2  ARG  12          2HH1      ARG  12 -25.244  -0.541  -4.038
   93    H    CYS  13           H        CYS  13 -25.685   1.293 -10.436
   94    HA   CYS  13           HA       CYS  13 -26.590  -0.301 -12.740
   95   1HB   CYS  13          2HB       CYS  13 -26.879   1.972 -13.706
   96   2HB   CYS  13          1HB       CYS  13 -27.538   1.906 -12.088
   97    H    ARG  14           H        ARG  14 -23.539   0.457 -11.388
   98    HA   ARG  14           HA       ARG  14 -22.074   0.918 -13.882
   99   1HB   ARG  14          2HB       ARG  14 -20.422   1.382 -12.396
  100   2HB   ARG  14          1HB       ARG  14 -21.646   1.178 -11.163
  101   1HG   ARG  14          2HG       ARG  14 -19.674  -0.921 -12.131
  102   2HG   ARG  14          1HG       ARG  14 -19.726  -0.178 -10.539
  103   1HD   ARG  14          2HD       ARG  14 -22.272  -1.293 -10.945
  104   2HD   ARG  14          1HD       ARG  14 -21.115  -2.514 -11.487
  105    HE   ARG  14           HE       ARG  14 -21.337  -1.491  -8.744
  106   1HH1  ARG  14          1HH2      ARG  14 -20.855  -4.359  -9.389
  107   2HH1  ARG  14          2HH2      ARG  14 -19.172  -4.544  -9.029
  108   1HH2  ARG  14          1HH1      ARG  14 -18.523  -1.138  -9.030
  109   2HH2  ARG  14          2HH1      ARG  14 -17.852  -2.721  -8.823
  110    H    ASN  15           H        ASN  15 -23.387  -1.799 -12.315
  111    HA   ASN  15           HA       ASN  15 -21.520  -3.825 -13.053
  112   1HB   ASN  15          2HB       ASN  15 -24.433  -3.655 -12.309
  113   2HB   ASN  15          1HB       ASN  15 -23.642  -5.202 -12.554
  114   1HD2  ASN  15          1HD2      ASN  15 -24.327  -2.858 -10.283
  115   2HD2  ASN  15          2HD2      ASN  15 -23.074  -3.118  -9.177
  116    H    HIS  16           H        HIS  16 -24.349  -2.442 -14.560
  117    HA   HIS  16           HA       HIS  16 -24.263  -4.300 -16.846
  118   1HB   HIS  16          2HB       HIS  16 -26.020  -1.959 -16.055
  119   2HB   HIS  16          1HB       HIS  16 -26.368  -3.107 -17.329
  120    HD1  HIS  16           HD1      HIS  16 -27.536  -5.226 -16.692
  121    HD2  HIS  16           HD2      HIS  16 -25.737  -3.325 -13.446
  122    HE1  HIS  16           HE1      HIS  16 -28.157  -6.583 -14.629
  123    H    GLY  17           H        GLY  17 -22.991  -1.216 -15.983
  124   1HA   GLY  17          2HA       GLY  17 -21.261  -0.346 -17.576
  125   2HA   GLY  17          1HA       GLY  17 -22.403  -0.695 -18.875
  126    H    LEU  18           H        LEU  18 -23.820   0.492 -16.014
  127    HA   LEU  18           HA       LEU  18 -24.583   2.979 -17.386
  128   1HB   LEU  18          2HB       LEU  18 -25.773   1.210 -15.652
  129   2HB   LEU  18          1HB       LEU  18 -25.310   2.518 -14.563
  130    HG   LEU  18           HG       LEU  18 -27.544   2.954 -15.423
  131   1HD1  LEU  18          1HD1      LEU  18 -25.939   4.826 -17.082
  132   2HD1  LEU  18          2HD1      LEU  18 -25.518   4.725 -15.372
  133   3HD1  LEU  18          3HD1      LEU  18 -27.156   5.171 -15.853
  134   1HD2  LEU  18          1HD2      LEU  18 -27.844   1.889 -17.446
  135   2HD2  LEU  18          2HD2      LEU  18 -26.207   2.244 -17.994
  136   3HD2  LEU  18          3HD2      LEU  18 -27.448   3.496 -18.055
  137    H    LYS  19           H        LYS  19 -24.076   5.071 -16.552
  138    HA   LYS  19           HA       LYS  19 -22.156   5.299 -14.310
  139   1HB   LYS  19          2HB       LYS  19 -21.654   5.991 -17.215
  140   2HB   LYS  19          1HB       LYS  19 -20.732   6.746 -15.915
  141   1HG   LYS  19          2HG       LYS  19 -20.968   3.758 -16.368
  142   2HG   LYS  19          1HG       LYS  19 -19.575   4.743 -16.816
  143   1HD   LYS  19          2HD       LYS  19 -20.145   5.351 -14.110
  144   2HD   LYS  19          1HD       LYS  19 -20.218   3.595 -14.251
  145   1HE   LYS  19          2HE       LYS  19 -17.946   4.959 -15.631
  146   2HE   LYS  19          1HE       LYS  19 -17.884   4.866 -13.860
  147   1HZ   LYS  19          1HZ       LYS  19 -17.225   2.766 -14.152
  148   2HZ   LYS  19          2HZ       LYS  19 -17.646   2.762 -15.799
  149   3HZ   LYS  19          3HZ       LYS  19 -18.819   2.420 -14.619
  150    H    ILE  20           H        ILE  20 -23.898   6.396 -13.307
  151    HA   ILE  20           HA       ILE  20 -24.884   8.890 -14.592
  152    HB   ILE  20           HB       ILE  20 -26.841   8.394 -13.515
  153   1HG1  ILE  20          2HG1      ILE  20 -25.558   8.872 -11.281
  154   2HG1  ILE  20          1HG1      ILE  20 -27.133   8.143 -11.309
  155   1HG2  ILE  20          1HG2      ILE  20 -26.160   6.267 -14.554
  156   2HG2  ILE  20          2HG2      ILE  20 -27.274   6.078 -13.203
  157   3HG2  ILE  20          3HG2      ILE  20 -25.558   5.745 -12.985
  158   1HD1  ILE  20          1HD1      ILE  20 -25.605   6.914  -9.866
  159   2HD1  ILE  20          2HD1      ILE  20 -24.548   6.619 -11.235
  160   3HD1  ILE  20          3HD1      ILE  20 -26.165   5.919 -11.199
  161    H    THR  21           H        THR  21 -22.524   7.952 -12.371
  162    HA   THR  21           HA       THR  21 -21.084   9.348 -11.051
  163    HB   THR  21           HB       THR  21 -23.089  11.566 -11.314
  164    HG1  THR  21           HG1      THR  21 -22.765  11.715 -13.382
  165   1HG2  THR  21          1HG2      THR  21 -21.362  12.726 -10.466
  166   2HG2  THR  21          2HG2      THR  21 -20.392  12.299 -11.875
  167   3HG2  THR  21          3HG2      THR  21 -20.380  11.262 -10.449
  168    H    LEU  22           H        LEU  22 -24.079   8.291 -10.455
  169    HA   LEU  22           HA       LEU  22 -25.491   8.028  -8.570
  170   1HB   LEU  22          2HB       LEU  22 -23.415   6.801  -8.024
  171   2HB   LEU  22          1HB       LEU  22 -22.768   8.259  -7.273
  172    HG   LEU  22           HG       LEU  22 -25.403   7.751  -6.243
  173   1HD1  LEU  22          1HD1      LEU  22 -25.040   5.599  -5.167
  174   2HD1  LEU  22          2HD1      LEU  22 -23.432   5.475  -5.878
  175   3HD1  LEU  22          3HD1      LEU  22 -24.860   5.393  -6.910
  176   1HD2  LEU  22          1HD2      LEU  22 -23.867   9.054  -4.984
  177   2HD2  LEU  22          2HD2      LEU  22 -22.588   7.849  -5.144
  178   3HD2  LEU  22          3HD2      LEU  22 -23.975   7.531  -4.101
  179    H    LYS  23           H        LYS  23 -24.738  10.924  -9.384
  180    HA   LYS  23           HA       LYS  23 -24.787  12.354  -6.821
  181   1HB   LYS  23          2HB       LYS  23 -23.998  12.893  -9.408
  182   2HB   LYS  23          1HB       LYS  23 -25.531  13.760  -9.309
  183   1HG   LYS  23          2HG       LYS  23 -24.484  15.403  -8.187
  184   2HG   LYS  23          1HG       LYS  23 -24.177  14.264  -6.876
  185   1HD   LYS  23          2HD       LYS  23 -22.061  13.638  -7.779
  186   2HD   LYS  23          1HD       LYS  23 -22.407  14.421  -9.321
  187   1HE   LYS  23          2HE       LYS  23 -22.431  16.633  -8.174
  188   2HE   LYS  23          1HE       LYS  23 -21.999  15.824  -6.655
  189   1HZ   LYS  23          1HZ       LYS  23 -20.435  15.235  -9.066
  190   2HZ   LYS  23          2HZ       LYS  23 -19.951  15.221  -7.437
  191   3HZ   LYS  23          3HZ       LYS  23 -20.142  16.696  -8.259
  192    H    GLY  24           H        GLY  24 -26.733  12.291  -5.667
  193   1HA   GLY  24          2HA       GLY  24 -29.071  12.192  -5.298
  194   2HA   GLY  24          1HA       GLY  24 -29.155  13.388  -6.600
  195    H    HIS  25           H        HIS  25 -28.201   9.972  -6.460
  196    HA   HIS  25           HA       HIS  25 -29.895   9.454  -8.872
  197   1HB   HIS  25          2HB       HIS  25 -27.490   9.287  -9.130
  198   2HB   HIS  25          1HB       HIS  25 -27.374   8.241  -7.720
  199    HD1  HIS  25           HD1      HIS  25 -29.349   8.155 -11.007
  200    HD2  HIS  25           HD2      HIS  25 -27.074   5.650  -8.578
  201    HE1  HIS  25           HE1      HIS  25 -29.040   5.965 -12.255
  202    H    LYS  26           H        LYS  26 -28.528   6.775  -7.198
  203    HA   LYS  26           HA       LYS  26 -29.602   4.881  -6.309
  204   1HB   LYS  26          2HB       LYS  26 -29.370   6.296  -4.353
  205   2HB   LYS  26          1HB       LYS  26 -30.783   7.246  -4.814
  206   1HG   LYS  26          2HG       LYS  26 -32.263   5.397  -4.401
  207   2HG   LYS  26          1HG       LYS  26 -30.911   4.280  -4.217
  208   1HD   LYS  26          2HD       LYS  26 -30.277   5.201  -2.141
  209   2HD   LYS  26          1HD       LYS  26 -31.190   6.683  -2.419
  210   1HE   LYS  26          2HE       LYS  26 -33.209   5.716  -1.823
  211   2HE   LYS  26          1HE       LYS  26 -32.709   4.100  -2.362
  212   1HZ   LYS  26          1HZ       LYS  26 -32.030   5.517   0.125
  213   2HZ   LYS  26          2HZ       LYS  26 -30.924   4.399  -0.517
  214   3HZ   LYS  26          3HZ       LYS  26 -32.492   3.900  -0.094
  215    H    ARG  27           H        ARG  27 -32.478   6.774  -5.645
  216    HA   ARG  27           HA       ARG  27 -34.328   5.018  -6.796
  217   1HB   ARG  27          2HB       ARG  27 -34.764   7.008  -5.329
  218   2HB   ARG  27          1HB       ARG  27 -34.467   8.052  -6.720
  219   1HG   ARG  27          2HG       ARG  27 -36.837   7.771  -6.620
  220   2HG   ARG  27          1HG       ARG  27 -36.285   6.727  -7.931
  221   1HD   ARG  27          2HD       ARG  27 -36.705   4.779  -6.742
  222   2HD   ARG  27          1HD       ARG  27 -36.442   5.562  -5.170
  223    HE   ARG  27           HE       ARG  27 -38.818   6.273  -6.843
  224   1HH1  ARG  27          1HH2      ARG  27 -37.606   6.923  -3.885
  225   2HH1  ARG  27          2HH2      ARG  27 -38.924   6.288  -2.960
  226   1HH2  ARG  27          1HH1      ARG  27 -40.419   4.723  -5.669
  227   2HH2  ARG  27          2HH1      ARG  27 -40.517   5.040  -3.970
  228    H    TYR  28           H        TYR  28 -32.301   7.426  -8.350
  229    HA   TYR  28           HA       TYR  28 -33.691   7.309 -10.934
  230   1HB   TYR  28          2HB       TYR  28 -31.061   8.463  -9.946
  231   2HB   TYR  28          1HB       TYR  28 -31.683   8.703 -11.581
  232    HD1  TYR  28           HD1      TYR  28 -31.599  10.057  -8.325
  233    HD2  TYR  28           HD2      TYR  28 -34.217   9.530 -11.691
  234    HE1  TYR  28           HE1      TYR  28 -33.009  11.934  -7.522
  235    HE2  TYR  28           HE2      TYR  28 -35.627  11.407 -10.887
  236    HH   TYR  28           HH       TYR  28 -36.102  12.531  -8.672
  237    H    CYS  29           H        CYS  29 -31.918   5.050  -9.370
  238    HA   CYS  29           HA       CYS  29 -29.980   4.302 -11.416
  239   1HB   CYS  29          2HB       CYS  29 -29.979   3.864  -8.857
  240   2HB   CYS  29          1HB       CYS  29 -31.093   2.553  -9.224
  241    H    LYS  30           H        LYS  30 -30.120   2.614 -12.884
  242    HA   LYS  30           HA       LYS  30 -32.872   1.656 -13.513
  243   1HB   LYS  30          2HB       LYS  30 -30.433   2.246 -14.940
  244   2HB   LYS  30          1HB       LYS  30 -30.884   0.567 -15.243
  245   1HG   LYS  30          2HG       LYS  30 -33.278   2.082 -15.342
  246   2HG   LYS  30          1HG       LYS  30 -32.084   2.955 -16.304
  247   1HD   LYS  30          2HD       LYS  30 -31.713   0.247 -16.956
  248   2HD   LYS  30          1HD       LYS  30 -33.462   0.477 -16.916
  249   1HE   LYS  30          2HE       LYS  30 -32.140   2.722 -18.227
  250   2HE   LYS  30          1HE       LYS  30 -31.773   1.183 -19.032
  251   1HZ   LYS  30          1HZ       LYS  30 -33.934   0.809 -19.521
  252   2HZ   LYS  30          2HZ       LYS  30 -34.041   2.502 -19.434
  253   3HZ   LYS  30          3HZ       LYS  30 -34.510   1.548 -18.108
  254    H    PHE  31           H        PHE  31 -30.705   0.890 -11.321
  255    HA   PHE  31           HA       PHE  31 -31.233  -2.041 -11.363
  256   1HB   PHE  31          2HB       PHE  31 -28.531  -0.744 -10.859
  257   2HB   PHE  31          1HB       PHE  31 -28.847  -2.468 -11.057
  258    HD1  PHE  31           HD1      PHE  31 -28.817   0.810 -12.784
  259    HD2  PHE  31           HD2      PHE  31 -29.079  -3.447 -13.232
  260    HE1  PHE  31           HE1      PHE  31 -28.533   1.059 -15.222
  261    HE2  PHE  31           HE2      PHE  31 -28.803  -3.206 -15.675
  262    HZ   PHE  31           HZ       PHE  31 -28.525  -0.952 -16.683
  263    H    ARG  32           H        ARG  32 -31.744   0.703  -9.806
  264    HA   ARG  32           HA       ARG  32 -30.661   0.793  -7.282
  265   1HB   ARG  32          2HB       ARG  32 -33.325   1.191  -6.701
  266   2HB   ARG  32          1HB       ARG  32 -32.248   2.416  -7.356
  267   1HG   ARG  32          2HG       ARG  32 -34.439   2.162  -8.585
  268   2HG   ARG  32          1HG       ARG  32 -33.010   1.993  -9.589
  269   1HD   ARG  32          2HD       ARG  32 -33.380  -0.258  -9.978
  270   2HD   ARG  32          1HD       ARG  32 -34.126  -0.500  -8.385
  271    HE   ARG  32           HE       ARG  32 -36.026   1.001  -9.395
  272   1HH1  ARG  32          1HH2      ARG  32 -34.638   0.871 -12.122
  273   2HH1  ARG  32          2HH2      ARG  32 -35.550  -0.383 -12.894
  274   1HH2  ARG  32          1HH1      ARG  32 -36.959  -1.539  -9.944
  275   2HH2  ARG  32          2HH1      ARG  32 -36.866  -1.746 -11.660
  276    H    TYR  33           H        TYR  33 -32.742  -1.667  -8.559
  277    HA   TYR  33           HA       TYR  33 -32.562  -3.119  -5.942
  278   1HB   TYR  33          2HB       TYR  33 -34.934  -2.843  -7.816
  279   2HB   TYR  33          1HB       TYR  33 -34.907  -3.843  -6.362
  280    HD1  TYR  33           HD1      TYR  33 -36.169  -0.893  -7.484
  281    HD2  TYR  33           HD2      TYR  33 -33.653  -2.344  -4.319
  282    HE1  TYR  33           HE1      TYR  33 -36.754   1.087  -6.111
  283    HE2  TYR  33           HE2      TYR  33 -34.238  -0.364  -2.945
  284    HH   TYR  33           HH       TYR  33 -36.297   1.281  -2.878
  285    H    CYS  34           H        CYS  34 -31.493  -3.145  -8.985
  286    HA   CYS  34           HA       CYS  34 -32.133  -5.499 -10.305
  287   1HB   CYS  34          2HB       CYS  34 -30.448  -3.762 -10.968
  288   2HB   CYS  34          1HB       CYS  34 -29.367  -4.405  -9.731
  289    H    THR  35           H        THR  35 -30.778  -7.594 -10.276
  290    HA   THR  35           HA       THR  35 -29.892  -8.331  -7.520
  291    HB   THR  35           HB       THR  35 -31.243 -10.453  -7.853
  292    HG1  THR  35           HG1      THR  35 -32.710  -9.063  -9.776
  293   1HG2  THR  35          1HG2      THR  35 -32.214  -7.735  -7.356
  294   2HG2  THR  35          2HG2      THR  35 -32.523  -9.220  -6.455
  295   3HG2  THR  35          3HG2      THR  35 -33.489  -8.834  -7.880
  296    H    CYS  36           H        CYS  36 -29.100  -8.231 -10.770
  297    HA   CYS  36           HA       CYS  36 -28.041 -10.708 -11.481
  298   1HB   CYS  36          2HB       CYS  36 -26.595  -9.461 -12.912
  299   2HB   CYS  36          1HB       CYS  36 -28.034  -8.464 -12.706
  300    H    GLU  37           H        GLU  37 -25.567 -11.322 -11.316
  301    HA   GLU  37           HA       GLU  37 -24.887 -11.419  -8.473
  302   1HB   GLU  37          2HB       GLU  37 -24.583 -13.072 -10.576
  303   2HB   GLU  37          1HB       GLU  37 -22.990 -12.315 -10.583
  304   1HG   GLU  37          2HG       GLU  37 -22.444 -13.127  -8.467
  305   2HG   GLU  37          1HG       GLU  37 -24.133 -13.303  -7.989
  306    H    LYS  38           H        LYS  38 -24.318  -9.011 -10.726
  307    HA   LYS  38           HA       LYS  38 -21.592  -8.365  -9.680
  308   1HB   LYS  38          2HB       LYS  38 -23.191  -7.870 -12.113
  309   2HB   LYS  38          1HB       LYS  38 -22.289  -6.461 -11.554
  310   1HG   LYS  38          2HG       LYS  38 -20.230  -7.881 -11.443
  311   2HG   LYS  38          1HG       LYS  38 -21.153  -9.207 -12.150
  312   1HD   LYS  38          2HD       LYS  38 -21.000  -6.507 -13.490
  313   2HD   LYS  38          1HD       LYS  38 -19.774  -7.744 -13.767
  314   1HE   LYS  38          2HE       LYS  38 -21.961  -9.261 -14.163
  315   2HE   LYS  38          1HE       LYS  38 -22.627  -7.685 -14.638
  316   1HZ   LYS  38          1HZ       LYS  38 -19.931  -8.382 -15.548
  317   2HZ   LYS  38          2HZ       LYS  38 -21.117  -7.431 -16.307
  318   3HZ   LYS  38          3HZ       LYS  38 -21.241  -9.125 -16.328
  319    H    CYS  39           H        CYS  39 -24.909  -7.531  -9.486
  320    HA   CYS  39           HA       CYS  39 -24.511  -4.872  -8.292
  321   1HB   CYS  39          2HB       CYS  39 -26.683  -6.667  -9.246
  322   2HB   CYS  39          1HB       CYS  39 -27.111  -5.625  -7.903
  323    H    ARG  40           H        ARG  40 -25.367  -8.202  -7.425
  324    HA   ARG  40           HA       ARG  40 -25.806  -7.728  -4.608
  325   1HB   ARG  40          2HB       ARG  40 -25.318 -10.079  -6.424
  326   2HB   ARG  40          1HB       ARG  40 -25.324 -10.317  -4.677
  327   1HG   ARG  40          2HG       ARG  40 -27.574  -9.487  -4.490
  328   2HG   ARG  40          1HG       ARG  40 -27.572  -8.940  -6.167
  329   1HD   ARG  40          2HD       ARG  40 -28.545 -10.951  -6.629
  330   2HD   ARG  40          1HD       ARG  40 -26.924 -11.635  -6.392
  331    HE   ARG  40           HE       ARG  40 -27.702 -11.584  -3.846
  332   1HH1  ARG  40          1HH2      ARG  40 -28.862 -13.180  -6.578
  333   2HH1  ARG  40          2HH2      ARG  40 -30.259 -13.852  -5.804
  334   1HH2  ARG  40          1HH1      ARG  40 -29.811 -12.076  -2.860
  335   2HH2  ARG  40          2HH1      ARG  40 -30.795 -13.227  -3.700
  336    H    LEU  41           H        LEU  41 -23.065  -8.685  -6.614
  337    HA   LEU  41           HA       LEU  41 -21.195  -9.211  -4.507
  338   1HB   LEU  41          2HB       LEU  41 -20.108  -9.846  -6.397
  339   2HB   LEU  41          1HB       LEU  41 -21.313  -9.022  -7.378
  340    HG   LEU  41           HG       LEU  41 -20.046  -6.878  -7.012
  341   1HD1  LEU  41          1HD1      LEU  41 -18.184  -6.784  -5.709
  342   2HD1  LEU  41          2HD1      LEU  41 -17.593  -8.344  -6.280
  343   3HD1  LEU  41          3HD1      LEU  41 -18.804  -8.274  -4.998
  344   1HD2  LEU  41          1HD2      LEU  41 -18.981  -9.269  -8.456
  345   2HD2  LEU  41          2HD2      LEU  41 -17.956  -7.836  -8.376
  346   3HD2  LEU  41          3HD2      LEU  41 -19.560  -7.734  -9.102
  347    H    THR  42           H        THR  42 -22.367  -6.307  -6.048
  348    HA   THR  42           HA       THR  42 -20.385  -4.476  -5.000
  349    HB   THR  42           HB       THR  42 -23.221  -4.195  -6.018
  350    HG1  THR  42           HG1      THR  42 -21.132  -4.820  -7.277
  351   1HG2  THR  42          1HG2      THR  42 -21.318  -1.895  -5.965
  352   2HG2  THR  42          2HG2      THR  42 -22.112  -2.335  -4.452
  353   3HG2  THR  42          3HG2      THR  42 -23.078  -1.897  -5.862
  354    H    ALA  43           H        ALA  43 -23.838  -4.569  -4.214
  355    HA   ALA  43           HA       ALA  43 -23.878  -3.205  -1.809
  356   1HB   ALA  43          1HB       ALA  43 -25.487  -5.099  -3.237
  357   2HB   ALA  43          2HB       ALA  43 -26.012  -3.933  -2.022
  358   3HB   ALA  43          3HB       ALA  43 -25.505  -5.550  -1.534
  359    H    ASP  44           H        ASP  44 -22.669  -6.431  -2.436
  360    HA   ASP  44           HA       ASP  44 -22.360  -7.233   0.344
  361   1HB   ASP  44          2HB       ASP  44 -22.572  -8.653  -1.785
  362   2HB   ASP  44          1HB       ASP  44 -20.893  -8.226  -2.114
  363    H    ARG  45           H        ARG  45 -20.254  -5.852  -2.169
  364    HA   ARG  45           HA       ARG  45 -17.757  -5.931  -0.881
  365   1HB   ARG  45          2HB       ARG  45 -18.724  -5.006  -3.208
  366   2HB   ARG  45          1HB       ARG  45 -18.603  -3.467  -2.354
  367   1HG   ARG  45          2HG       ARG  45 -16.284  -3.616  -2.133
  368   2HG   ARG  45          1HG       ARG  45 -16.284  -5.374  -2.286
  369   1HD   ARG  45          2HD       ARG  45 -17.238  -4.816  -4.717
  370   2HD   ARG  45          1HD       ARG  45 -16.372  -3.293  -4.436
  371    HE   ARG  45           HE       ARG  45 -15.106  -5.999  -4.347
  372   1HH1  ARG  45          1HH2      ARG  45 -14.570  -2.870  -3.299
  373   2HH1  ARG  45          2HH2      ARG  45 -13.057  -2.660  -4.116
  374   1HH2  ARG  45          1HH1      ARG  45 -13.324  -5.607  -5.926
  375   2HH2  ARG  45          2HH1      ARG  45 -12.352  -4.210  -5.604
  376    H    GLN  46           H        GLN  46 -20.496  -3.754  -0.357
  377    HA   GLN  46           HA       GLN  46 -19.389  -1.654   1.095
  378   1HB   GLN  46          2HB       GLN  46 -21.808  -2.169   0.457
  379   2HB   GLN  46          1HB       GLN  46 -21.876  -3.187   1.897
  380   1HG   GLN  46          2HG       GLN  46 -22.522  -1.264   2.934
  381   2HG   GLN  46          1HG       GLN  46 -20.796  -0.900   2.928
  382   1HE2  GLN  46          1HE2      GLN  46 -23.582   0.645   2.343
  383   2HE2  GLN  46          2HE2      GLN  46 -23.135   1.639   1.042
  384    H    ARG  47           H        ARG  47 -19.961  -4.981   2.191
  385    HA   ARG  47           HA       ARG  47 -19.326  -4.470   4.979
  386   1HB   ARG  47          2HB       ARG  47 -20.105  -6.647   3.214
  387   2HB   ARG  47          1HB       ARG  47 -18.867  -7.173   4.356
  388   1HG   ARG  47          2HG       ARG  47 -20.195  -6.366   6.235
  389   2HG   ARG  47          1HG       ARG  47 -21.408  -5.714   5.132
  390   1HD   ARG  47          2HD       ARG  47 -21.606  -8.136   4.222
  391   2HD   ARG  47          1HD       ARG  47 -20.774  -8.609   5.718
  392    HE   ARG  47           HE       ARG  47 -22.660  -7.041   6.774
  393   1HH1  ARG  47          1HH2      ARG  47 -23.960  -7.317   3.949
  394   2HH1  ARG  47          2HH2      ARG  47 -25.151  -8.527   4.288
  395   1HH2  ARG  47          1HH1      ARG  47 -23.735  -9.452   7.313
  396   2HH2  ARG  47          2HH1      ARG  47 -25.025  -9.734   6.193
  397    H    VAL  48           H        VAL  48 -17.267  -3.612   5.325
  398    HA   VAL  48           HA       VAL  48 -14.958  -5.091   4.104
  399    HB   VAL  48           HB       VAL  48 -15.142  -2.235   5.119
  400   1HG1  VAL  48          1HG1      VAL  48 -12.994  -1.943   4.020
  401   2HG1  VAL  48          2HG1      VAL  48 -13.046  -3.592   3.397
  402   3HG1  VAL  48          3HG1      VAL  48 -12.873  -3.309   5.129
  403   1HG2  VAL  48          1HG2      VAL  48 -14.979  -3.118   2.236
  404   2HG2  VAL  48          2HG2      VAL  48 -15.437  -1.539   2.875
  405   3HG2  VAL  48          3HG2      VAL  48 -16.534  -2.911   3.041
  406    H    MET  49           H        MET  49 -14.701  -6.613   5.823
  407    HA   MET  49           HA       MET  49 -14.027  -5.426   8.496
  408   1HB   MET  49          2HB       MET  49 -15.860  -7.455   7.642
  409   2HB   MET  49          1HB       MET  49 -14.609  -8.225   8.620
  410   1HG   MET  49          2HG       MET  49 -16.006  -7.545  10.321
  411   2HG   MET  49          1HG       MET  49 -15.046  -6.074  10.160
  412   1HE   MET  49          1HE       MET  49 -19.315  -6.239  10.338
  413   2HE   MET  49          2HE       MET  49 -18.043  -5.814  11.480
  414   3HE   MET  49          3HE       MET  49 -18.079  -7.428  10.774
  415    H    ALA  50           H        ALA  50 -12.836  -7.124   5.785
  416    HA   ALA  50           HA       ALA  50 -10.365  -7.852   7.315
  417   1HB   ALA  50          1HB       ALA  50 -11.649  -9.872   6.982
  418   2HB   ALA  50          2HB       ALA  50 -10.321  -9.904   5.823
  419   3HB   ALA  50          3HB       ALA  50 -11.944  -9.466   5.291
  420    H    LEU  51           H        LEU  51  -8.449  -7.379   6.212
  421    HA   LEU  51           HA       LEU  51  -8.728  -6.300   3.424
  422   1HB   LEU  51          2HB       LEU  51  -8.294  -4.787   5.568
  423   2HB   LEU  51          1HB       LEU  51  -6.634  -5.339   5.342
  424    HG   LEU  51           HG       LEU  51  -7.129  -4.679   2.813
  425   1HD1  LEU  51          1HD1      LEU  51  -9.523  -4.093   3.431
  426   2HD1  LEU  51          2HD1      LEU  51  -8.637  -2.823   2.587
  427   3HD1  LEU  51          3HD1      LEU  51  -8.872  -2.723   4.331
  428   1HD2  LEU  51          1HD2      LEU  51  -5.343  -3.696   4.146
  429   2HD2  LEU  51          2HD2      LEU  51  -6.506  -2.732   5.057
  430   3HD2  LEU  51          3HD2      LEU  51  -6.228  -2.396   3.349
  431    H    GLN  52           H        GLN  52  -7.460  -7.390   1.978
  432    HA   GLN  52           HA       GLN  52  -5.041  -8.828   3.021
  433   1HB   GLN  52          2HB       GLN  52  -6.952 -10.330   2.561
  434   2HB   GLN  52          1HB       GLN  52  -7.054  -9.694   0.919
  435   1HG   GLN  52          2HG       GLN  52  -5.673 -11.421   0.391
  436   2HG   GLN  52          1HG       GLN  52  -4.407 -10.397   1.068
  437   1HE2  GLN  52          1HE2      GLN  52  -6.733 -12.978   1.987
  438   2HE2  GLN  52          2HE2      GLN  52  -5.795 -13.575   3.269
  Start of MODEL   11
    1   1H    SER   1          1H        SER   1  -9.333  13.070 -16.834
    2   2H    SER   1          2H        SER   1 -10.470  12.985 -15.575
    3   3H    SER   1          3H        SER   1  -8.896  13.543 -15.265
    4    HA   SER   1           HA       SER   1  -9.257  15.584 -16.279
    5   1HB   SER   1          1HB       SER   1 -11.415  13.994 -17.684
    6   2HB   SER   1          2HB       SER   1  -9.981  14.734 -18.391
    7    HG   SER   1           HG       SER   1 -12.144  16.129 -17.209
    8    H    ILE   2           H        ILE   2 -10.252  17.158 -15.038
    9    HA   ILE   2           HA       ILE   2 -11.600  18.027 -13.294
   10    HB   ILE   2           HB       ILE   2 -13.536  16.430 -15.002
   11   1HG1  ILE   2          2HG1      ILE   2 -13.016  19.411 -14.991
   12   2HG1  ILE   2          1HG1      ILE   2 -12.115  18.306 -16.030
   13   1HG2  ILE   2          1HG2      ILE   2 -14.312  17.101 -12.636
   14   2HG2  ILE   2          2HG2      ILE   2 -15.321  17.615 -13.988
   15   3HG2  ILE   2          3HG2      ILE   2 -14.229  18.764 -13.216
   16   1HD1  ILE   2          1HD1      ILE   2 -14.001  19.176 -17.291
   17   2HD1  ILE   2          2HD1      ILE   2 -15.117  18.723 -16.003
   18   3HD1  ILE   2          3HD1      ILE   2 -14.300  17.473 -16.940
   19    H    SER   3           H        SER   3 -10.699  16.803 -11.511
   20    HA   SER   3           HA       SER   3 -12.553  14.725 -10.460
   21   1HB   SER   3          2HB       SER   3 -10.316  13.465  -9.890
   22   2HB   SER   3          1HB       SER   3 -10.996  13.327 -11.509
   23    HG   SER   3           HG       SER   3  -8.752  13.862 -11.508
   24    HA   PRO   4           HA       PRO   4 -10.549  17.744  -7.417
   25   1HB   PRO   4          2HB       PRO   4 -12.730  19.323  -6.927
   26   2HB   PRO   4          1HB       PRO   4 -11.544  19.682  -8.199
   27   1HG   PRO   4          2HG       PRO   4 -14.239  18.442  -8.421
   28   2HG   PRO   4          1HG       PRO   4 -13.430  19.588  -9.500
   29   1HD   PRO   4          2HD       PRO   4 -13.612  16.910 -10.002
   30   2HD   PRO   4          1HD       PRO   4 -12.303  17.944 -10.618
   31    H    ARG   5           H        ARG   5 -14.053  16.951  -7.299
   32    HA   ARG   5           HA       ARG   5 -13.628  15.157  -5.004
   33   1HB   ARG   5          2HB       ARG   5 -14.435  17.988  -4.792
   34   2HB   ARG   5          1HB       ARG   5 -15.480  16.872  -3.911
   35   1HG   ARG   5          2HG       ARG   5 -13.933  16.760  -2.284
   36   2HG   ARG   5          1HG       ARG   5 -12.815  16.031  -3.438
   37   1HD   ARG   5          2HD       ARG   5 -11.746  18.022  -2.541
   38   2HD   ARG   5          1HD       ARG   5 -12.239  18.395  -4.205
   39    HE   ARG   5           HE       ARG   5 -14.071  19.704  -3.337
   40   1HH1  ARG   5          1HH2      ARG   5 -14.566  17.889  -0.928
   41   2HH1  ARG   5          2HH2      ARG   5 -14.139  18.945   0.376
   42   1HH2  ARG   5          1HH1      ARG   5 -12.471  21.209  -1.654
   43   2HH2  ARG   5          2HH1      ARG   5 -12.954  20.826  -0.036
   44    H    THR   6           H        THR   6 -14.688  14.373  -7.378
   45    HA   THR   6           HA       THR   6 -17.660  14.536  -7.123
   46    HB   THR   6           HB       THR   6 -17.194  13.272  -9.466
   47    HG1  THR   6           HG1      THR   6 -15.013  15.022  -9.337
   48   1HG2  THR   6          1HG2      THR   6 -18.325  15.189  -9.882
   49   2HG2  THR   6          2HG2      THR   6 -16.737  15.890 -10.192
   50   3HG2  THR   6          3HG2      THR   6 -17.483  16.065  -8.604
   51    HA   PRO   7           HA       PRO   7 -17.836  10.386  -5.677
   52   1HB   PRO   7          2HB       PRO   7 -20.333   9.706  -6.564
   53   2HB   PRO   7          1HB       PRO   7 -20.061  10.804  -5.196
   54   1HG   PRO   7          2HG       PRO   7 -20.742  11.438  -8.022
   55   2HG   PRO   7          1HG       PRO   7 -21.309  12.199  -6.528
   56   1HD   PRO   7          2HD       PRO   7 -19.385  13.273  -8.133
   57   2HD   PRO   7          1HD       PRO   7 -19.482  13.569  -6.382
   58    HA   PRO   8           HA       PRO   8 -16.725   7.927  -9.164
   59   1HB   PRO   8          2HB       PRO   8 -16.762   5.466  -7.984
   60   2HB   PRO   8          1HB       PRO   8 -15.493   6.666  -7.676
   61   1HG   PRO   8          2HG       PRO   8 -17.789   5.870  -5.989
   62   2HG   PRO   8          1HG       PRO   8 -16.179   6.432  -5.521
   63   1HD   PRO   8          2HD       PRO   8 -18.500   7.966  -5.505
   64   2HD   PRO   8          1HD       PRO   8 -16.842   8.597  -5.457
   65    H    ASN   9           H        ASN   9 -19.340   8.644  -9.466
   66    HA   ASN   9           HA       ASN   9 -21.442   7.954 -10.312
   67   1HB   ASN   9          2HB       ASN   9 -21.142   6.535 -12.145
   68   2HB   ASN   9          1HB       ASN   9 -19.507   7.133 -11.873
   69   1HD2  ASN   9          1HD2      ASN   9 -17.934   5.532 -11.713
   70   2HD2  ASN   9          2HD2      ASN   9 -18.231   3.910 -11.310
   71    H    CYS  10           H        CYS  10 -23.025   6.081 -10.411
   72    HA   CYS  10           HA       CYS  10 -23.258   4.880  -7.750
   73   1HB   CYS  10          2HB       CYS  10 -25.216   5.770  -8.932
   74   2HB   CYS  10          1HB       CYS  10 -24.871   4.781 -10.316
   75    H    ALA  11           H        ALA  11 -22.852   2.674  -7.274
   76    HA   ALA  11           HA       ALA  11 -21.458   1.178  -9.367
   77   1HB   ALA  11          1HB       ALA  11 -21.587   1.250  -6.482
   78   2HB   ALA  11          2HB       ALA  11 -20.326   0.578  -7.516
   79   3HB   ALA  11          3HB       ALA  11 -21.718  -0.407  -7.068
   80    H    ARG  12           H        ARG  12 -24.580   1.143  -7.846
   81    HA   ARG  12           HA       ARG  12 -25.423  -1.523  -8.391
   82   1HB   ARG  12          2HB       ARG  12 -26.561   0.308  -7.084
   83   2HB   ARG  12          1HB       ARG  12 -26.950   1.087  -8.608
   84   1HG   ARG  12          2HG       ARG  12 -28.879  -0.136  -8.268
   85   2HG   ARG  12          1HG       ARG  12 -27.929  -1.271  -9.227
   86   1HD   ARG  12          2HD       ARG  12 -29.004  -2.270  -7.134
   87   2HD   ARG  12          1HD       ARG  12 -27.246  -2.487  -7.238
   88    HE   ARG  12           HE       ARG  12 -27.063  -1.094  -5.347
   89   1HH1  ARG  12          1HH2      ARG  12 -29.993  -1.498  -4.751
   90   2HH1  ARG  12          2HH2      ARG  12 -30.559   0.135  -4.650
   91   1HH2  ARG  12          1HH1      ARG  12 -27.774   1.477  -6.220
   92   2HH2  ARG  12          2HH1      ARG  12 -29.304   1.819  -5.484
   93    H    CYS  13           H        CYS  13 -25.653   1.409 -10.352
   94    HA   CYS  13           HA       CYS  13 -26.649  -0.127 -12.627
   95   1HB   CYS  13          2HB       CYS  13 -26.737   2.149 -13.657
   96   2HB   CYS  13          1HB       CYS  13 -27.475   2.105 -12.076
   97    H    ARG  14           H        ARG  14 -23.372   0.951 -11.655
   98    HA   ARG  14           HA       ARG  14 -22.290   0.889 -14.352
   99   1HB   ARG  14          2HB       ARG  14 -20.115   0.438 -13.143
  100   2HB   ARG  14          1HB       ARG  14 -20.991   1.845 -12.545
  101   1HG   ARG  14          2HG       ARG  14 -20.280   0.614 -10.621
  102   2HG   ARG  14          1HG       ARG  14 -21.999   0.346 -10.800
  103   1HD   ARG  14          2HD       ARG  14 -21.688  -1.878 -10.906
  104   2HD   ARG  14          1HD       ARG  14 -20.542  -1.685 -12.248
  105    HE   ARG  14           HE       ARG  14 -19.284  -0.816  -9.832
  106   1HH1  ARG  14          1HH2      ARG  14 -19.356  -3.275 -12.096
  107   2HH1  ARG  14          2HH2      ARG  14 -18.671  -4.488 -11.066
  108   1HH2  ARG  14          1HH1      ARG  14 -18.840  -2.533  -8.208
  109   2HH2  ARG  14          2HH1      ARG  14 -18.377  -4.066  -8.867
  110    H    ASN  15           H        ASN  15 -23.159  -1.545 -12.054
  111    HA   ASN  15           HA       ASN  15 -21.710  -3.791 -12.713
  112   1HB   ASN  15          2HB       ASN  15 -24.640  -3.309 -12.178
  113   2HB   ASN  15          1HB       ASN  15 -23.960  -4.929 -12.217
  114   1HD2  ASN  15          1HD2      ASN  15 -24.884  -2.740 -10.058
  115   2HD2  ASN  15          2HD2      ASN  15 -23.672  -2.856  -8.885
  116    H    HIS  16           H        HIS  16 -24.306  -2.281 -14.475
  117    HA   HIS  16           HA       HIS  16 -24.186  -4.317 -16.636
  118   1HB   HIS  16          2HB       HIS  16 -26.052  -2.040 -15.923
  119   2HB   HIS  16          1HB       HIS  16 -26.322  -3.178 -17.224
  120    HD1  HIS  16           HD1      HIS  16 -27.181  -5.493 -16.659
  121    HD2  HIS  16           HD2      HIS  16 -26.016  -3.284 -13.326
  122    HE1  HIS  16           HE1      HIS  16 -27.844  -6.867 -14.622
  123    H    GLY  17           H        GLY  17 -22.945  -1.213 -15.913
  124   1HA   GLY  17          2HA       GLY  17 -21.272  -0.332 -17.540
  125   2HA   GLY  17          1HA       GLY  17 -22.399  -0.774 -18.826
  126    H    LEU  18           H        LEU  18 -23.428   0.671 -15.816
  127    HA   LEU  18           HA       LEU  18 -24.450   3.014 -17.346
  128   1HB   LEU  18          2HB       LEU  18 -25.579   1.238 -15.598
  129   2HB   LEU  18          1HB       LEU  18 -25.164   2.564 -14.511
  130    HG   LEU  18           HG       LEU  18 -27.447   2.798 -15.472
  131   1HD1  LEU  18          1HD1      LEU  18 -27.213   5.051 -15.526
  132   2HD1  LEU  18          2HD1      LEU  18 -26.014   4.990 -16.818
  133   3HD1  LEU  18          3HD1      LEU  18 -25.525   4.712 -15.147
  134   1HD2  LEU  18          1HD2      LEU  18 -26.499   3.611 -18.120
  135   2HD2  LEU  18          2HD2      LEU  18 -27.850   2.563 -17.688
  136   3HD2  LEU  18          3HD2      LEU  18 -26.220   1.899 -17.800
  137    H    LYS  19           H        LYS  19 -24.117   5.169 -16.428
  138    HA   LYS  19           HA       LYS  19 -22.158   5.490 -14.241
  139   1HB   LYS  19          2HB       LYS  19 -21.293   5.257 -16.849
  140   2HB   LYS  19          1HB       LYS  19 -21.468   7.004 -16.681
  141   1HG   LYS  19          2HG       LYS  19 -19.199   6.266 -16.029
  142   2HG   LYS  19          1HG       LYS  19 -20.063   6.962 -14.658
  143   1HD   LYS  19          2HD       LYS  19 -20.187   4.964 -13.551
  144   2HD   LYS  19          1HD       LYS  19 -20.407   4.042 -15.037
  145   1HE   LYS  19          2HE       LYS  19 -17.779   5.192 -15.085
  146   2HE   LYS  19          1HE       LYS  19 -18.005   4.345 -13.542
  147   1HZ   LYS  19          1HZ       LYS  19 -18.497   2.373 -14.582
  148   2HZ   LYS  19          2HZ       LYS  19 -17.343   3.005 -15.656
  149   3HZ   LYS  19          3HZ       LYS  19 -18.998   3.117 -16.022
  150    H    ILE  20           H        ILE  20 -23.875   6.584 -13.203
  151    HA   ILE  20           HA       ILE  20 -24.958   9.025 -14.528
  152    HB   ILE  20           HB       ILE  20 -26.903   8.469 -13.464
  153   1HG1  ILE  20          2HG1      ILE  20 -25.661   9.036 -11.226
  154   2HG1  ILE  20          1HG1      ILE  20 -27.208   8.242 -11.246
  155   1HG2  ILE  20          1HG2      ILE  20 -25.526   5.882 -12.869
  156   2HG2  ILE  20          2HG2      ILE  20 -26.130   6.350 -14.452
  157   3HG2  ILE  20          3HG2      ILE  20 -27.253   6.143 -13.111
  158   1HD1  ILE  20          1HD1      ILE  20 -25.650   7.096  -9.775
  159   2HD1  ILE  20          2HD1      ILE  20 -24.557   6.837 -11.124
  160   3HD1  ILE  20          3HD1      ILE  20 -26.139   6.061 -11.104
  161    H    THR  21           H        THR  21 -22.538   8.207 -12.358
  162    HA   THR  21           HA       THR  21 -21.137   9.668 -11.069
  163    HB   THR  21           HB       THR  21 -23.256  11.789 -11.215
  164    HG1  THR  21           HG1      THR  21 -22.541  12.295 -13.290
  165   1HG2  THR  21          1HG2      THR  21 -20.648  12.680 -11.898
  166   2HG2  THR  21          2HG2      THR  21 -20.476  11.590 -10.523
  167   3HG2  THR  21          3HG2      THR  21 -21.538  12.993 -10.409
  168    H    LEU  22           H        LEU  22 -24.140   8.533 -10.407
  169    HA   LEU  22           HA       LEU  22 -25.405   8.120  -8.454
  170   1HB   LEU  22          2HB       LEU  22 -23.489   6.924  -7.802
  171   2HB   LEU  22          1HB       LEU  22 -22.540   8.391  -7.569
  172    HG   LEU  22           HG       LEU  22 -23.784   8.968  -5.584
  173   1HD1  LEU  22          1HD1      LEU  22 -25.948   8.370  -5.389
  174   2HD1  LEU  22          2HD1      LEU  22 -25.460   6.684  -5.217
  175   3HD1  LEU  22          3HD1      LEU  22 -25.798   7.344  -6.816
  176   1HD2  LEU  22          1HD2      LEU  22 -23.624   6.544  -4.405
  177   2HD2  LEU  22          2HD2      LEU  22 -22.198   7.510  -4.787
  178   3HD2  LEU  22          3HD2      LEU  22 -22.701   6.212  -5.870
  179    H    LYS  23           H        LYS  23 -24.623  11.129  -9.251
  180    HA   LYS  23           HA       LYS  23 -24.945  12.498  -6.681
  181   1HB   LYS  23          2HB       LYS  23 -23.699  13.391  -8.668
  182   2HB   LYS  23          1HB       LYS  23 -25.227  13.471  -9.548
  183   1HG   LYS  23          2HG       LYS  23 -26.047  15.216  -8.239
  184   2HG   LYS  23          1HG       LYS  23 -25.005  14.814  -6.873
  185   1HD   LYS  23          2HD       LYS  23 -23.051  15.434  -8.483
  186   2HD   LYS  23          1HD       LYS  23 -24.299  16.257  -9.420
  187   1HE   LYS  23          2HE       LYS  23 -24.464  17.949  -7.906
  188   2HE   LYS  23          1HE       LYS  23 -24.430  16.829  -6.529
  189   1HZ   LYS  23          1HZ       LYS  23 -22.375  18.385  -7.142
  190   2HZ   LYS  23          2HZ       LYS  23 -21.989  17.041  -8.107
  191   3HZ   LYS  23          3HZ       LYS  23 -22.184  16.857  -6.429
  192    H    GLY  24           H        GLY  24 -26.975  12.425  -5.677
  193   1HA   GLY  24          2HA       GLY  24 -29.330  12.229  -5.489
  194   2HA   GLY  24          1HA       GLY  24 -29.361  13.386  -6.830
  195    H    HIS  25           H        HIS  25 -28.777   9.922  -6.207
  196    HA   HIS  25           HA       HIS  25 -30.155   9.320  -8.801
  197   1HB   HIS  25          2HB       HIS  25 -27.739   9.379  -9.054
  198   2HB   HIS  25          1HB       HIS  25 -27.534   8.330  -7.659
  199    HD1  HIS  25           HD1      HIS  25 -29.450   8.133 -10.972
  200    HD2  HIS  25           HD2      HIS  25 -27.045   5.780  -8.521
  201    HE1  HIS  25           HE1      HIS  25 -29.006   5.962 -12.208
  202    H    LYS  26           H        LYS  26 -28.553   6.753  -7.166
  203    HA   LYS  26           HA       LYS  26 -29.467   4.757  -6.304
  204   1HB   LYS  26          2HB       LYS  26 -30.259   7.126  -4.702
  205   2HB   LYS  26          1HB       LYS  26 -31.128   5.635  -4.331
  206   1HG   LYS  26          2HG       LYS  26 -28.965   4.453  -4.072
  207   2HG   LYS  26          1HG       LYS  26 -28.114   5.964  -4.390
  208   1HD   LYS  26          2HD       LYS  26 -28.230   6.383  -2.179
  209   2HD   LYS  26          1HD       LYS  26 -29.968   6.599  -2.387
  210   1HE   LYS  26          2HE       LYS  26 -30.039   4.888  -0.833
  211   2HE   LYS  26          1HE       LYS  26 -29.851   3.885  -2.285
  212   1HZ   LYS  26          1HZ       LYS  26 -27.523   5.041  -0.869
  213   2HZ   LYS  26          2HZ       LYS  26 -27.546   3.772  -1.999
  214   3HZ   LYS  26          3HZ       LYS  26 -28.165   3.533  -0.435
  215    H    ARG  27           H        ARG  27 -32.427   6.433  -5.468
  216    HA   ARG  27           HA       ARG  27 -34.211   4.575  -6.538
  217   1HB   ARG  27          2HB       ARG  27 -34.516   6.738  -5.106
  218   2HB   ARG  27          1HB       ARG  27 -34.732   7.545  -6.660
  219   1HG   ARG  27          2HG       ARG  27 -36.925   6.922  -5.951
  220   2HG   ARG  27          1HG       ARG  27 -36.474   5.749  -7.191
  221   1HD   ARG  27          2HD       ARG  27 -36.090   4.037  -5.612
  222   2HD   ARG  27          1HD       ARG  27 -35.931   5.189  -4.271
  223    HE   ARG  27           HE       ARG  27 -38.504   4.509  -5.630
  224   1HH1  ARG  27          1HH2      ARG  27 -37.793   7.254  -4.191
  225   2HH1  ARG  27          2HH2      ARG  27 -38.667   7.012  -2.716
  226   1HH2  ARG  27          1HH1      ARG  27 -39.155   3.622  -3.248
  227   2HH2  ARG  27          2HH1      ARG  27 -39.437   4.957  -2.181
  228    H    TYR  28           H        TYR  28 -32.498   7.171  -8.202
  229    HA   TYR  28           HA       TYR  28 -33.985   6.962 -10.698
  230   1HB   TYR  28          2HB       TYR  28 -31.331   8.166  -9.851
  231   2HB   TYR  28          1HB       TYR  28 -32.012   8.366 -11.470
  232    HD1  TYR  28           HD1      TYR  28 -31.881   9.739  -8.213
  233    HD2  TYR  28           HD2      TYR  28 -34.535   9.165 -11.540
  234    HE1  TYR  28           HE1      TYR  28 -33.306  11.596  -7.396
  235    HE2  TYR  28           HE2      TYR  28 -35.961  11.022 -10.724
  236    HH   TYR  28           HH       TYR  28 -36.417  12.300  -8.852
  237    H    CYS  29           H        CYS  29 -31.475   5.163  -9.207
  238    HA   CYS  29           HA       CYS  29 -29.844   4.270 -11.289
  239   1HB   CYS  29          2HB       CYS  29 -29.956   3.698  -8.725
  240   2HB   CYS  29          1HB       CYS  29 -30.983   2.377  -9.253
  241    H    LYS  30           H        LYS  30 -29.960   2.623 -12.795
  242    HA   LYS  30           HA       LYS  30 -32.703   1.713 -13.545
  243   1HB   LYS  30          2HB       LYS  30 -31.494   2.580 -15.396
  244   2HB   LYS  30          1HB       LYS  30 -29.973   1.893 -14.837
  245   1HG   LYS  30          2HG       LYS  30 -30.807   0.648 -16.783
  246   2HG   LYS  30          1HG       LYS  30 -30.825  -0.379 -15.356
  247   1HD   LYS  30          2HD       LYS  30 -32.910  -0.393 -16.871
  248   2HD   LYS  30          1HD       LYS  30 -33.155  -0.251 -15.131
  249   1HE   LYS  30          2HE       LYS  30 -33.739   2.019 -15.265
  250   2HE   LYS  30          1HE       LYS  30 -32.891   2.243 -16.809
  251   1HZ   LYS  30          1HZ       LYS  30 -35.151   2.071 -17.375
  252   2HZ   LYS  30          2HZ       LYS  30 -35.418   0.779 -16.306
  253   3HZ   LYS  30          3HZ       LYS  30 -34.506   0.541 -17.719
  254    H    PHE  31           H        PHE  31 -30.455   0.907 -11.406
  255    HA   PHE  31           HA       PHE  31 -30.891  -2.037 -11.575
  256   1HB   PHE  31          2HB       PHE  31 -28.290  -0.516 -11.117
  257   2HB   PHE  31          1HB       PHE  31 -28.422  -2.278 -11.196
  258    HD1  PHE  31           HD1      PHE  31 -28.558   0.866 -13.089
  259    HD2  PHE  31           HD2      PHE  31 -28.951  -3.400 -13.308
  260    HE1  PHE  31           HE1      PHE  31 -28.493   0.995 -15.552
  261    HE2  PHE  31           HE2      PHE  31 -28.901  -3.278 -15.774
  262    HZ   PHE  31           HZ       PHE  31 -28.678  -1.080 -16.909
  263    H    ARG  32           H        ARG  32 -31.451   0.669  -9.871
  264    HA   ARG  32           HA       ARG  32 -30.444   0.459  -7.285
  265   1HB   ARG  32          2HB       ARG  32 -32.960   1.252  -6.742
  266   2HB   ARG  32          1HB       ARG  32 -31.772   2.311  -7.485
  267   1HG   ARG  32          2HG       ARG  32 -34.080   2.230  -8.585
  268   2HG   ARG  32          1HG       ARG  32 -32.702   2.004  -9.642
  269   1HD   ARG  32          2HD       ARG  32 -33.161  -0.256  -9.993
  270   2HD   ARG  32          1HD       ARG  32 -34.011  -0.411  -8.442
  271    HE   ARG  32           HE       ARG  32 -35.895   0.828  -9.413
  272   1HH1  ARG  32          1HH2      ARG  32 -34.013   2.039 -11.590
  273   2HH1  ARG  32          2HH2      ARG  32 -34.670   1.281 -13.003
  274   1HH2  ARG  32          1HH1      ARG  32 -36.474  -1.084 -11.218
  275   2HH2  ARG  32          2HH1      ARG  32 -36.061  -0.488 -12.792
  276    H    TYR  33           H        TYR  33 -32.605  -1.704  -8.885
  277    HA   TYR  33           HA       TYR  33 -33.023  -3.177  -6.303
  278   1HB   TYR  33          2HB       TYR  33 -34.898  -2.661  -8.630
  279   2HB   TYR  33          1HB       TYR  33 -35.253  -3.793  -7.325
  280    HD1  TYR  33           HD1      TYR  33 -36.380  -0.854  -8.306
  281    HD2  TYR  33           HD2      TYR  33 -34.150  -2.402  -4.976
  282    HE1  TYR  33           HE1      TYR  33 -37.185   1.020  -6.894
  283    HE2  TYR  33           HE2      TYR  33 -34.956  -0.529  -3.565
  284    HH   TYR  33           HH       TYR  33 -35.804   1.916  -4.071
  285    H    CYS  34           H        CYS  34 -31.695  -3.262  -9.396
  286    HA   CYS  34           HA       CYS  34 -32.203  -5.741 -10.522
  287   1HB   CYS  34          2HB       CYS  34 -30.551  -3.983 -11.274
  288   2HB   CYS  34          1HB       CYS  34 -29.469  -4.547 -10.002
  289    H    THR  35           H        THR  35 -30.803  -7.778 -10.302
  290    HA   THR  35           HA       THR  35 -29.864  -8.247  -7.511
  291    HB   THR  35           HB       THR  35 -31.196 -10.506  -7.838
  292    HG1  THR  35           HG1      THR  35 -31.746  -9.900 -10.023
  293   1HG2  THR  35          1HG2      THR  35 -33.324  -9.146  -7.081
  294   2HG2  THR  35          2HG2      THR  35 -32.202  -7.786  -7.075
  295   3HG2  THR  35          3HG2      THR  35 -31.892  -9.189  -6.051
  296    H    CYS  36           H        CYS  36 -29.026  -8.303 -10.664
  297    HA   CYS  36           HA       CYS  36 -28.042 -10.845 -11.303
  298   1HB   CYS  36          2HB       CYS  36 -26.523  -9.661 -12.742
  299   2HB   CYS  36          1HB       CYS  36 -27.998  -8.698 -12.647
  300    H    GLU  37           H        GLU  37 -25.466 -11.291 -11.221
  301    HA   GLU  37           HA       GLU  37 -24.796 -11.459  -8.372
  302   1HB   GLU  37          2HB       GLU  37 -22.968 -12.851  -9.218
  303   2HB   GLU  37          1HB       GLU  37 -24.458 -13.268 -10.064
  304   1HG   GLU  37          2HG       GLU  37 -23.681 -12.509 -12.060
  305   2HG   GLU  37          1HG       GLU  37 -22.923 -11.094 -11.329
  306    H    LYS  38           H        LYS  38 -24.335  -9.026 -10.619
  307    HA   LYS  38           HA       LYS  38 -21.682  -8.201  -9.513
  308   1HB   LYS  38          2HB       LYS  38 -23.120  -7.983 -12.039
  309   2HB   LYS  38          1HB       LYS  38 -22.584  -6.397 -11.482
  310   1HG   LYS  38          2HG       LYS  38 -20.358  -7.870 -10.965
  311   2HG   LYS  38          1HG       LYS  38 -20.982  -8.724 -12.377
  312   1HD   LYS  38          2HD       LYS  38 -21.292  -6.087 -13.111
  313   2HD   LYS  38          1HD       LYS  38 -19.789  -6.044 -12.188
  314   1HE   LYS  38          2HE       LYS  38 -18.652  -7.318 -13.731
  315   2HE   LYS  38          1HE       LYS  38 -20.083  -8.288 -14.133
  316   1HZ   LYS  38          1HZ       LYS  38 -20.153  -5.426 -14.735
  317   2HZ   LYS  38          2HZ       LYS  38 -20.874  -6.723 -15.561
  318   3HZ   LYS  38          3HZ       LYS  38 -19.215  -6.411 -15.748
  319    H    CYS  39           H        CYS  39 -25.041  -7.647  -9.312
  320    HA   CYS  39           HA       CYS  39 -24.826  -4.904  -8.235
  321   1HB   CYS  39          2HB       CYS  39 -26.871  -6.815  -9.209
  322   2HB   CYS  39          1HB       CYS  39 -27.390  -5.826  -7.861
  323    H    ARG  40           H        ARG  40 -25.507  -8.253  -7.260
  324    HA   ARG  40           HA       ARG  40 -25.921  -7.623  -4.441
  325   1HB   ARG  40          2HB       ARG  40 -25.707 -10.005  -6.230
  326   2HB   ARG  40          1HB       ARG  40 -25.381 -10.271  -4.516
  327   1HG   ARG  40          2HG       ARG  40 -27.557  -9.974  -3.934
  328   2HG   ARG  40          1HG       ARG  40 -27.763  -8.619  -5.044
  329   1HD   ARG  40          2HD       ARG  40 -29.099 -10.180  -6.123
  330   2HD   ARG  40          1HD       ARG  40 -27.541 -10.612  -6.853
  331    HE   ARG  40           HE       ARG  40 -27.330 -12.410  -5.183
  332   1HH1  ARG  40          1HH2      ARG  40 -30.070 -10.503  -4.533
  333   2HH1  ARG  40          2HH2      ARG  40 -31.078 -11.831  -4.066
  334   1HH2  ARG  40          1HH1      ARG  40 -28.742 -14.247  -4.919
  335   2HH2  ARG  40          2HH1      ARG  40 -30.326 -13.950  -4.283
  336    H    LEU  41           H        LEU  41 -23.287  -8.587  -6.541
  337    HA   LEU  41           HA       LEU  41 -21.317  -9.142  -4.513
  338   1HB   LEU  41          2HB       LEU  41 -20.717  -9.953  -6.600
  339   2HB   LEU  41          1HB       LEU  41 -21.475  -8.606  -7.443
  340    HG   LEU  41           HG       LEU  41 -19.628  -7.153  -6.956
  341   1HD1  LEU  41          1HD1      LEU  41 -19.251  -8.955  -4.760
  342   2HD1  LEU  41          2HD1      LEU  41 -18.460  -7.405  -5.047
  343   3HD1  LEU  41          3HD1      LEU  41 -17.754  -8.889  -5.687
  344   1HD2  LEU  41          1HD2      LEU  41 -18.879  -9.911  -7.912
  345   2HD2  LEU  41          2HD2      LEU  41 -17.668  -8.631  -7.821
  346   3HD2  LEU  41          3HD2      LEU  41 -19.083  -8.433  -8.855
  347    H    THR  42           H        THR  42 -22.520  -6.254  -6.071
  348    HA   THR  42           HA       THR  42 -20.433  -4.453  -5.167
  349    HB   THR  42           HB       THR  42 -23.259  -4.175  -6.185
  350    HG1  THR  42           HG1      THR  42 -20.688  -4.137  -7.230
  351   1HG2  THR  42          1HG2      THR  42 -21.273  -1.938  -5.714
  352   2HG2  THR  42          2HG2      THR  42 -22.633  -2.288  -4.647
  353   3HG2  THR  42          3HG2      THR  42 -22.925  -1.781  -6.309
  354    H    ALA  43           H        ALA  43 -23.865  -4.463  -4.271
  355    HA   ALA  43           HA       ALA  43 -23.793  -2.990  -1.921
  356   1HB   ALA  43          1HB       ALA  43 -25.844  -4.113  -1.397
  357   2HB   ALA  43          2HB       ALA  43 -25.320  -5.593  -2.200
  358   3HB   ALA  43          3HB       ALA  43 -25.733  -4.169  -3.156
  359    H    ASP  44           H        ASP  44 -22.832  -6.341  -2.437
  360    HA   ASP  44           HA       ASP  44 -22.381  -7.063   0.314
  361   1HB   ASP  44          2HB       ASP  44 -22.645  -8.582  -1.667
  362   2HB   ASP  44          1HB       ASP  44 -21.071  -8.037  -2.250
  363    H    ARG  45           H        ARG  45 -20.339  -5.668  -2.242
  364    HA   ARG  45           HA       ARG  45 -17.823  -5.711  -0.938
  365   1HB   ARG  45          2HB       ARG  45 -18.256  -5.120  -3.302
  366   2HB   ARG  45          1HB       ARG  45 -19.068  -3.642  -2.783
  367   1HG   ARG  45          2HG       ARG  45 -16.458  -3.852  -1.542
  368   2HG   ARG  45          1HG       ARG  45 -16.320  -3.964  -3.298
  369   1HD   ARG  45          2HD       ARG  45 -17.311  -1.843  -3.633
  370   2HD   ARG  45          1HD       ARG  45 -18.021  -1.822  -2.007
  371    HE   ARG  45           HE       ARG  45 -15.332  -2.029  -1.481
  372   1HH1  ARG  45          1HH2      ARG  45 -17.463   0.428  -1.902
  373   2HH1  ARG  45          2HH2      ARG  45 -16.321   1.613  -2.443
  374   1HH2  ARG  45          1HH1      ARG  45 -13.744  -0.672  -2.856
  375   2HH2  ARG  45          2HH1      ARG  45 -14.215   0.991  -2.983
  376    H    GLN  46           H        GLN  46 -20.517  -3.405  -0.681
  377    HA   GLN  46           HA       GLN  46 -19.069  -1.544   1.032
  378   1HB   GLN  46          2HB       GLN  46 -21.100  -1.220  -0.574
  379   2HB   GLN  46          1HB       GLN  46 -22.063  -1.804   0.783
  380   1HG   GLN  46          2HG       GLN  46 -21.528   0.028   2.128
  381   2HG   GLN  46          1HG       GLN  46 -20.051   0.380   1.231
  382   1HE2  GLN  46          1HE2      GLN  46 -21.890   2.466   1.686
  383   2HE2  GLN  46          2HE2      GLN  46 -22.637   2.888   0.222
  384    H    ARG  47           H        ARG  47 -20.159  -4.622   1.625
  385    HA   ARG  47           HA       ARG  47 -21.400  -4.228   4.241
  386   1HB   ARG  47          2HB       ARG  47 -21.485  -6.164   2.402
  387   2HB   ARG  47          1HB       ARG  47 -20.152  -6.803   3.364
  388   1HG   ARG  47          2HG       ARG  47 -21.741  -7.674   4.719
  389   2HG   ARG  47          1HG       ARG  47 -21.998  -6.021   5.283
  390   1HD   ARG  47          2HD       ARG  47 -23.907  -5.731   3.987
  391   2HD   ARG  47          1HD       ARG  47 -23.381  -6.909   2.768
  392    HE   ARG  47           HE       ARG  47 -23.850  -8.698   4.451
  393   1HH1  ARG  47          1HH2      ARG  47 -24.054  -6.485   6.659
  394   2HH1  ARG  47          2HH2      ARG  47 -25.751  -6.569   6.996
  395   1HH2  ARG  47          1HH1      ARG  47 -26.496  -8.405   4.150
  396   2HH2  ARG  47          2HH1      ARG  47 -27.134  -7.653   5.573
  397    H    VAL  48           H        VAL  48 -20.320  -5.541   6.138
  398    HA   VAL  48           HA       VAL  48 -17.469  -4.648   6.321
  399    HB   VAL  48           HB       VAL  48 -19.578  -5.282   8.413
  400   1HG1  VAL  48          1HG1      VAL  48 -16.682  -4.515   8.558
  401   2HG1  VAL  48          2HG1      VAL  48 -17.587  -5.652   9.557
  402   3HG1  VAL  48          3HG1      VAL  48 -17.786  -3.917   9.796
  403   1HG2  VAL  48          1HG2      VAL  48 -18.418  -2.652   7.437
  404   2HG2  VAL  48          2HG2      VAL  48 -19.566  -2.829   8.763
  405   3HG2  VAL  48          3HG2      VAL  48 -20.049  -3.239   7.117
  406    H    MET  49           H        MET  49 -17.359  -6.887   4.970
  407    HA   MET  49           HA       MET  49 -16.717  -9.003   6.988
  408   1HB   MET  49          2HB       MET  49 -18.604  -9.008   4.686
  409   2HB   MET  49          1HB       MET  49 -17.634 -10.465   4.904
  410   1HG   MET  49          2HG       MET  49 -18.357 -10.245   7.417
  411   2HG   MET  49          1HG       MET  49 -19.657  -9.248   6.764
  412   1HE   MET  49          1HE       MET  49 -17.655 -12.245   6.688
  413   2HE   MET  49          2HE       MET  49 -18.550 -13.535   5.889
  414   3HE   MET  49          3HE       MET  49 -18.911 -13.131   7.566
  415    H    ALA  50           H        ALA  50 -14.453  -8.537   6.679
  416    HA   ALA  50           HA       ALA  50 -13.359  -8.803   3.925
  417   1HB   ALA  50          1HB       ALA  50 -12.120  -7.126   4.824
  418   2HB   ALA  50          2HB       ALA  50 -11.289  -8.379   5.747
  419   3HB   ALA  50          3HB       ALA  50 -12.655  -7.519   6.458
  420    H    LEU  51           H        LEU  51 -14.066 -11.207   4.093
  421    HA   LEU  51           HA       LEU  51 -12.465 -12.916   5.868
  422   1HB   LEU  51          2HB       LEU  51 -13.712 -14.699   4.633
  423   2HB   LEU  51          1HB       LEU  51 -14.781 -13.452   5.277
  424    HG   LEU  51           HG       LEU  51 -13.775 -12.815   2.601
  425   1HD1  LEU  51          1HD1      LEU  51 -15.280 -15.378   3.110
  426   2HD1  LEU  51          2HD1      LEU  51 -13.872 -15.117   2.080
  427   3HD1  LEU  51          3HD1      LEU  51 -15.452 -14.508   1.586
  428   1HD2  LEU  51          1HD2      LEU  51 -15.608 -11.530   2.966
  429   2HD2  LEU  51          2HD2      LEU  51 -16.191 -12.589   4.249
  430   3HD2  LEU  51          3HD2      LEU  51 -16.544 -12.968   2.563
  431    H    GLN  52           H        GLN  52 -10.407 -11.855   4.814
  432    HA   GLN  52           HA       GLN  52  -9.357 -13.780   2.848
  433   1HB   GLN  52          2HB       GLN  52 -10.676 -11.781   1.748
  434   2HB   GLN  52          1HB       GLN  52  -9.214 -10.866   2.122
  435   1HG   GLN  52          2HG       GLN  52  -7.900 -12.709   0.963
  436   2HG   GLN  52          1HG       GLN  52  -9.447 -13.343   0.398
  437   1HE2  GLN  52          1HE2      GLN  52 -10.766 -10.804  -0.049
  438   2HE2  GLN  52          2HE2      GLN  52  -9.996 -10.045  -1.358
  Start of MODEL   12
    1   1H    SER   1          1H        SER   1 -16.189  23.459 -24.105
    2   2H    SER   1          2H        SER   1 -15.450  22.244 -23.175
    3   3H    SER   1          3H        SER   1 -15.020  22.448 -24.806
    4    HA   SER   1           HA       SER   1 -13.687  24.237 -24.397
    5   1HB   SER   1          2HB       SER   1 -15.982  25.113 -23.260
    6   2HB   SER   1          1HB       SER   1 -14.992  24.933 -21.813
    7    HG   SER   1           HG       SER   1 -14.898  26.818 -23.737
    8    H    ILE   2           H        ILE   2 -14.770  22.892 -21.249
    9    HA   ILE   2           HA       ILE   2 -12.352  21.362 -20.836
   10    HB   ILE   2           HB       ILE   2 -11.398  23.610 -20.697
   11   1HG1  ILE   2          2HG1      ILE   2 -11.751  22.560 -17.877
   12   2HG1  ILE   2          1HG1      ILE   2 -10.683  21.804 -19.060
   13   1HG2  ILE   2          1HG2      ILE   2 -13.856  24.378 -19.806
   14   2HG2  ILE   2          2HG2      ILE   2 -12.403  25.364 -19.636
   15   3HG2  ILE   2          3HG2      ILE   2 -12.952  24.361 -18.292
   16   1HD1  ILE   2          1HD1      ILE   2  -9.450  23.929 -19.305
   17   2HD1  ILE   2          2HD1      ILE   2  -9.429  23.374 -17.630
   18   3HD1  ILE   2          3HD1      ILE   2 -10.512  24.680 -18.114
   19    H    SER   3           H        SER   3 -14.217  19.943 -20.252
   20    HA   SER   3           HA       SER   3 -15.402  20.582 -17.575
   21   1HB   SER   3          2HB       SER   3 -17.075  20.312 -19.257
   22   2HB   SER   3          1HB       SER   3 -16.262  18.908 -19.943
   23    HG   SER   3           HG       SER   3 -16.753  17.777 -18.041
   24    HA   PRO   4           HA       PRO   4 -12.831  17.239 -16.151
   25   1HB   PRO   4          2HB       PRO   4 -13.729  17.234 -13.568
   26   2HB   PRO   4          1HB       PRO   4 -12.593  18.447 -14.191
   27   1HG   PRO   4          2HG       PRO   4 -15.514  18.666 -13.700
   28   2HG   PRO   4          1HG       PRO   4 -14.238  19.876 -13.494
   29   1HD   PRO   4          2HD       PRO   4 -15.975  19.795 -15.625
   30   2HD   PRO   4          1HD       PRO   4 -14.377  20.568 -15.660
   31    H    ARG   5           H        ARG   5 -13.326  15.105 -16.518
   32    HA   ARG   5           HA       ARG   5 -16.118  14.181 -15.927
   33   1HB   ARG   5          2HB       ARG   5 -15.184  14.266 -18.310
   34   2HB   ARG   5          1HB       ARG   5 -14.093  12.967 -17.823
   35   1HG   ARG   5          2HG       ARG   5 -15.901  11.771 -18.698
   36   2HG   ARG   5          1HG       ARG   5 -16.286  11.805 -16.976
   37   1HD   ARG   5          2HD       ARG   5 -17.848  13.620 -17.278
   38   2HD   ARG   5          1HD       ARG   5 -17.332  13.853 -18.960
   39    HE   ARG   5           HE       ARG   5 -18.111  11.132 -18.639
   40   1HH1  ARG   5          1HH2      ARG   5 -19.143  12.740 -20.872
   41   2HH1  ARG   5          2HH2      ARG   5 -20.815  12.948 -20.470
   42   1HH2  ARG   5          1HH1      ARG   5 -20.398  12.071 -17.141
   43   2HH2  ARG   5          2HH1      ARG   5 -21.525  12.569 -18.358
   44    H    THR   6           H        THR   6 -14.133  14.210 -13.836
   45    HA   THR   6           HA       THR   6 -13.485  11.290 -13.592
   46    HB   THR   6           HB       THR   6 -11.595  11.991 -12.301
   47    HG1  THR   6           HG1      THR   6 -13.165  14.230 -11.968
   48   1HG2  THR   6          1HG2      THR   6 -10.389  13.060 -13.956
   49   2HG2  THR   6          2HG2      THR   6 -11.677  14.219 -14.290
   50   3HG2  THR   6          3HG2      THR   6 -11.802  12.565 -14.888
   51    HA   PRO   7           HA       PRO   7 -16.181  12.842  -9.943
   52   1HB   PRO   7          2HB       PRO   7 -18.739  12.434 -10.812
   53   2HB   PRO   7          1HB       PRO   7 -17.900  13.988 -10.996
   54   1HG   PRO   7          2HG       PRO   7 -18.374  11.846 -13.002
   55   2HG   PRO   7          1HG       PRO   7 -18.387  13.604 -13.201
   56   1HD   PRO   7          2HD       PRO   7 -16.295  11.996 -13.945
   57   2HD   PRO   7          1HD       PRO   7 -16.136  13.714 -13.522
   58    HA   PRO   8           HA       PRO   8 -16.931   8.632  -8.835
   59   1HB   PRO   8          2HB       PRO   8 -19.085   8.784  -7.161
   60   2HB   PRO   8          1HB       PRO   8 -17.470   9.357  -6.701
   61   1HG   PRO   8          2HG       PRO   8 -19.839  10.906  -7.609
   62   2HG   PRO   8          1HG       PRO   8 -18.629  11.309  -6.382
   63   1HD   PRO   8          2HD       PRO   8 -18.640  12.355  -8.909
   64   2HD   PRO   8          1HD       PRO   8 -17.176  12.181  -7.914
   65    H    ASN   9           H        ASN   9 -19.362   7.330  -8.294
   66    HA   ASN   9           HA       ASN   9 -21.414   7.757 -10.270
   67   1HB   ASN   9          2HB       ASN   9 -20.774   6.192 -11.944
   68   2HB   ASN   9          1HB       ASN   9 -19.330   7.158 -11.635
   69   1HD2  ASN   9          1HD2      ASN   9 -20.883   4.086 -10.548
   70   2HD2  ASN   9          2HD2      ASN   9 -19.419   3.267 -10.288
   71    H    CYS  10           H        CYS  10 -22.974   6.004 -10.285
   72    HA   CYS  10           HA       CYS  10 -23.175   4.650  -7.704
   73   1HB   CYS  10          2HB       CYS  10 -25.130   5.587  -8.857
   74   2HB   CYS  10          1HB       CYS  10 -24.796   4.622 -10.259
   75    H    ALA  11           H        ALA  11 -22.709   2.463  -7.305
   76    HA   ALA  11           HA       ALA  11 -21.340   1.024  -9.448
   77   1HB   ALA  11          1HB       ALA  11 -21.964   0.078  -6.652
   78   2HB   ALA  11          2HB       ALA  11 -20.623   1.164  -7.016
   79   3HB   ALA  11          3HB       ALA  11 -20.650  -0.462  -7.698
   80    H    ARG  12           H        ARG  12 -24.456   0.948  -7.923
   81    HA   ARG  12           HA       ARG  12 -25.284  -1.713  -8.537
   82   1HB   ARG  12          2HB       ARG  12 -26.413   0.020  -7.128
   83   2HB   ARG  12          1HB       ARG  12 -26.811   0.904  -8.588
   84   1HG   ARG  12          2HG       ARG  12 -28.664  -0.333  -8.768
   85   2HG   ARG  12          1HG       ARG  12 -27.639  -1.736  -9.066
   86   1HD   ARG  12          2HD       ARG  12 -29.136  -2.205  -7.169
   87   2HD   ARG  12          1HD       ARG  12 -27.470  -2.065  -6.572
   88    HE   ARG  12           HE       ARG  12 -28.371   0.528  -6.435
   89   1HH1  ARG  12          1HH2      ARG  12 -28.658  -2.326  -4.685
   90   2HH1  ARG  12          2HH2      ARG  12 -29.906  -1.759  -3.627
   91   1HH2  ARG  12          1HH1      ARG  12 -30.394   1.205  -5.363
   92   2HH2  ARG  12          2HH1      ARG  12 -30.886   0.246  -4.007
   93    H    CYS  13           H        CYS  13 -25.576   1.281 -10.400
   94    HA   CYS  13           HA       CYS  13 -26.632  -0.182 -12.703
   95   1HB   CYS  13          2HB       CYS  13 -26.704   2.131 -13.665
   96   2HB   CYS  13          1HB       CYS  13 -27.434   2.038 -12.082
   97    H    ARG  14           H        ARG  14 -23.332   0.802 -11.727
   98    HA   ARG  14           HA       ARG  14 -22.294   0.829 -14.455
   99   1HB   ARG  14          2HB       ARG  14 -20.093   0.404 -13.286
  100   2HB   ARG  14          1HB       ARG  14 -20.985   1.788 -12.660
  101   1HG   ARG  14          2HG       ARG  14 -20.200   0.535 -10.769
  102   2HG   ARG  14          1HG       ARG  14 -21.924   0.276 -10.901
  103   1HD   ARG  14          2HD       ARG  14 -21.636  -1.949 -11.063
  104   2HD   ARG  14          1HD       ARG  14 -20.489  -1.743 -12.401
  105    HE   ARG  14           HE       ARG  14 -19.774  -2.006  -9.576
  106   1HH1  ARG  14          1HH2      ARG  14 -18.662  -2.189 -12.706
  107   2HH1  ARG  14          2HH2      ARG  14 -17.074  -1.580 -12.379
  108   1HH2  ARG  14          1HH1      ARG  14 -17.822  -0.619  -9.133
  109   2HH2  ARG  14          2HH1      ARG  14 -16.599  -0.688 -10.357
  110    H    ASN  15           H        ASN  15 -23.107  -1.663 -12.199
  111    HA   ASN  15           HA       ASN  15 -21.607  -3.864 -12.890
  112   1HB   ASN  15          2HB       ASN  15 -24.539  -3.442 -12.337
  113   2HB   ASN  15          1HB       ASN  15 -23.860  -5.058 -12.465
  114   1HD2  ASN  15          1HD2      ASN  15 -24.668  -2.791 -10.257
  115   2HD2  ASN  15          2HD2      ASN  15 -23.491  -3.048  -9.069
  116    H    HIS  16           H        HIS  16 -24.198  -2.363 -14.649
  117    HA   HIS  16           HA       HIS  16 -24.031  -4.359 -16.841
  118   1HB   HIS  16          2HB       HIS  16 -25.933  -2.108 -16.136
  119   2HB   HIS  16          1HB       HIS  16 -26.180  -3.274 -17.418
  120    HD1  HIS  16           HD1      HIS  16 -27.028  -5.579 -16.813
  121    HD2  HIS  16           HD2      HIS  16 -25.863  -3.320 -13.513
  122    HE1  HIS  16           HE1      HIS  16 -27.696  -6.917 -14.754
  123    H    GLY  17           H        GLY  17 -22.953  -1.182 -16.040
  124   1HA   GLY  17          2HA       GLY  17 -21.216  -0.296 -17.634
  125   2HA   GLY  17          1HA       GLY  17 -22.337  -0.704 -18.934
  126    H    LEU  18           H        LEU  18 -23.492   0.630 -15.935
  127    HA   LEU  18           HA       LEU  18 -24.427   3.034 -17.419
  128   1HB   LEU  18          2HB       LEU  18 -25.617   1.237 -15.723
  129   2HB   LEU  18          1HB       LEU  18 -25.212   2.549 -14.615
  130    HG   LEU  18           HG       LEU  18 -27.455   2.874 -15.578
  131   1HD1  LEU  18          1HD1      LEU  18 -27.137   5.116 -15.732
  132   2HD1  LEU  18          2HD1      LEU  18 -25.957   4.954 -17.033
  133   3HD1  LEU  18          3HD1      LEU  18 -25.460   4.727 -15.357
  134   1HD2  LEU  18          1HD2      LEU  18 -26.737   3.610 -18.248
  135   2HD2  LEU  18          2HD2      LEU  18 -27.836   2.331 -17.732
  136   3HD2  LEU  18          3HD2      LEU  18 -26.120   1.986 -17.949
  137    H    LYS  19           H        LYS  19 -24.038   5.151 -16.519
  138    HA   LYS  19           HA       LYS  19 -22.139   5.395 -14.259
  139   1HB   LYS  19          2HB       LYS  19 -21.230   5.269 -16.849
  140   2HB   LYS  19          1HB       LYS  19 -21.456   7.006 -16.646
  141   1HG   LYS  19          2HG       LYS  19 -19.187   6.398 -15.967
  142   2HG   LYS  19          1HG       LYS  19 -20.108   6.910 -14.554
  143   1HD   LYS  19          2HD       LYS  19 -19.639   4.940 -13.575
  144   2HD   LYS  19          1HD       LYS  19 -20.560   4.126 -14.840
  145   1HE   LYS  19          2HE       LYS  19 -18.247   4.592 -16.189
  146   2HE   LYS  19          1HE       LYS  19 -17.620   4.400 -14.540
  147   1HZ   LYS  19          1HZ       LYS  19 -19.445   2.476 -14.589
  148   2HZ   LYS  19          2HZ       LYS  19 -17.826   2.218 -15.034
  149   3HZ   LYS  19          3HZ       LYS  19 -19.008   2.475 -16.227
  150    H    ILE  20           H        ILE  20 -23.936   6.383 -13.226
  151    HA   ILE  20           HA       ILE  20 -25.054   8.849 -14.448
  152    HB   ILE  20           HB       ILE  20 -26.957   8.233 -13.364
  153   1HG1  ILE  20          2HG1      ILE  20 -25.690   8.847 -11.150
  154   2HG1  ILE  20          1HG1      ILE  20 -27.222   8.021 -11.142
  155   1HG2  ILE  20          1HG2      ILE  20 -25.532   5.673 -12.750
  156   2HG2  ILE  20          2HG2      ILE  20 -26.131   6.115 -14.342
  157   3HG2  ILE  20          3HG2      ILE  20 -27.259   5.907 -13.008
  158   1HD1  ILE  20          1HD1      ILE  20 -24.548   6.658 -11.058
  159   2HD1  ILE  20          2HD1      ILE  20 -26.123   5.869 -10.979
  160   3HD1  ILE  20          3HD1      ILE  20 -25.603   6.935  -9.684
  161    H    THR  21           H        THR  21 -22.563   8.043 -12.362
  162    HA   THR  21           HA       THR  21 -21.141   9.512 -11.129
  163    HB   THR  21           HB       THR  21 -23.316  11.587 -11.181
  164    HG1  THR  21           HG1      THR  21 -23.284  11.509 -13.262
  165   1HG2  THR  21          1HG2      THR  21 -20.983  12.825 -11.782
  166   2HG2  THR  21          2HG2      THR  21 -20.372  11.457 -10.852
  167   3HG2  THR  21          3HG2      THR  21 -21.538  12.564 -10.129
  168    H    LEU  22           H        LEU  22 -24.113   8.342 -10.336
  169    HA   LEU  22           HA       LEU  22 -25.254   7.881  -8.314
  170   1HB   LEU  22          2HB       LEU  22 -23.347   6.661  -7.763
  171   2HB   LEU  22          1HB       LEU  22 -22.326   8.093  -7.684
  172    HG   LEU  22           HG       LEU  22 -23.369   8.783  -5.597
  173   1HD1  LEU  22          1HD1      LEU  22 -25.583   7.464  -6.486
  174   2HD1  LEU  22          2HD1      LEU  22 -25.346   7.950  -4.807
  175   3HD1  LEU  22          3HD1      LEU  22 -24.966   6.303  -5.310
  176   1HD2  LEU  22          1HD2      LEU  22 -21.854   7.416  -4.642
  177   2HD2  LEU  22          2HD2      LEU  22 -22.004   6.259  -5.964
  178   3HD2  LEU  22          3HD2      LEU  22 -23.094   6.163  -4.581
  179    H    LYS  23           H        LYS  23 -24.564  10.887  -9.131
  180    HA   LYS  23           HA       LYS  23 -24.719  12.233  -6.524
  181   1HB   LYS  23          2HB       LYS  23 -24.563  12.933  -9.425
  182   2HB   LYS  23          1HB       LYS  23 -25.258  14.146  -8.349
  183   1HG   LYS  23          2HG       LYS  23 -22.990  13.187  -6.996
  184   2HG   LYS  23          1HG       LYS  23 -22.480  13.371  -8.675
  185   1HD   LYS  23          2HD       LYS  23 -24.040  15.543  -7.280
  186   2HD   LYS  23          1HD       LYS  23 -22.285  15.440  -7.128
  187   1HE   LYS  23          2HE       LYS  23 -22.571  15.167  -9.835
  188   2HE   LYS  23          1HE       LYS  23 -23.917  16.260  -9.456
  189   1HZ   LYS  23          1HZ       LYS  23 -21.048  16.664  -9.108
  190   2HZ   LYS  23          2HZ       LYS  23 -22.056  17.274  -7.885
  191   3HZ   LYS  23          3HZ       LYS  23 -22.261  17.787  -9.490
  192    H    GLY  24           H        GLY  24 -26.685  12.219  -5.431
  193   1HA   GLY  24          2HA       GLY  24 -29.026  12.060  -5.113
  194   2HA   GLY  24          1HA       GLY  24 -29.107  13.233  -6.437
  195    H    HIS  25           H        HIS  25 -28.276   9.782  -6.078
  196    HA   HIS  25           HA       HIS  25 -29.934   9.220  -8.516
  197   1HB   HIS  25          2HB       HIS  25 -27.540   9.183  -8.903
  198   2HB   HIS  25          1HB       HIS  25 -27.293   8.141  -7.507
  199    HD1  HIS  25           HD1      HIS  25 -29.409   7.976 -10.693
  200    HD2  HIS  25           HD2      HIS  25 -26.924   5.563  -8.383
  201    HE1  HIS  25           HE1      HIS  25 -29.055   5.822 -11.967
  202    H    LYS  26           H        LYS  26 -28.339   6.606  -6.946
  203    HA   LYS  26           HA       LYS  26 -29.248   4.671  -5.971
  204   1HB   LYS  26          2HB       LYS  26 -30.097   7.102  -4.482
  205   2HB   LYS  26          1HB       LYS  26 -30.961   5.620  -4.072
  206   1HG   LYS  26          2HG       LYS  26 -28.747   4.486  -3.750
  207   2HG   LYS  26          1HG       LYS  26 -27.961   6.046  -4.000
  208   1HD   LYS  26          2HD       LYS  26 -29.620   6.861  -2.128
  209   2HD   LYS  26          1HD       LYS  26 -29.695   5.147  -1.719
  210   1HE   LYS  26          2HE       LYS  26 -27.361   5.042  -1.251
  211   2HE   LYS  26          1HE       LYS  26 -27.055   6.598  -2.050
  212   1HZ   LYS  26          1HZ       LYS  26 -27.259   6.658   0.460
  213   2HZ   LYS  26          2HZ       LYS  26 -28.912   6.334   0.243
  214   3HZ   LYS  26          3HZ       LYS  26 -28.231   7.752  -0.397
  215    H    ARG  27           H        ARG  27 -32.218   6.387  -5.267
  216    HA   ARG  27           HA       ARG  27 -33.974   4.483  -6.342
  217   1HB   ARG  27          2HB       ARG  27 -34.515   6.409  -4.845
  218   2HB   ARG  27          1HB       ARG  27 -34.312   7.498  -6.218
  219   1HG   ARG  27          2HG       ARG  27 -36.341   6.973  -7.074
  220   2HG   ARG  27          1HG       ARG  27 -36.100   5.248  -6.796
  221   1HD   ARG  27          2HD       ARG  27 -36.645   7.090  -4.469
  222   2HD   ARG  27          1HD       ARG  27 -37.981   6.437  -5.440
  223    HE   ARG  27           HE       ARG  27 -36.351   4.237  -4.932
  224   1HH1  ARG  27          1HH2      ARG  27 -38.759   6.116  -3.483
  225   2HH1  ARG  27          2HH2      ARG  27 -38.686   5.320  -1.947
  226   1HH2  ARG  27          1HH1      ARG  27 -35.905   3.417  -2.768
  227   2HH2  ARG  27          2HH1      ARG  27 -37.069   3.791  -1.541
  228    H    TYR  28           H        TYR  28 -32.141   6.979  -7.978
  229    HA   TYR  28           HA       TYR  28 -33.665   6.790 -10.489
  230   1HB   TYR  28          2HB       TYR  28 -31.118   8.153  -9.568
  231   2HB   TYR  28          1HB       TYR  28 -31.722   8.284 -11.222
  232    HD1  TYR  28           HD1      TYR  28 -32.578   8.939  -7.660
  233    HD2  TYR  28           HD2      TYR  28 -33.550   9.710 -11.771
  234    HE1  TYR  28           HE1      TYR  28 -34.153  10.718  -6.952
  235    HE2  TYR  28           HE2      TYR  28 -35.127  11.490 -11.064
  236    HH   TYR  28           HH       TYR  28 -35.254  13.053  -8.842
  237    H    CYS  29           H        CYS  29 -31.791   4.585  -9.064
  238    HA   CYS  29           HA       CYS  29 -29.894   3.999 -11.231
  239   1HB   CYS  29          2HB       CYS  29 -29.604   3.628  -8.705
  240   2HB   CYS  29          1HB       CYS  29 -30.692   2.260  -8.891
  241    H    LYS  30           H        LYS  30 -30.747   3.081 -13.112
  242    HA   LYS  30           HA       LYS  30 -33.198   1.672 -13.344
  243   1HB   LYS  30          2HB       LYS  30 -31.226   2.487 -15.015
  244   2HB   LYS  30          1HB       LYS  30 -30.836   0.769 -14.931
  245   1HG   LYS  30          2HG       LYS  30 -33.460   0.519 -15.310
  246   2HG   LYS  30          1HG       LYS  30 -33.263   2.108 -16.050
  247   1HD   LYS  30          2HD       LYS  30 -31.613  -0.334 -16.766
  248   2HD   LYS  30          1HD       LYS  30 -33.000   0.244 -17.691
  249   1HE   LYS  30          2HE       LYS  30 -30.846   2.226 -17.067
  250   2HE   LYS  30          1HE       LYS  30 -30.523   1.016 -18.326
  251   1HZ   LYS  30          1HZ       LYS  30 -33.105   2.441 -18.239
  252   2HZ   LYS  30          2HZ       LYS  30 -32.355   1.671 -19.555
  253   3HZ   LYS  30          3HZ       LYS  30 -31.762   3.159 -18.987
  254    H    PHE  31           H        PHE  31 -30.150   0.809 -11.995
  255    HA   PHE  31           HA       PHE  31 -30.831  -2.084 -11.756
  256   1HB   PHE  31          2HB       PHE  31 -28.306  -0.461 -11.226
  257   2HB   PHE  31          1HB       PHE  31 -28.372  -2.226 -11.299
  258    HD1  PHE  31           HD1      PHE  31 -28.706   0.906 -13.238
  259    HD2  PHE  31           HD2      PHE  31 -28.603  -3.382 -13.412
  260    HE1  PHE  31           HE1      PHE  31 -28.509   1.015 -15.700
  261    HE2  PHE  31           HE2      PHE  31 -28.417  -3.277 -15.878
  262    HZ   PHE  31           HZ       PHE  31 -28.364  -1.078 -17.029
  263    H    ARG  32           H        ARG  32 -31.659   0.562 -10.142
  264    HA   ARG  32           HA       ARG  32 -30.728   0.541  -7.525
  265   1HB   ARG  32          2HB       ARG  32 -32.735   1.703  -7.013
  266   2HB   ARG  32          1HB       ARG  32 -32.466   2.032  -8.718
  267   1HG   ARG  32          2HG       ARG  32 -34.192  -0.271  -7.814
  268   2HG   ARG  32          1HG       ARG  32 -34.844   1.347  -8.016
  269   1HD   ARG  32          2HD       ARG  32 -34.228   1.378 -10.362
  270   2HD   ARG  32          1HD       ARG  32 -33.367  -0.164 -10.197
  271    HE   ARG  32           HE       ARG  32 -36.192  -0.200  -9.367
  272   1HH1  ARG  32          1HH2      ARG  32 -34.126  -2.326 -10.507
  273   2HH1  ARG  32          2HH2      ARG  32 -34.959  -2.753 -11.964
  274   1HH2  ARG  32          1HH1      ARG  32 -37.149  -0.069 -11.812
  275   2HH2  ARG  32          2HH1      ARG  32 -36.671  -1.477 -12.702
  276    H    TYR  33           H        TYR  33 -32.932  -1.703  -9.062
  277    HA   TYR  33           HA       TYR  33 -33.031  -3.271  -6.499
  278   1HB   TYR  33          2HB       TYR  33 -35.085  -2.914  -8.701
  279   2HB   TYR  33          1HB       TYR  33 -35.268  -4.040  -7.357
  280    HD1  TYR  33           HD1      TYR  33 -36.927  -1.465  -8.180
  281    HD2  TYR  33           HD2      TYR  33 -33.900  -2.267  -5.238
  282    HE1  TYR  33           HE1      TYR  33 -37.801   0.380  -6.775
  283    HE2  TYR  33           HE2      TYR  33 -34.775  -0.424  -3.835
  284    HH   TYR  33           HH       TYR  33 -36.908   0.804  -3.533
  285    H    CYS  34           H        CYS  34 -31.678  -3.272  -9.524
  286    HA   CYS  34           HA       CYS  34 -32.145  -5.725 -10.746
  287   1HB   CYS  34          2HB       CYS  34 -30.489  -3.964 -11.445
  288   2HB   CYS  34          1HB       CYS  34 -29.448  -4.493 -10.119
  289    H    THR  35           H        THR  35 -30.737  -7.768 -10.522
  290    HA   THR  35           HA       THR  35 -29.968  -8.291  -7.680
  291    HB   THR  35           HB       THR  35 -31.177 -10.535  -8.050
  292    HG1  THR  35           HG1      THR  35 -32.974  -9.994  -9.662
  293   1HG2  THR  35          1HG2      THR  35 -33.189  -8.347  -8.207
  294   2HG2  THR  35          2HG2      THR  35 -31.996  -8.246  -6.913
  295   3HG2  THR  35          3HG2      THR  35 -33.043  -9.660  -7.039
  296    H    CYS  36           H        CYS  36 -29.001  -8.370 -10.886
  297    HA   CYS  36           HA       CYS  36 -27.794 -10.826 -11.378
  298   1HB   CYS  36          2HB       CYS  36 -26.287  -9.597 -12.770
  299   2HB   CYS  36          1HB       CYS  36 -27.784  -8.667 -12.737
  300    H    GLU  37           H        GLU  37 -25.366 -11.387 -11.015
  301    HA   GLU  37           HA       GLU  37 -24.819 -11.284  -8.152
  302   1HB   GLU  37          2HB       GLU  37 -24.279 -12.953 -10.281
  303   2HB   GLU  37          1HB       GLU  37 -22.703 -12.229  -9.960
  304   1HG   GLU  37          2HG       GLU  37 -22.495 -13.259  -7.937
  305   2HG   GLU  37          1HG       GLU  37 -24.208 -13.074  -7.557
  306    H    LYS  38           H        LYS  38 -24.290  -8.970 -10.451
  307    HA   LYS  38           HA       LYS  38 -21.640  -8.123  -9.349
  308   1HB   LYS  38          2HB       LYS  38 -23.273  -7.551 -11.821
  309   2HB   LYS  38          1HB       LYS  38 -21.996  -6.437 -11.333
  310   1HG   LYS  38          2HG       LYS  38 -21.192  -9.267 -11.273
  311   2HG   LYS  38          1HG       LYS  38 -21.607  -8.676 -12.883
  312   1HD   LYS  38          2HD       LYS  38 -19.987  -6.772 -11.352
  313   2HD   LYS  38          1HD       LYS  38 -19.167  -8.309 -11.626
  314   1HE   LYS  38          2HE       LYS  38 -20.398  -7.716 -14.083
  315   2HE   LYS  38          1HE       LYS  38 -19.705  -6.179 -13.527
  316   1HZ   LYS  38          1HZ       LYS  38 -18.171  -7.834 -14.736
  317   2HZ   LYS  38          2HZ       LYS  38 -18.185  -8.696 -13.272
  318   3HZ   LYS  38          3HZ       LYS  38 -17.604  -7.100 -13.316
  319    H    CYS  39           H        CYS  39 -25.005  -7.517  -9.294
  320    HA   CYS  39           HA       CYS  39 -24.784  -4.756  -8.271
  321   1HB   CYS  39          2HB       CYS  39 -26.828  -6.665  -9.268
  322   2HB   CYS  39          1HB       CYS  39 -27.378  -5.585  -8.000
  323    H    ARG  40           H        ARG  40 -25.672  -8.051  -7.259
  324    HA   ARG  40           HA       ARG  40 -26.177  -7.376  -4.481
  325   1HB   ARG  40          2HB       ARG  40 -25.653  -9.888  -6.084
  326   2HB   ARG  40          1HB       ARG  40 -25.848  -9.953  -4.333
  327   1HG   ARG  40          2HG       ARG  40 -28.060  -8.873  -4.538
  328   2HG   ARG  40          1HG       ARG  40 -27.868  -8.820  -6.291
  329   1HD   ARG  40          2HD       ARG  40 -28.126 -11.128  -6.526
  330   2HD   ARG  40          1HD       ARG  40 -27.576 -11.457  -4.871
  331    HE   ARG  40           HE       ARG  40 -29.914  -9.870  -4.675
  332   1HH1  ARG  40          1HH2      ARG  40 -29.167 -12.761  -6.347
  333   2HH1  ARG  40          2HH2      ARG  40 -30.566 -13.617  -5.790
  334   1HH2  ARG  40          1HH1      ARG  40 -31.627 -11.058  -3.703
  335   2HH2  ARG  40          2HH1      ARG  40 -31.960 -12.652  -4.294
  336    H    LEU  41           H        LEU  41 -23.477  -8.556  -6.398
  337    HA   LEU  41           HA       LEU  41 -21.584  -9.049  -4.330
  338   1HB   LEU  41          2HB       LEU  41 -20.940  -9.817  -6.430
  339   2HB   LEU  41          1HB       LEU  41 -21.609  -8.409  -7.251
  340    HG   LEU  41           HG       LEU  41 -19.740  -7.056  -6.688
  341   1HD1  LEU  41          1HD1      LEU  41 -17.988  -8.740  -5.241
  342   2HD1  LEU  41          2HD1      LEU  41 -19.560  -8.877  -4.450
  343   3HD1  LEU  41          3HD1      LEU  41 -18.808  -7.294  -4.651
  344   1HD2  LEU  41          1HD2      LEU  41 -19.109  -8.430  -8.507
  345   2HD2  LEU  41          2HD2      LEU  41 -18.974  -9.863  -7.489
  346   3HD2  LEU  41          3HD2      LEU  41 -17.765  -8.585  -7.375
  347    H    THR  42           H        THR  42 -22.570  -6.122  -6.018
  348    HA   THR  42           HA       THR  42 -20.576  -4.358  -4.902
  349    HB   THR  42           HB       THR  42 -23.314  -4.031  -6.126
  350    HG1  THR  42           HG1      THR  42 -20.651  -3.917  -6.961
  351   1HG2  THR  42          1HG2      THR  42 -22.829  -1.614  -6.252
  352   2HG2  THR  42          2HG2      THR  42 -21.343  -1.868  -5.335
  353   3HG2  THR  42          3HG2      THR  42 -22.908  -2.160  -4.577
  354    H    ALA  43           H        ALA  43 -24.055  -4.174  -4.291
  355    HA   ALA  43           HA       ALA  43 -24.077  -2.793  -1.889
  356   1HB   ALA  43          1HB       ALA  43 -26.244  -3.266  -2.380
  357   2HB   ALA  43          2HB       ALA  43 -25.997  -4.831  -1.604
  358   3HB   ALA  43          3HB       ALA  43 -25.772  -4.665  -3.345
  359    H    ASP  44           H        ASP  44 -23.271  -6.171  -2.452
  360    HA   ASP  44           HA       ASP  44 -23.117  -6.930   0.356
  361   1HB   ASP  44          2HB       ASP  44 -23.557  -8.463  -1.560
  362   2HB   ASP  44          1HB       ASP  44 -21.932  -8.140  -2.167
  363    H    ARG  45           H        ARG  45 -20.849  -5.831  -2.141
  364    HA   ARG  45           HA       ARG  45 -18.383  -6.253  -0.817
  365   1HB   ARG  45          2HB       ARG  45 -18.776  -5.514  -3.177
  366   2HB   ARG  45          1HB       ARG  45 -19.262  -3.931  -2.571
  367   1HG   ARG  45          2HG       ARG  45 -17.120  -3.282  -2.291
  368   2HG   ARG  45          1HG       ARG  45 -16.707  -4.777  -1.450
  369   1HD   ARG  45          2HD       ARG  45 -16.055  -5.859  -3.405
  370   2HD   ARG  45          1HD       ARG  45 -17.115  -4.866  -4.427
  371    HE   ARG  45           HE       ARG  45 -14.411  -4.198  -3.753
  372   1HH1  ARG  45          1HH2      ARG  45 -17.532  -2.989  -4.496
  373   2HH1  ARG  45          2HH2      ARG  45 -17.023  -1.337  -4.605
  374   1HH2  ARG  45          1HH1      ARG  45 -13.753  -2.008  -3.665
  375   2HH2  ARG  45          2HH1      ARG  45 -14.883  -0.781  -4.133
  376    H    GLN  46           H        GLN  46 -20.963  -4.063  -0.097
  377    HA   GLN  46           HA       GLN  46 -19.212  -2.605   1.859
  378   1HB   GLN  46          2HB       GLN  46 -21.037  -1.769  -0.229
  379   2HB   GLN  46          1HB       GLN  46 -21.577  -1.151   1.332
  380   1HG   GLN  46          2HG       GLN  46 -20.086   0.514   0.648
  381   2HG   GLN  46          1HG       GLN  46 -19.054  -0.509   1.650
  382   1HE2  GLN  46          1HE2      GLN  46 -19.876   0.269  -1.733
  383   2HE2  GLN  46          2HE2      GLN  46 -18.468  -0.399  -2.402
  384    H    ARG  47           H        ARG  47 -22.655  -3.465   1.295
  385    HA   ARG  47           HA       ARG  47 -23.360  -3.294   4.098
  386   1HB   ARG  47          2HB       ARG  47 -24.681  -4.645   1.720
  387   2HB   ARG  47          1HB       ARG  47 -25.472  -4.301   3.259
  388   1HG   ARG  47          2HG       ARG  47 -24.640  -1.842   2.797
  389   2HG   ARG  47          1HG       ARG  47 -24.578  -2.394   1.123
  390   1HD   ARG  47          2HD       ARG  47 -26.889  -2.736   1.007
  391   2HD   ARG  47          1HD       ARG  47 -27.047  -2.927   2.764
  392    HE   ARG  47           HE       ARG  47 -26.247  -0.404   2.748
  393   1HH1  ARG  47          1HH2      ARG  47 -26.871  -0.823  -0.349
  394   2HH1  ARG  47          2HH2      ARG  47 -28.343   0.084  -0.445
  395   1HH2  ARG  47          1HH1      ARG  47 -28.761   0.268   2.993
  396   2HH2  ARG  47          2HH1      ARG  47 -29.414   0.703   1.450
  397    H    VAL  48           H        VAL  48 -23.521  -4.970   5.615
  398    HA   VAL  48           HA       VAL  48 -22.703  -7.712   4.726
  399    HB   VAL  48           HB       VAL  48 -21.762  -6.362   7.265
  400   1HG1  VAL  48          1HG1      VAL  48 -21.356  -8.650   7.462
  401   2HG1  VAL  48          2HG1      VAL  48 -19.857  -8.098   6.717
  402   3HG1  VAL  48          3HG1      VAL  48 -21.105  -8.856   5.729
  403   1HG2  VAL  48          1HG2      VAL  48 -19.572  -6.335   5.660
  404   2HG2  VAL  48          2HG2      VAL  48 -20.652  -4.952   5.841
  405   3HG2  VAL  48          3HG2      VAL  48 -20.834  -6.038   4.463
  406    H    MET  49           H        MET  49 -25.025  -8.210   4.929
  407    HA   MET  49           HA       MET  49 -25.780  -8.824   7.738
  408   1HB   MET  49          2HB       MET  49 -27.037  -6.844   5.887
  409   2HB   MET  49          1HB       MET  49 -28.118  -7.807   6.897
  410   1HG   MET  49          2HG       MET  49 -25.820  -6.798   8.392
  411   2HG   MET  49          1HG       MET  49 -26.780  -5.497   7.684
  412   1HE   MET  49          1HE       MET  49 -26.748  -6.003  11.140
  413   2HE   MET  49          2HE       MET  49 -28.242  -5.085  10.976
  414   3HE   MET  49          3HE       MET  49 -26.892  -4.757   9.893
  415    H    ALA  50           H        ALA  50 -27.338 -10.538   7.857
  416    HA   ALA  50           HA       ALA  50 -28.198 -11.758   5.267
  417   1HB   ALA  50          1HB       ALA  50 -26.166 -12.669   7.122
  418   2HB   ALA  50          2HB       ALA  50 -26.606 -13.336   5.549
  419   3HB   ALA  50          3HB       ALA  50 -27.463 -13.858   6.999
  420    H    LEU  51           H        LEU  51 -29.808 -13.617   5.775
  421    HA   LEU  51           HA       LEU  51 -31.751 -12.618   7.773
  422   1HB   LEU  51          2HB       LEU  51 -32.009 -14.959   5.872
  423   2HB   LEU  51          1HB       LEU  51 -33.298 -13.960   6.543
  424    HG   LEU  51           HG       LEU  51 -31.593 -12.149   5.250
  425   1HD1  LEU  51          1HD1      LEU  51 -31.915 -13.380   2.878
  426   2HD1  LEU  51          2HD1      LEU  51 -31.675 -14.800   3.896
  427   3HD1  LEU  51          3HD1      LEU  51 -30.441 -13.541   3.832
  428   1HD2  LEU  51          1HD2      LEU  51 -34.013 -11.954   5.332
  429   2HD2  LEU  51          2HD2      LEU  51 -34.204 -13.440   4.400
  430   3HD2  LEU  51          3HD2      LEU  51 -33.521 -12.003   3.639
  431    H    GLN  52           H        GLN  52 -32.642 -14.033   9.414
  432    HA   GLN  52           HA       GLN  52 -30.684 -15.937  10.514
  433   1HB   GLN  52          2HB       GLN  52 -32.378 -14.128  11.582
  434   2HB   GLN  52          1HB       GLN  52 -33.404 -15.558  11.672
  435   1HG   GLN  52          2HG       GLN  52 -32.302 -16.032  13.591
  436   2HG   GLN  52          1HG       GLN  52 -30.957 -16.506  12.551
  437   1HE2  GLN  52          1HE2      GLN  52 -29.221 -14.906  12.204
  438   2HE2  GLN  52          2HE2      GLN  52 -29.023 -13.600  13.268
  Start of MODEL   13
    1   1H    SER   1          1H        SER   1 -15.249  -3.452 -14.774
    2   2H    SER   1          2H        SER   1 -13.776  -3.406 -13.926
    3   3H    SER   1          3H        SER   1 -14.542  -1.961 -14.383
    4    HA   SER   1           HA       SER   1 -16.286  -2.261 -12.828
    5   1HB   SER   1          2HB       SER   1 -16.558  -4.414 -11.707
    6   2HB   SER   1          1HB       SER   1 -16.456  -4.687 -13.444
    7    HG   SER   1           HG       SER   1 -15.023  -5.857 -11.695
    8    H    ILE   2           H        ILE   2 -13.518  -1.243 -12.808
    9    HA   ILE   2           HA       ILE   2 -13.026  -1.433  -9.864
   10    HB   ILE   2           HB       ILE   2 -11.556  -2.922 -11.372
   11   1HG1  ILE   2          2HG1      ILE   2  -9.460  -2.193 -10.132
   12   2HG1  ILE   2          1HG1      ILE   2 -10.394  -0.830  -9.514
   13   1HG2  ILE   2          1HG2      ILE   2 -11.341  -0.826 -12.987
   14   2HG2  ILE   2          2HG2      ILE   2 -10.003  -1.960 -12.802
   15   3HG2  ILE   2          3HG2      ILE   2  -9.989  -0.428 -11.926
   16   1HD1  ILE   2          1HD1      ILE   2 -10.251  -3.168  -8.201
   17   2HD1  ILE   2          2HD1      ILE   2 -11.617  -3.534  -9.255
   18   3HD1  ILE   2          3HD1      ILE   2 -11.695  -2.156  -8.157
   19    H    SER   3           H        SER   3 -13.095   0.625  -9.058
   20    HA   SER   3           HA       SER   3 -12.322   2.882 -10.880
   21   1HB   SER   3          2HB       SER   3 -14.728   2.392  -9.776
   22   2HB   SER   3          1HB       SER   3 -13.997   3.286  -8.445
   23    HG   SER   3           HG       SER   3 -14.265   4.106 -11.152
   24    HA   PRO   4           HA       PRO   4  -9.315   2.843  -7.379
   25   1HB   PRO   4          2HB       PRO   4  -7.090   3.212  -8.927
   26   2HB   PRO   4          1HB       PRO   4  -7.769   1.612  -8.578
   27   1HG   PRO   4          2HG       PRO   4  -7.975   3.254 -11.036
   28   2HG   PRO   4          1HG       PRO   4  -7.887   1.498 -10.852
   29   1HD   PRO   4          2HD       PRO   4 -10.202   2.913 -11.362
   30   2HD   PRO   4          1HD       PRO   4 -10.140   1.285 -10.654
   31    H    ARG   5           H        ARG   5  -8.554   4.831 -10.267
   32    HA   ARG   5           HA       ARG   5  -8.674   7.257  -8.505
   33   1HB   ARG   5          2HB       ARG   5  -6.870   8.124  -9.924
   34   2HB   ARG   5          1HB       ARG   5  -6.414   6.536  -9.306
   35   1HG   ARG   5          2HG       ARG   5  -7.197   5.506 -11.423
   36   2HG   ARG   5          1HG       ARG   5  -7.587   7.111 -12.043
   37   1HD   ARG   5          2HD       ARG   5  -4.808   6.378 -11.074
   38   2HD   ARG   5          1HD       ARG   5  -5.313   6.216 -12.768
   39    HE   ARG   5           HE       ARG   5  -6.061   8.810 -11.809
   40   1HH1  ARG   5          1HH2      ARG   5  -4.557   8.068 -14.378
   41   2HH1  ARG   5          2HH2      ARG   5  -3.060   8.905 -14.131
   42   1HH2  ARG   5          1HH1      ARG   5  -3.597   9.405 -10.741
   43   2HH2  ARG   5          2HH1      ARG   5  -2.516   9.664 -12.071
   44    H    THR   6           H        THR   6 -10.929   6.138  -9.974
   45    HA   THR   6           HA       THR   6 -11.258   8.039 -12.258
   46    HB   THR   6           HB       THR   6 -13.429   6.311 -12.173
   47    HG1  THR   6           HG1      THR   6 -12.452   5.143 -10.499
   48   1HG2  THR   6          1HG2      THR   6 -12.179   5.080 -13.962
   49   2HG2  THR   6          2HG2      THR   6 -10.740   6.006 -13.533
   50   3HG2  THR   6          3HG2      THR   6 -12.161   6.830 -14.175
   51    HA   PRO   7           HA       PRO   7 -14.368  10.365 -10.211
   52   1HB   PRO   7          2HB       PRO   7 -16.493  10.393 -11.938
   53   2HB   PRO   7          1HB       PRO   7 -14.993  11.295 -12.232
   54   1HG   PRO   7          2HG       PRO   7 -15.892   8.697 -13.372
   55   2HG   PRO   7          1HG       PRO   7 -15.019  10.031 -14.145
   56   1HD   PRO   7          2HD       PRO   7 -13.816   7.735 -13.297
   57   2HD   PRO   7          1HD       PRO   7 -12.980   9.299 -13.404
   58    HA   PRO   8           HA       PRO   8 -17.139   7.742  -8.048
   59   1HB   PRO   8          2HB       PRO   8 -19.103   9.489  -7.292
   60   2HB   PRO   8          1HB       PRO   8 -17.478   9.491  -6.578
   61   1HG   PRO   8          2HG       PRO   8 -18.641  11.286  -8.643
   62   2HG   PRO   8          1HG       PRO   8 -17.519  11.655  -7.324
   63   1HD   PRO   8          2HD       PRO   8 -16.763  11.347  -9.940
   64   2HD   PRO   8          1HD       PRO   8 -15.685  11.082  -8.552
   65    H    ASN   9           H        ASN   9 -19.338   6.800  -8.093
   66    HA   ASN   9           HA       ASN   9 -21.366   7.536  -9.993
   67   1HB   ASN   9          2HB       ASN   9 -20.884   6.002 -11.775
   68   2HB   ASN   9          1HB       ASN   9 -19.388   6.884 -11.465
   69   1HD2  ASN   9          1HD2      ASN   9 -17.561   5.606 -11.091
   70   2HD2  ASN   9          2HD2      ASN   9 -17.599   3.965 -10.660
   71    H    CYS  10           H        CYS  10 -23.050   5.882 -10.118
   72    HA   CYS  10           HA       CYS  10 -23.380   4.428  -7.626
   73   1HB   CYS  10          2HB       CYS  10 -25.258   5.448  -8.839
   74   2HB   CYS  10          1HB       CYS  10 -24.889   4.510 -10.253
   75    H    ALA  11           H        ALA  11 -22.684   2.314  -7.254
   76    HA   ALA  11           HA       ALA  11 -21.500   0.822  -9.488
   77   1HB   ALA  11          1HB       ALA  11 -20.763  -0.690  -7.757
   78   2HB   ALA  11          2HB       ALA  11 -21.913  -0.003  -6.611
   79   3HB   ALA  11          3HB       ALA  11 -20.545   0.958  -7.171
   80    H    ARG  12           H        ARG  12 -24.650   1.034  -8.193
   81    HA   ARG  12           HA       ARG  12 -25.394  -1.767  -8.559
   82   1HB   ARG  12          2HB       ARG  12 -26.634  -0.016  -7.230
   83   2HB   ARG  12          1HB       ARG  12 -27.021   0.801  -8.736
   84   1HG   ARG  12          2HG       ARG  12 -28.665  -0.648  -9.231
   85   2HG   ARG  12          1HG       ARG  12 -27.668  -2.042  -8.817
   86   1HD   ARG  12          2HD       ARG  12 -29.230  -0.293  -6.882
   87   2HD   ARG  12          1HD       ARG  12 -29.518  -2.006  -7.245
   88    HE   ARG  12           HE       ARG  12 -26.827  -1.836  -6.467
   89   1HH1  ARG  12          1HH2      ARG  12 -29.350  -3.186  -5.131
   90   2HH1  ARG  12          2HH2      ARG  12 -29.140  -2.616  -3.508
   91   1HH2  ARG  12          1HH1      ARG  12 -26.797  -0.209  -4.375
   92   2HH2  ARG  12          2HH1      ARG  12 -27.695  -0.928  -3.080
   93    H    CYS  13           H        CYS  13 -25.698   1.168 -10.465
   94    HA   CYS  13           HA       CYS  13 -26.571  -0.327 -12.835
   95   1HB   CYS  13          2HB       CYS  13 -26.773   1.995 -13.720
   96   2HB   CYS  13          1HB       CYS  13 -27.484   1.867 -12.132
   97    H    ARG  14           H        ARG  14 -23.510   0.385 -11.448
   98    HA   ARG  14           HA       ARG  14 -22.033   0.860 -13.929
   99   1HB   ARG  14          2HB       ARG  14 -20.376   1.273 -12.426
  100   2HB   ARG  14          1HB       ARG  14 -21.620   1.085 -11.207
  101   1HG   ARG  14          2HG       ARG  14 -19.625  -1.006 -12.143
  102   2HG   ARG  14          1HG       ARG  14 -19.773  -0.314 -10.534
  103   1HD   ARG  14          2HD       ARG  14 -22.282  -1.422 -11.067
  104   2HD   ARG  14          1HD       ARG  14 -21.120  -2.612 -11.661
  105    HE   ARG  14           HE       ARG  14 -21.499  -1.943  -8.882
  106   1HH1  ARG  14          1HH2      ARG  14 -20.232  -4.421 -10.233
  107   2HH1  ARG  14          2HH2      ARG  14 -18.627  -4.341  -9.588
  108   1HH2  ARG  14          1HH1      ARG  14 -18.948  -1.066  -8.492
  109   2HH2  ARG  14          2HH1      ARG  14 -17.900  -2.439  -8.600
  110    H    ASN  15           H        ASN  15 -23.419  -1.862 -12.458
  111    HA   ASN  15           HA       ASN  15 -21.566  -3.909 -13.191
  112   1HB   ASN  15          2HB       ASN  15 -24.477  -3.685 -12.473
  113   2HB   ASN  15          1HB       ASN  15 -23.740  -5.249 -12.772
  114   1HD2  ASN  15          1HD2      ASN  15 -24.288  -2.864 -10.466
  115   2HD2  ASN  15          2HD2      ASN  15 -23.097  -3.266  -9.336
  116    H    HIS  16           H        HIS  16 -24.299  -2.413 -14.754
  117    HA   HIS  16           HA       HIS  16 -24.179  -4.293 -17.039
  118   1HB   HIS  16          2HB       HIS  16 -26.079  -2.085 -16.205
  119   2HB   HIS  16          1HB       HIS  16 -26.369  -3.260 -17.469
  120    HD1  HIS  16           HD1      HIS  16 -27.212  -5.549 -16.810
  121    HD2  HIS  16           HD2      HIS  16 -25.791  -3.325 -13.589
  122    HE1  HIS  16           HE1      HIS  16 -27.749  -6.893 -14.715
  123    H    GLY  17           H        GLY  17 -23.039  -1.168 -16.167
  124   1HA   GLY  17          2HA       GLY  17 -21.408  -0.220 -17.828
  125   2HA   GLY  17          1HA       GLY  17 -22.606  -0.574 -19.072
  126    H    LEU  18           H        LEU  18 -23.470   0.702 -15.930
  127    HA   LEU  18           HA       LEU  18 -24.468   3.157 -17.302
  128   1HB   LEU  18          2HB       LEU  18 -25.645   1.311 -15.653
  129   2HB   LEU  18          1HB       LEU  18 -25.185   2.565 -14.503
  130    HG   LEU  18           HG       LEU  18 -27.415   3.047 -15.320
  131   1HD1  LEU  18          1HD1      LEU  18 -27.036   5.273 -15.690
  132   2HD1  LEU  18          2HD1      LEU  18 -25.829   4.968 -16.939
  133   3HD1  LEU  18          3HD1      LEU  18 -25.398   4.813 -15.236
  134   1HD2  LEU  18          1HD2      LEU  18 -26.693   1.785 -17.596
  135   2HD2  LEU  18          2HD2      LEU  18 -26.489   3.456 -18.121
  136   3HD2  LEU  18          3HD2      LEU  18 -28.054   2.903 -17.524
  137    H    LYS  19           H        LYS  19 -23.969   5.217 -16.389
  138    HA   LYS  19           HA       LYS  19 -22.040   5.370 -14.144
  139   1HB   LYS  19          2HB       LYS  19 -21.180   5.257 -16.755
  140   2HB   LYS  19          1HB       LYS  19 -21.336   6.998 -16.511
  141   1HG   LYS  19          2HG       LYS  19 -19.072   6.169 -15.900
  142   2HG   LYS  19          1HG       LYS  19 -19.914   6.873 -14.520
  143   1HD   LYS  19          2HD       LYS  19 -19.963   4.901 -13.408
  144   2HD   LYS  19          1HD       LYS  19 -20.460   4.011 -14.849
  145   1HE   LYS  19          2HE       LYS  19 -18.157   3.912 -15.649
  146   2HE   LYS  19          1HE       LYS  19 -17.616   4.940 -14.308
  147   1HZ   LYS  19          1HZ       LYS  19 -19.111   2.424 -13.864
  148   2HZ   LYS  19          2HZ       LYS  19 -18.219   3.327 -12.735
  149   3HZ   LYS  19          3HZ       LYS  19 -17.418   2.453 -13.954
  150    H    ILE  20           H        ILE  20 -23.824   6.395 -13.091
  151    HA   ILE  20           HA       ILE  20 -24.811   8.949 -14.256
  152    HB   ILE  20           HB       ILE  20 -26.779   8.372 -13.258
  153   1HG1  ILE  20          2HG1      ILE  20 -25.542   8.816 -10.979
  154   2HG1  ILE  20          1HG1      ILE  20 -27.121   8.090 -11.059
  155   1HG2  ILE  20          1HG2      ILE  20 -26.036   6.276 -14.318
  156   2HG2  ILE  20          2HG2      ILE  20 -27.181   6.041 -13.003
  157   3HG2  ILE  20          3HG2      ILE  20 -25.467   5.731 -12.745
  158   1HD1  ILE  20          1HD1      ILE  20 -25.636   6.823  -9.613
  159   2HD1  ILE  20          2HD1      ILE  20 -24.537   6.568 -10.957
  160   3HD1  ILE  20          3HD1      ILE  20 -26.151   5.864 -10.988
  161    H    THR  21           H        THR  21 -22.440   7.929 -12.112
  162    HA   THR  21           HA       THR  21 -21.001   9.266 -10.738
  163    HB   THR  21           HB       THR  21 -23.060  11.457 -10.840
  164    HG1  THR  21           HG1      THR  21 -22.390  11.999 -12.857
  165   1HG2  THR  21          1HG2      THR  21 -21.144  12.892 -10.691
  166   2HG2  THR  21          2HG2      THR  21 -20.044  11.557 -11.037
  167   3HG2  THR  21          3HG2      THR  21 -20.912  11.609  -9.502
  168    H    LEU  22           H        LEU  22 -24.036   8.191 -10.152
  169    HA   LEU  22           HA       LEU  22 -25.348   7.758  -8.227
  170   1HB   LEU  22          2HB       LEU  22 -23.459   6.450  -7.660
  171   2HB   LEU  22          1HB       LEU  22 -22.482   7.867  -7.286
  172    HG   LEU  22           HG       LEU  22 -23.736   8.309  -5.290
  173   1HD1  LEU  22          1HD1      LEU  22 -25.956   7.708  -6.367
  174   2HD1  LEU  22          2HD1      LEU  22 -25.767   7.145  -4.707
  175   3HD1  LEU  22          3HD1      LEU  22 -25.570   6.017  -6.050
  176   1HD2  LEU  22          1HD2      LEU  22 -22.236   6.682  -4.633
  177   2HD2  LEU  22          2HD2      LEU  22 -22.856   5.498  -5.783
  178   3HD2  LEU  22          3HD2      LEU  22 -23.738   5.824  -4.291
  179    H    LYS  23           H        LYS  23 -24.509  10.721  -8.930
  180    HA   LYS  23           HA       LYS  23 -24.713  12.034  -6.306
  181   1HB   LYS  23          2HB       LYS  23 -23.390  13.083  -8.026
  182   2HB   LYS  23          1HB       LYS  23 -24.693  12.927  -9.205
  183   1HG   LYS  23          2HG       LYS  23 -26.074  14.399  -7.596
  184   2HG   LYS  23          1HG       LYS  23 -24.531  14.780  -6.830
  185   1HD   LYS  23          2HD       LYS  23 -24.628  14.984  -9.796
  186   2HD   LYS  23          1HD       LYS  23 -25.509  16.215  -8.889
  187   1HE   LYS  23          2HE       LYS  23 -23.568  17.263  -8.383
  188   2HE   LYS  23          1HE       LYS  23 -22.927  15.774  -7.661
  189   1HZ   LYS  23          1HZ       LYS  23 -23.091  16.170 -10.592
  190   2HZ   LYS  23          2HZ       LYS  23 -22.203  14.999  -9.741
  191   3HZ   LYS  23          3HZ       LYS  23 -21.723  16.627  -9.701
  192    H    GLY  24           H        GLY  24 -26.754  11.910  -5.328
  193   1HA   GLY  24          2HA       GLY  24 -29.111  11.893  -5.154
  194   2HA   GLY  24          1HA       GLY  24 -29.066  13.113  -6.436
  195    H    HIS  25           H        HIS  25 -28.556   9.606  -6.045
  196    HA   HIS  25           HA       HIS  25 -30.016   9.182  -8.632
  197   1HB   HIS  25          2HB       HIS  25 -27.605   9.117  -8.911
  198   2HB   HIS  25          1HB       HIS  25 -27.439   8.027  -7.542
  199    HD1  HIS  25           HD1      HIS  25 -29.371   8.007 -10.848
  200    HD2  HIS  25           HD2      HIS  25 -27.081   5.475  -8.468
  201    HE1  HIS  25           HE1      HIS  25 -28.996   5.874 -12.156
  202    H    LYS  26           H        LYS  26 -28.533   6.487  -7.081
  203    HA   LYS  26           HA       LYS  26 -29.527   4.524  -6.248
  204   1HB   LYS  26          2HB       LYS  26 -29.305   5.969  -4.280
  205   2HB   LYS  26          1HB       LYS  26 -30.842   6.750  -4.652
  206   1HG   LYS  26          2HG       LYS  26 -32.095   4.878  -4.047
  207   2HG   LYS  26          1HG       LYS  26 -30.748   3.768  -4.306
  208   1HD   LYS  26          2HD       LYS  26 -30.712   5.867  -2.130
  209   2HD   LYS  26          1HD       LYS  26 -31.355   4.245  -1.866
  210   1HE   LYS  26          2HE       LYS  26 -29.223   3.229  -2.371
  211   2HE   LYS  26          1HE       LYS  26 -28.560   4.779  -2.925
  212   1HZ   LYS  26          1HZ       LYS  26 -28.054   4.136  -0.540
  213   2HZ   LYS  26          2HZ       LYS  26 -29.696   4.426  -0.212
  214   3HZ   LYS  26          3HZ       LYS  26 -28.704   5.684  -0.779
  215    H    ARG  27           H        ARG  27 -32.453   6.289  -5.474
  216    HA   ARG  27           HA       ARG  27 -34.255   4.498  -6.646
  217   1HB   ARG  27          2HB       ARG  27 -34.303   6.958  -5.332
  218   2HB   ARG  27          1HB       ARG  27 -35.067   7.304  -6.884
  219   1HG   ARG  27          2HG       ARG  27 -36.828   6.588  -5.431
  220   2HG   ARG  27          1HG       ARG  27 -36.492   5.224  -6.499
  221   1HD   ARG  27          2HD       ARG  27 -36.137   3.950  -4.659
  222   2HD   ARG  27          1HD       ARG  27 -34.730   4.964  -4.283
  223    HE   ARG  27           HE       ARG  27 -37.345   5.161  -3.015
  224   1HH1  ARG  27          1HH2      ARG  27 -34.170   6.183  -2.942
  225   2HH1  ARG  27          2HH2      ARG  27 -34.492   7.744  -2.263
  226   1HH2  ARG  27          1HH1      ARG  27 -37.933   7.473  -2.596
  227   2HH2  ARG  27          2HH1      ARG  27 -36.622   8.471  -2.061
  228    H    TYR  28           H        TYR  28 -32.331   7.006  -8.150
  229    HA   TYR  28           HA       TYR  28 -33.768   6.907 -10.717
  230   1HB   TYR  28          2HB       TYR  28 -31.216   8.202  -9.700
  231   2HB   TYR  28          1HB       TYR  28 -31.843   8.439 -11.335
  232    HD1  TYR  28           HD1      TYR  28 -31.623  10.145  -8.447
  233    HD2  TYR  28           HD2      TYR  28 -34.692   8.645 -11.051
  234    HE1  TYR  28           HE1      TYR  28 -33.183  11.885  -7.613
  235    HE2  TYR  28           HE2      TYR  28 -36.251  10.384 -10.219
  236    HH   TYR  28           HH       TYR  28 -35.177  13.014  -8.231
  237    H    CYS  29           H        CYS  29 -31.988   4.650  -9.288
  238    HA   CYS  29           HA       CYS  29 -30.008   4.094 -11.394
  239   1HB   CYS  29          2HB       CYS  29 -29.771   3.698  -8.883
  240   2HB   CYS  29          1HB       CYS  29 -30.913   2.372  -9.077
  241    H    LYS  30           H        LYS  30 -30.716   3.118 -13.287
  242    HA   LYS  30           HA       LYS  30 -33.198   1.810 -13.690
  243   1HB   LYS  30          2HB       LYS  30 -31.216   2.531 -15.285
  244   2HB   LYS  30          1HB       LYS  30 -30.650   0.884 -15.005
  245   1HG   LYS  30          2HG       LYS  30 -33.442   0.736 -15.529
  246   2HG   LYS  30          1HG       LYS  30 -32.730   1.771 -16.767
  247   1HD   LYS  30          2HD       LYS  30 -31.700  -0.978 -16.002
  248   2HD   LYS  30          1HD       LYS  30 -32.680  -0.624 -17.425
  249   1HE   LYS  30          2HE       LYS  30 -30.053   0.794 -16.896
  250   2HE   LYS  30          1HE       LYS  30 -30.154  -0.707 -17.839
  251   1HZ   LYS  30          1HZ       LYS  30 -32.180   0.694 -18.869
  252   2HZ   LYS  30          2HZ       LYS  30 -30.613   0.695 -19.525
  253   3HZ   LYS  30          3HZ       LYS  30 -31.107   1.955 -18.500
  254    H    PHE  31           H        PHE  31 -30.310   0.836 -12.082
  255    HA   PHE  31           HA       PHE  31 -31.203  -2.002 -11.817
  256   1HB   PHE  31          2HB       PHE  31 -28.574  -0.648 -11.109
  257   2HB   PHE  31          1HB       PHE  31 -28.843  -2.383 -11.307
  258    HD1  PHE  31           HD1      PHE  31 -28.745   0.877 -13.079
  259    HD2  PHE  31           HD2      PHE  31 -28.908  -3.393 -13.481
  260    HE1  PHE  31           HE1      PHE  31 -28.310   1.093 -15.503
  261    HE2  PHE  31           HE2      PHE  31 -28.472  -3.180 -15.907
  262    HZ   PHE  31           HZ       PHE  31 -28.168  -0.938 -16.926
  263    H    ARG  32           H        ARG  32 -32.093   0.608 -10.373
  264    HA   ARG  32           HA       ARG  32 -31.250   0.783  -7.723
  265   1HB   ARG  32          2HB       ARG  32 -33.401   1.810  -7.343
  266   2HB   ARG  32          1HB       ARG  32 -32.949   2.173  -9.007
  267   1HG   ARG  32          2HG       ARG  32 -34.523  -0.325  -8.563
  268   2HG   ARG  32          1HG       ARG  32 -35.374   1.202  -8.355
  269   1HD   ARG  32          2HD       ARG  32 -34.590   1.916 -10.618
  270   2HD   ARG  32          1HD       ARG  32 -33.851   0.317 -10.830
  271    HE   ARG  32           HE       ARG  32 -36.774   0.634 -10.259
  272   1HH1  ARG  32          1HH2      ARG  32 -34.657  -1.804 -10.689
  273   2HH1  ARG  32          2HH2      ARG  32 -35.356  -2.458 -12.133
  274   1HH2  ARG  32          1HH1      ARG  32 -37.445   0.257 -12.669
  275   2HH2  ARG  32          2HH1      ARG  32 -36.932  -1.290 -13.255
  276    H    TYR  33           H        TYR  33 -33.019  -1.761  -9.259
  277    HA   TYR  33           HA       TYR  33 -33.257  -3.159  -6.617
  278   1HB   TYR  33          2HB       TYR  33 -35.237  -3.045  -8.913
  279   2HB   TYR  33          1HB       TYR  33 -35.441  -4.009  -7.450
  280    HD1  TYR  33           HD1      TYR  33 -36.938  -1.405  -8.733
  281    HD2  TYR  33           HD2      TYR  33 -34.329  -2.160  -5.406
  282    HE1  TYR  33           HE1      TYR  33 -37.862   0.575  -7.560
  283    HE2  TYR  33           HE2      TYR  33 -35.251  -0.180  -4.232
  284    HH   TYR  33           HH       TYR  33 -37.389   2.070  -5.832
  285    H    CYS  34           H        CYS  34 -31.822  -3.210  -9.612
  286    HA   CYS  34           HA       CYS  34 -32.129  -5.709 -10.770
  287   1HB   CYS  34          2HB       CYS  34 -30.504  -3.887 -11.427
  288   2HB   CYS  34          1HB       CYS  34 -29.490  -4.391 -10.073
  289    H    THR  35           H        THR  35 -30.690  -7.687 -10.448
  290    HA   THR  35           HA       THR  35 -29.905  -8.111  -7.600
  291    HB   THR  35           HB       THR  35 -31.135 -10.415  -8.002
  292    HG1  THR  35           HG1      THR  35 -32.585  -8.685  -9.708
  293   1HG2  THR  35          1HG2      THR  35 -33.015  -8.106  -7.701
  294   2HG2  THR  35          2HG2      THR  35 -31.716  -8.292  -6.522
  295   3HG2  THR  35          3HG2      THR  35 -32.895  -9.584  -6.746
  296    H    CYS  36           H        CYS  36 -28.973  -8.263 -10.787
  297    HA   CYS  36           HA       CYS  36 -27.823 -10.755 -11.256
  298   1HB   CYS  36          2HB       CYS  36 -26.313  -9.576 -12.687
  299   2HB   CYS  36          1HB       CYS  36 -27.793  -8.620 -12.655
  300    H    GLU  37           H        GLU  37 -25.402 -11.352 -10.872
  301    HA   GLU  37           HA       GLU  37 -24.863 -11.172  -8.012
  302   1HB   GLU  37          2HB       GLU  37 -23.154 -12.767  -8.528
  303   2HB   GLU  37          1HB       GLU  37 -24.484 -13.114  -9.635
  304   1HG   GLU  37          2HG       GLU  37 -23.204 -11.383 -11.186
  305   2HG   GLU  37          1HG       GLU  37 -21.821 -11.871 -10.205
  306    H    LYS  38           H        LYS  38 -24.277  -8.948 -10.405
  307    HA   LYS  38           HA       LYS  38 -21.628  -8.096  -9.304
  308   1HB   LYS  38          2HB       LYS  38 -22.593  -8.330 -11.866
  309   2HB   LYS  38          1HB       LYS  38 -22.903  -6.625 -11.536
  310   1HG   LYS  38          2HG       LYS  38 -20.707  -6.623 -12.396
  311   2HG   LYS  38          1HG       LYS  38 -20.463  -6.575 -10.649
  312   1HD   LYS  38          2HD       LYS  38 -20.296  -9.100 -10.697
  313   2HD   LYS  38          1HD       LYS  38 -20.283  -8.996 -12.458
  314   1HE   LYS  38          2HE       LYS  38 -18.364  -7.192 -11.101
  315   2HE   LYS  38          1HE       LYS  38 -18.014  -8.924 -10.945
  316   1HZ   LYS  38          1HZ       LYS  38 -17.881  -9.204 -13.202
  317   2HZ   LYS  38          2HZ       LYS  38 -17.267  -7.625 -13.070
  318   3HZ   LYS  38          3HZ       LYS  38 -18.878  -7.877 -13.549
  319    H    CYS  39           H        CYS  39 -24.980  -7.456  -9.247
  320    HA   CYS  39           HA       CYS  39 -24.722  -4.654  -8.344
  321   1HB   CYS  39          2HB       CYS  39 -26.783  -6.557  -9.284
  322   2HB   CYS  39          1HB       CYS  39 -27.327  -5.472  -8.021
  323    H    ARG  40           H        ARG  40 -25.604  -7.900  -7.180
  324    HA   ARG  40           HA       ARG  40 -26.090  -7.052  -4.435
  325   1HB   ARG  40          2HB       ARG  40 -26.058  -9.510  -6.078
  326   2HB   ARG  40          1HB       ARG  40 -25.587  -9.760  -4.396
  327   1HG   ARG  40          2HG       ARG  40 -27.678  -9.331  -3.616
  328   2HG   ARG  40          1HG       ARG  40 -27.933  -8.010  -4.756
  329   1HD   ARG  40          2HD       ARG  40 -29.051  -9.362  -6.196
  330   2HD   ARG  40          1HD       ARG  40 -27.797 -10.616  -6.092
  331    HE   ARG  40           HE       ARG  40 -28.974 -10.847  -3.653
  332   1HH1  ARG  40          1HH2      ARG  40 -29.567 -12.887  -5.731
  333   2HH1  ARG  40          2HH2      ARG  40 -31.290 -12.785  -5.875
  334   1HH2  ARG  40          1HH1      ARG  40 -31.504  -9.697  -4.313
  335   2HH2  ARG  40          2HH1      ARG  40 -32.387 -10.978  -5.073
  336    H    LEU  41           H        LEU  41 -23.429  -8.282  -6.356
  337    HA   LEU  41           HA       LEU  41 -21.551  -8.779  -4.231
  338   1HB   LEU  41          2HB       LEU  41 -20.978  -9.731  -6.288
  339   2HB   LEU  41          1HB       LEU  41 -21.548  -8.333  -7.195
  340    HG   LEU  41           HG       LEU  41 -19.599  -7.078  -6.707
  341   1HD1  LEU  41          1HD1      LEU  41 -18.010  -8.827  -5.111
  342   2HD1  LEU  41          2HD1      LEU  41 -19.579  -8.676  -4.324
  343   3HD1  LEU  41          3HD1      LEU  41 -18.629  -7.234  -4.679
  344   1HD2  LEU  41          1HD2      LEU  41 -18.160  -9.648  -6.901
  345   2HD2  LEU  41          2HD2      LEU  41 -18.154  -8.270  -8.000
  346   3HD2  LEU  41          3HD2      LEU  41 -19.463  -9.450  -8.073
  347    H    THR  42           H        THR  42 -22.584  -5.972  -6.024
  348    HA   THR  42           HA       THR  42 -20.513  -4.133  -5.258
  349    HB   THR  42           HB       THR  42 -23.384  -3.956  -6.145
  350    HG1  THR  42           HG1      THR  42 -20.895  -3.318  -7.345
  351   1HG2  THR  42          1HG2      THR  42 -23.015  -1.518  -6.448
  352   2HG2  THR  42          2HG2      THR  42 -21.462  -1.672  -5.626
  353   3HG2  THR  42          3HG2      THR  42 -22.959  -1.994  -4.750
  354    H    ALA  43           H        ALA  43 -23.878  -4.248  -4.117
  355    HA   ALA  43           HA       ALA  43 -23.681  -2.610  -1.865
  356   1HB   ALA  43          1HB       ALA  43 -25.520  -4.353  -3.006
  357   2HB   ALA  43          2HB       ALA  43 -25.794  -3.420  -1.535
  358   3HB   ALA  43          3HB       ALA  43 -25.218  -5.085  -1.430
  359    H    ASP  44           H        ASP  44 -22.541  -5.873  -2.362
  360    HA   ASP  44           HA       ASP  44 -21.898  -6.437   0.431
  361   1HB   ASP  44          2HB       ASP  44 -22.458  -8.052  -1.464
  362   2HB   ASP  44          1HB       ASP  44 -20.862  -7.700  -2.124
  363    H    ARG  45           H        ARG  45 -20.307  -5.041  -2.365
  364    HA   ARG  45           HA       ARG  45 -17.606  -5.134  -1.248
  365   1HB   ARG  45          2HB       ARG  45 -18.829  -4.821  -3.728
  366   2HB   ARG  45          1HB       ARG  45 -18.182  -3.216  -3.390
  367   1HG   ARG  45          2HG       ARG  45 -16.638  -5.826  -3.366
  368   2HG   ARG  45          1HG       ARG  45 -16.477  -4.518  -4.539
  369   1HD   ARG  45          2HD       ARG  45 -15.608  -3.012  -2.840
  370   2HD   ARG  45          1HD       ARG  45 -15.929  -4.206  -1.565
  371    HE   ARG  45           HE       ARG  45 -14.368  -5.583  -3.405
  372   1HH1  ARG  45          1HH2      ARG  45 -13.502  -4.794  -0.588
  373   2HH1  ARG  45          2HH2      ARG  45 -12.049  -3.914  -0.923
  374   1HH2  ARG  45          1HH1      ARG  45 -12.746  -3.515  -4.294
  375   2HH2  ARG  45          2HH1      ARG  45 -11.619  -3.192  -3.019
  376    H    GLN  46           H        GLN  46 -20.334  -2.958  -1.129
  377    HA   GLN  46           HA       GLN  46 -18.704  -0.654  -0.245
  378   1HB   GLN  46          2HB       GLN  46 -20.573  -0.248  -1.713
  379   2HB   GLN  46          1HB       GLN  46 -21.656  -1.180  -0.679
  380   1HG   GLN  46          2HG       GLN  46 -20.261   1.027   0.693
  381   2HG   GLN  46          1HG       GLN  46 -21.386   1.543  -0.563
  382   1HE2  GLN  46          1HE2      GLN  46 -21.367   1.158   2.659
  383   2HE2  GLN  46          2HE2      GLN  46 -22.945   0.593   2.925
  384    H    ARG  47           H        ARG  47 -19.411  -3.381   1.301
  385    HA   ARG  47           HA       ARG  47 -20.799  -2.504   3.689
  386   1HB   ARG  47          2HB       ARG  47 -20.097  -4.876   2.531
  387   2HB   ARG  47          1HB       ARG  47 -18.897  -4.772   3.819
  388   1HG   ARG  47          2HG       ARG  47 -20.653  -5.801   4.945
  389   2HG   ARG  47          1HG       ARG  47 -20.985  -4.102   5.290
  390   1HD   ARG  47          2HD       ARG  47 -22.548  -4.033   3.347
  391   2HD   ARG  47          1HD       ARG  47 -22.267  -5.768   3.094
  392    HE   ARG  47           HE       ARG  47 -22.953  -5.237   5.848
  393   1HH1  ARG  47          1HH2      ARG  47 -23.947  -7.476   3.994
  394   2HH1  ARG  47          2HH2      ARG  47 -25.638  -7.108   3.923
  395   1HH2  ARG  47          1HH1      ARG  47 -25.266  -3.906   5.195
  396   2HH2  ARG  47          2HH1      ARG  47 -26.385  -5.088   4.603
  397    H    VAL  48           H        VAL  48 -19.743  -0.670   4.573
  398    HA   VAL  48           HA       VAL  48 -16.844  -0.925   5.234
  399    HB   VAL  48           HB       VAL  48 -17.520   1.072   4.042
  400   1HG1  VAL  48          1HG1      VAL  48 -19.770   1.450   4.283
  401   2HG1  VAL  48          2HG1      VAL  48 -19.210   2.558   5.536
  402   3HG1  VAL  48          3HG1      VAL  48 -19.779   0.947   5.972
  403   1HG2  VAL  48          1HG2      VAL  48 -16.075   2.181   5.368
  404   2HG2  VAL  48          2HG2      VAL  48 -16.469   1.130   6.727
  405   3HG2  VAL  48          3HG2      VAL  48 -17.418   2.588   6.436
  406    H    MET  49           H        MET  49 -18.082  -2.619   6.866
  407    HA   MET  49           HA       MET  49 -19.195  -1.348   9.259
  408   1HB   MET  49          2HB       MET  49 -18.219  -4.178   8.767
  409   2HB   MET  49          1HB       MET  49 -19.341  -3.658  10.024
  410   1HG   MET  49          2HG       MET  49 -20.266  -2.763   7.436
  411   2HG   MET  49          1HG       MET  49 -19.994  -4.505   7.415
  412   1HE   MET  49          1HE       MET  49 -23.057  -1.938   9.245
  413   2HE   MET  49          2HE       MET  49 -23.308  -2.696   7.674
  414   3HE   MET  49          3HE       MET  49 -21.858  -1.737   7.959
  415    H    ALA  50           H        ALA  50 -17.633  -0.070  10.296
  416    HA   ALA  50           HA       ALA  50 -14.866  -0.976  10.627
  417   1HB   ALA  50          1HB       ALA  50 -16.495   1.405  10.961
  418   2HB   ALA  50          2HB       ALA  50 -14.748   1.279  10.757
  419   3HB   ALA  50          3HB       ALA  50 -15.458   1.161  12.366
  420    H    LEU  51           H        LEU  51 -15.571  -3.072  11.735
  421    HA   LEU  51           HA       LEU  51 -15.836  -2.596  14.679
  422   1HB   LEU  51          2HB       LEU  51 -17.865  -3.458  13.056
  423   2HB   LEU  51          1HB       LEU  51 -17.150  -4.994  13.548
  424    HG   LEU  51           HG       LEU  51 -17.415  -3.099  15.768
  425   1HD1  LEU  51          1HD1      LEU  51 -19.890  -4.074  14.309
  426   2HD1  LEU  51          2HD1      LEU  51 -19.417  -2.396  14.570
  427   3HD1  LEU  51          3HD1      LEU  51 -19.894  -3.400  15.939
  428   1HD2  LEU  51          1HD2      LEU  51 -17.386  -5.093  16.817
  429   2HD2  LEU  51          2HD2      LEU  51 -17.390  -5.906  15.252
  430   3HD2  LEU  51          3HD2      LEU  51 -18.915  -5.527  16.053
  431    H    GLN  52           H        GLN  52 -13.418  -2.983  14.448
  432    HA   GLN  52           HA       GLN  52 -12.818  -5.916  14.225
  433   1HB   GLN  52          2HB       GLN  52 -11.921  -4.089  12.551
  434   2HB   GLN  52          1HB       GLN  52 -10.796  -3.721  13.858
  435   1HG   GLN  52          2HG       GLN  52  -9.905  -5.940  13.844
  436   2HG   GLN  52          1HG       GLN  52 -11.204  -6.528  12.805
  437   1HE2  GLN  52          1HE2      GLN  52  -8.519  -6.889  11.993
  438   2HE2  GLN  52          2HE2      GLN  52  -8.199  -5.886  10.663
  Start of MODEL   14
    1   1H    SER   1          1H        SER   1  -3.750  17.905 -18.005
    2   2H    SER   1          2H        SER   1  -4.054  16.709 -19.173
    3   3H    SER   1          3H        SER   1  -4.022  16.301 -17.525
    4    HA   SER   1           HA       SER   1  -6.114  17.052 -17.137
    5   1HB   SER   1          2HB       SER   1  -6.900  19.054 -18.592
    6   2HB   SER   1          1HB       SER   1  -5.597  19.343 -17.443
    7    HG   SER   1           HG       SER   1  -5.581  19.623 -20.090
    8    H    ILE   2           H        ILE   2  -5.396  14.908 -18.908
    9    HA   ILE   2           HA       ILE   2  -7.652  15.049 -20.884
   10    HB   ILE   2           HB       ILE   2  -4.980  13.627 -21.125
   11   1HG1  ILE   2          2HG1      ILE   2  -4.845  16.135 -21.169
   12   2HG1  ILE   2          1HG1      ILE   2  -4.376  15.385 -22.695
   13   1HG2  ILE   2          1HG2      ILE   2  -6.640  12.486 -22.433
   14   2HG2  ILE   2          2HG2      ILE   2  -5.726  13.496 -23.554
   15   3HG2  ILE   2          3HG2      ILE   2  -7.322  14.008 -23.006
   16   1HD1  ILE   2          1HD1      ILE   2  -5.911  17.344 -22.992
   17   2HD1  ILE   2          2HD1      ILE   2  -7.149  16.457 -22.103
   18   3HD1  ILE   2          3HD1      ILE   2  -6.564  15.843 -23.650
   19    H    SER   3           H        SER   3  -5.595  12.863 -18.935
   20    HA   SER   3           HA       SER   3  -7.852  10.889 -18.923
   21   1HB   SER   3          2HB       SER   3  -4.846  10.666 -18.676
   22   2HB   SER   3          1HB       SER   3  -5.920   9.322 -18.293
   23    HG   SER   3           HG       SER   3  -5.728  10.727 -20.757
   24    HA   PRO   4           HA       PRO   4  -7.362  12.594 -14.622
   25   1HB   PRO   4          2HB       PRO   4 -10.017  13.137 -14.234
   26   2HB   PRO   4          1HB       PRO   4  -8.890  14.300 -14.961
   27   1HG   PRO   4          2HG       PRO   4 -10.883  12.523 -16.272
   28   2HG   PRO   4          1HG       PRO   4 -10.415  14.183 -16.669
   29   1HD   PRO   4          2HD       PRO   4  -9.533  11.991 -18.040
   30   2HD   PRO   4          1HD       PRO   4  -8.627  13.516 -17.928
   31    H    ARG   5           H        ARG   5  -9.156  11.857 -12.740
   32    HA   ARG   5           HA       ARG   5  -9.088   8.913 -12.862
   33   1HB   ARG   5          2HB       ARG   5  -8.864  10.924 -10.922
   34   2HB   ARG   5          1HB       ARG   5 -10.400  10.132 -10.565
   35   1HG   ARG   5          2HG       ARG   5  -9.219   8.497  -9.560
   36   2HG   ARG   5          1HG       ARG   5  -8.641   8.033 -11.161
   37   1HD   ARG   5          2HD       ARG   5  -6.825   9.829 -10.864
   38   2HD   ARG   5          1HD       ARG   5  -7.294   9.855  -9.153
   39    HE   ARG   5           HE       ARG   5  -7.033   7.173  -9.624
   40   1HH1  ARG   5          1HH2      ARG   5  -4.998   9.624  -8.787
   41   2HH1  ARG   5          2HH2      ARG   5  -3.538   8.882  -9.349
   42   1HH2  ARG   5          1HH1      ARG   5  -5.170   6.321 -11.024
   43   2HH2  ARG   5          2HH1      ARG   5  -3.635   7.011 -10.617
   44    H    THR   6           H        THR   6 -11.327   8.221 -11.388
   45    HA   THR   6           HA       THR   6 -13.544   8.867 -13.295
   46    HB   THR   6           HB       THR   6 -14.410   6.661 -12.162
   47    HG1  THR   6           HG1      THR   6 -13.003   6.364 -10.551
   48   1HG2  THR   6          1HG2      THR   6 -12.844   5.335 -13.701
   49   2HG2  THR   6          2HG2      THR   6 -12.088   6.883 -14.079
   50   3HG2  THR   6          3HG2      THR   6 -13.791   6.619 -14.456
   51    HA   PRO   7           HA       PRO   7 -15.617  10.834  -9.933
   52   1HB   PRO   7          2HB       PRO   7 -18.136  10.869 -10.994
   53   2HB   PRO   7          1HB       PRO   7 -16.840  11.945 -11.552
   54   1HG   PRO   7          2HG       PRO   7 -17.910   9.471 -12.792
   55   2HG   PRO   7          1HG       PRO   7 -17.298  10.945 -13.554
   56   1HD   PRO   7          2HD       PRO   7 -15.886   8.587 -13.332
   57   2HD   PRO   7          1HD       PRO   7 -15.154  10.189 -13.569
   58    HA   PRO   8           HA       PRO   8 -17.499   7.642  -7.565
   59   1HB   PRO   8          2HB       PRO   8 -19.262   9.057  -6.026
   60   2HB   PRO   8          1HB       PRO   8 -17.505   9.109  -5.780
   61   1HG   PRO   8          2HG       PRO   8 -19.280  11.067  -7.145
   62   2HG   PRO   8          1HG       PRO   8 -17.878  11.350  -6.101
   63   1HD   PRO   8          2HD       PRO   8 -17.795  11.524  -8.825
   64   2HD   PRO   8          1HD       PRO   8 -16.388  11.111  -7.822
   65    H    ASN   9           H        ASN   9 -18.570   7.120  -9.845
   66    HA   ASN   9           HA       ASN   9 -21.356   7.792 -10.267
   67   1HB   ASN   9          2HB       ASN   9 -21.141   6.270 -12.085
   68   2HB   ASN   9          1HB       ASN   9 -19.540   6.985 -11.900
   69   1HD2  ASN   9          1HD2      ASN   9 -17.804   5.615 -11.203
   70   2HD2  ASN   9          2HD2      ASN   9 -17.989   3.943 -10.977
   71    H    CYS  10           H        CYS  10 -22.995   5.929 -10.420
   72    HA   CYS  10           HA       CYS  10 -23.235   4.683  -7.778
   73   1HB   CYS  10          2HB       CYS  10 -25.173   5.646  -8.924
   74   2HB   CYS  10          1HB       CYS  10 -24.867   4.678 -10.330
   75    H    ALA  11           H        ALA  11 -22.848   2.468  -7.350
   76    HA   ALA  11           HA       ALA  11 -21.501   0.988  -9.483
   77   1HB   ALA  11          1HB       ALA  11 -21.905   0.736  -6.542
   78   2HB   ALA  11          2HB       ALA  11 -20.409   0.670  -7.474
   79   3HB   ALA  11          3HB       ALA  11 -21.487  -0.725  -7.436
   80    H    ARG  12           H        ARG  12 -24.599   0.958  -7.902
   81    HA   ARG  12           HA       ARG  12 -25.541  -1.653  -8.500
   82   1HB   ARG  12          2HB       ARG  12 -26.603   0.174  -7.150
   83   2HB   ARG  12          1HB       ARG  12 -26.942   1.036  -8.640
   84   1HG   ARG  12          2HG       ARG  12 -28.864  -0.091  -8.751
   85   2HG   ARG  12          1HG       ARG  12 -27.915  -1.537  -9.092
   86   1HD   ARG  12          2HD       ARG  12 -28.040  -0.822  -6.226
   87   2HD   ARG  12          1HD       ARG  12 -29.595  -1.298  -6.936
   88    HE   ARG  12           HE       ARG  12 -27.790  -3.161  -7.936
   89   1HH1  ARG  12          1HH2      ARG  12 -26.409  -2.612  -5.269
   90   2HH1  ARG  12          2HH2      ARG  12 -27.108  -3.844  -4.272
   91   1HH2  ARG  12          1HH1      ARG  12 -29.716  -4.503  -6.464
   92   2HH2  ARG  12          2HH1      ARG  12 -28.984  -4.916  -4.949
   93    H    CYS  13           H        CYS  13 -25.615   1.302 -10.430
   94    HA   CYS  13           HA       CYS  13 -26.709  -0.175 -12.712
   95   1HB   CYS  13          2HB       CYS  13 -26.754   2.125 -13.703
   96   2HB   CYS  13          1HB       CYS  13 -27.484   2.064 -12.121
   97    H    ARG  14           H        ARG  14 -23.405   0.859 -11.769
   98    HA   ARG  14           HA       ARG  14 -22.334   0.802 -14.462
   99   1HB   ARG  14          2HB       ARG  14 -20.163   0.313 -13.272
  100   2HB   ARG  14          1HB       ARG  14 -21.026   1.710 -12.635
  101   1HG   ARG  14          2HG       ARG  14 -20.313   0.428 -10.745
  102   2HG   ARG  14          1HG       ARG  14 -22.035   0.176 -10.922
  103   1HD   ARG  14          2HD       ARG  14 -21.742  -2.048 -11.091
  104   2HD   ARG  14          1HD       ARG  14 -20.597  -1.828 -12.429
  105    HE   ARG  14           HE       ARG  14 -19.472  -1.125  -9.826
  106   1HH1  ARG  14          1HH2      ARG  14 -20.600  -4.072 -10.222
  107   2HH1  ARG  14          2HH2      ARG  14 -19.102  -4.890 -10.513
  108   1HH2  ARG  14          1HH1      ARG  14 -17.304  -1.972 -11.031
  109   2HH2  ARG  14          2HH1      ARG  14 -17.235  -3.701 -10.972
  110    H    ASN  15           H        ASN  15 -23.231  -1.666 -12.213
  111    HA   ASN  15           HA       ASN  15 -21.796  -3.912 -12.898
  112   1HB   ASN  15          2HB       ASN  15 -24.721  -3.413 -12.360
  113   2HB   ASN  15          1HB       ASN  15 -24.062  -5.041 -12.434
  114   1HD2  ASN  15          1HD2      ASN  15 -24.924  -2.813 -10.252
  115   2HD2  ASN  15          2HD2      ASN  15 -23.734  -3.014  -9.065
  116    H    HIS  16           H        HIS  16 -24.396  -2.387 -14.643
  117    HA   HIS  16           HA       HIS  16 -24.246  -4.399 -16.821
  118   1HB   HIS  16          2HB       HIS  16 -26.159  -2.172 -16.084
  119   2HB   HIS  16          1HB       HIS  16 -26.415  -3.326 -17.374
  120    HD1  HIS  16           HD1      HIS  16 -27.119  -5.703 -16.778
  121    HD2  HIS  16           HD2      HIS  16 -26.114  -3.366 -13.480
  122    HE1  HIS  16           HE1      HIS  16 -27.721  -7.072 -14.717
  123    H    GLY  17           H        GLY  17 -23.053  -1.285 -16.073
  124   1HA   GLY  17          2HA       GLY  17 -21.398  -0.392 -17.723
  125   2HA   GLY  17          1HA       GLY  17 -22.556  -0.806 -18.988
  126    H    LEU  18           H        LEU  18 -23.462   0.609 -15.922
  127    HA   LEU  18           HA       LEU  18 -24.505   2.986 -17.391
  128   1HB   LEU  18          2HB       LEU  18 -25.632   1.181 -15.668
  129   2HB   LEU  18          1HB       LEU  18 -25.185   2.476 -14.559
  130    HG   LEU  18           HG       LEU  18 -27.491   2.723 -15.502
  131   1HD1  LEU  18          1HD1      LEU  18 -27.262   4.969 -15.387
  132   2HD1  LEU  18          2HD1      LEU  18 -26.097   5.007 -16.712
  133   3HD1  LEU  18          3HD1      LEU  18 -25.561   4.624 -15.076
  134   1HD2  LEU  18          1HD2      LEU  18 -27.893   2.918 -17.771
  135   2HD2  LEU  18          2HD2      LEU  18 -26.508   1.827 -17.817
  136   3HD2  LEU  18          3HD2      LEU  18 -26.282   3.552 -18.107
  137    H    LYS  19           H        LYS  19 -24.184   5.110 -16.350
  138    HA   LYS  19           HA       LYS  19 -22.200   5.361 -14.192
  139   1HB   LYS  19          2HB       LYS  19 -21.171   5.028 -16.634
  140   2HB   LYS  19          1HB       LYS  19 -21.550   6.746 -16.770
  141   1HG   LYS  19          2HG       LYS  19 -19.286   6.538 -15.926
  142   2HG   LYS  19          1HG       LYS  19 -20.313   7.123 -14.615
  143   1HD   LYS  19          2HD       LYS  19 -19.314   5.420 -13.456
  144   2HD   LYS  19          1HD       LYS  19 -20.565   4.450 -14.236
  145   1HE   LYS  19          2HE       LYS  19 -18.922   4.082 -16.154
  146   2HE   LYS  19          1HE       LYS  19 -17.679   4.792 -15.103
  147   1HZ   LYS  19          1HZ       LYS  19 -19.475   2.670 -14.110
  148   2HZ   LYS  19          2HZ       LYS  19 -17.956   3.145 -13.514
  149   3HZ   LYS  19          3HZ       LYS  19 -18.066   2.272 -14.967
  150    H    ILE  20           H        ILE  20 -23.835   6.515 -13.137
  151    HA   ILE  20           HA       ILE  20 -24.889   8.968 -14.466
  152    HB   ILE  20           HB       ILE  20 -26.842   8.455 -13.387
  153   1HG1  ILE  20          2HG1      ILE  20 -25.562   8.969 -11.156
  154   2HG1  ILE  20          1HG1      ILE  20 -27.126   8.211 -11.168
  155   1HG2  ILE  20          1HG2      ILE  20 -25.506   5.832 -12.840
  156   2HG2  ILE  20          2HG2      ILE  20 -26.130   6.330 -14.407
  157   3HG2  ILE  20          3HG2      ILE  20 -27.232   6.128 -13.048
  158   1HD1  ILE  20          1HD1      ILE  20 -24.509   6.744 -11.100
  159   2HD1  ILE  20          2HD1      ILE  20 -26.109   6.007 -11.060
  160   3HD1  ILE  20          3HD1      ILE  20 -25.568   7.016  -9.731
  161    H    THR  21           H        THR  21 -22.497   8.084 -12.278
  162    HA   THR  21           HA       THR  21 -21.056   9.518 -11.000
  163    HB   THR  21           HB       THR  21 -23.135  11.679 -11.122
  164    HG1  THR  21           HG1      THR  21 -23.001  11.785 -13.201
  165   1HG2  THR  21          1HG2      THR  21 -20.203  11.414 -10.774
  166   2HG2  THR  21          2HG2      THR  21 -21.318  12.589 -10.076
  167   3HG2  THR  21          3HG2      THR  21 -20.739  12.798 -11.729
  168    H    LEU  22           H        LEU  22 -24.041   8.399 -10.329
  169    HA   LEU  22           HA       LEU  22 -25.347   8.033  -8.392
  170   1HB   LEU  22          2HB       LEU  22 -23.174   6.877  -8.009
  171   2HB   LEU  22          1HB       LEU  22 -22.592   8.309  -7.171
  172    HG   LEU  22           HG       LEU  22 -23.698   6.249  -5.870
  173   1HD1  LEU  22          1HD1      LEU  22 -23.131   7.705  -4.261
  174   2HD1  LEU  22          2HD1      LEU  22 -24.713   8.459  -4.463
  175   3HD1  LEU  22          3HD1      LEU  22 -23.323   9.070  -5.361
  176   1HD2  LEU  22          1HD2      LEU  22 -26.082   8.076  -6.202
  177   2HD2  LEU  22          2HD2      LEU  22 -26.025   6.468  -5.481
  178   3HD2  LEU  22          3HD2      LEU  22 -25.859   6.658  -7.226
  179    H    LYS  23           H        LYS  23 -24.582  10.984  -9.152
  180    HA   LYS  23           HA       LYS  23 -24.690  12.343  -6.556
  181   1HB   LYS  23          2HB       LYS  23 -23.601  13.184  -8.699
  182   2HB   LYS  23          1HB       LYS  23 -25.225  13.410  -9.347
  183   1HG   LYS  23          2HG       LYS  23 -24.753  14.576  -6.664
  184   2HG   LYS  23          1HG       LYS  23 -23.875  15.340  -7.989
  185   1HD   LYS  23          2HD       LYS  23 -25.919  15.749  -9.205
  186   2HD   LYS  23          1HD       LYS  23 -26.853  14.784  -8.061
  187   1HE   LYS  23          2HE       LYS  23 -25.662  16.604  -6.380
  188   2HE   LYS  23          1HE       LYS  23 -25.940  17.583  -7.835
  189   1HZ   LYS  23          1HZ       LYS  23 -28.206  16.346  -7.840
  190   2HZ   LYS  23          2HZ       LYS  23 -27.989  17.688  -6.819
  191   3HZ   LYS  23          3HZ       LYS  23 -27.889  16.113  -6.190
  192    H    GLY  24           H        GLY  24 -26.648  12.177  -5.420
  193   1HA   GLY  24          2HA       GLY  24 -28.986  12.026  -5.079
  194   2HA   GLY  24          1HA       GLY  24 -29.084  13.258  -6.347
  195    H    HIS  25           H        HIS  25 -28.312   9.782  -6.106
  196    HA   HIS  25           HA       HIS  25 -29.961   9.335  -8.573
  197   1HB   HIS  25          2HB       HIS  25 -27.585   9.319  -8.999
  198   2HB   HIS  25          1HB       HIS  25 -27.299   8.254  -7.630
  199    HD1  HIS  25           HD1      HIS  25 -29.363   8.136 -10.857
  200    HD2  HIS  25           HD2      HIS  25 -26.954   5.686  -8.506
  201    HE1  HIS  25           HE1      HIS  25 -29.000   5.975 -12.139
  202    H    LYS  26           H        LYS  26 -28.360   6.650  -7.114
  203    HA   LYS  26           HA       LYS  26 -29.296   4.666  -6.242
  204   1HB   LYS  26          2HB       LYS  26 -30.388   6.961  -4.603
  205   2HB   LYS  26          1HB       LYS  26 -30.661   5.279  -4.143
  206   1HG   LYS  26          2HG       LYS  26 -27.873   6.180  -4.785
  207   2HG   LYS  26          1HG       LYS  26 -28.559   6.569  -3.208
  208   1HD   LYS  26          2HD       LYS  26 -29.054   3.796  -4.000
  209   2HD   LYS  26          1HD       LYS  26 -27.336   4.176  -3.883
  210   1HE   LYS  26          2HE       LYS  26 -29.372   4.794  -1.713
  211   2HE   LYS  26          1HE       LYS  26 -28.265   3.406  -1.696
  212   1HZ   LYS  26          1HZ       LYS  26 -27.708   6.165  -1.157
  213   2HZ   LYS  26          2HZ       LYS  26 -26.675   5.532  -2.348
  214   3HZ   LYS  26          3HZ       LYS  26 -26.770   4.793  -0.821
  215    H    ARG  27           H        ARG  27 -32.200   6.395  -5.343
  216    HA   ARG  27           HA       ARG  27 -34.045   4.602  -6.432
  217   1HB   ARG  27          2HB       ARG  27 -34.181   6.825  -4.967
  218   2HB   ARG  27          1HB       ARG  27 -34.599   7.547  -6.521
  219   1HG   ARG  27          2HG       ARG  27 -36.680   6.705  -6.403
  220   2HG   ARG  27          1HG       ARG  27 -36.041   5.074  -6.188
  221   1HD   ARG  27          2HD       ARG  27 -36.921   5.184  -4.088
  222   2HD   ARG  27          1HD       ARG  27 -35.575   6.280  -3.717
  223    HE   ARG  27           HE       ARG  27 -38.332   7.117  -4.425
  224   1HH1  ARG  27          1HH2      ARG  27 -36.102   8.805  -5.682
  225   2HH1  ARG  27          2HH2      ARG  27 -35.941  10.062  -4.502
  226   1HH2  ARG  27          1HH1      ARG  27 -37.676   8.338  -2.043
  227   2HH2  ARG  27          2HH1      ARG  27 -36.835   9.798  -2.442
  228    H    TYR  28           H        TYR  28 -32.217   7.121  -8.056
  229    HA   TYR  28           HA       TYR  28 -33.789   7.031 -10.537
  230   1HB   TYR  28          2HB       TYR  28 -31.204   8.286  -9.587
  231   2HB   TYR  28          1HB       TYR  28 -31.745   8.434 -11.262
  232    HD1  TYR  28           HD1      TYR  28 -32.727   9.110  -7.732
  233    HD2  TYR  28           HD2      TYR  28 -33.475   9.941 -11.879
  234    HE1  TYR  28           HE1      TYR  28 -34.266  10.945  -7.087
  235    HE2  TYR  28           HE2      TYR  28 -35.014  11.774 -11.235
  236    HH   TYR  28           HH       TYR  28 -35.586  13.156  -9.459
  237    H    CYS  29           H        CYS  29 -31.607   4.932  -9.134
  238    HA   CYS  29           HA       CYS  29 -29.824   4.257 -11.255
  239   1HB   CYS  29          2HB       CYS  29 -29.915   3.589  -8.728
  240   2HB   CYS  29          1HB       CYS  29 -30.965   2.297  -9.282
  241    H    LYS  30           H        LYS  30 -29.912   2.616 -12.793
  242    HA   LYS  30           HA       LYS  30 -32.657   1.765 -13.614
  243   1HB   LYS  30          2HB       LYS  30 -30.095   2.390 -14.885
  244   2HB   LYS  30          1HB       LYS  30 -30.718   0.831 -15.426
  245   1HG   LYS  30          2HG       LYS  30 -32.952   2.528 -15.387
  246   2HG   LYS  30          1HG       LYS  30 -31.653   3.494 -16.089
  247   1HD   LYS  30          2HD       LYS  30 -31.247   1.124 -17.362
  248   2HD   LYS  30          1HD       LYS  30 -32.998   1.082 -17.157
  249   1HE   LYS  30          2HE       LYS  30 -33.026   3.468 -18.104
  250   2HE   LYS  30          1HE       LYS  30 -31.347   3.171 -18.598
  251   1HZ   LYS  30          1HZ       LYS  30 -32.029   1.206 -19.768
  252   2HZ   LYS  30          2HZ       LYS  30 -32.972   2.508 -20.314
  253   3HZ   LYS  30          3HZ       LYS  30 -33.629   1.377 -19.232
  254    H    PHE  31           H        PHE  31 -30.423   0.837 -11.500
  255    HA   PHE  31           HA       PHE  31 -30.916  -2.089 -11.788
  256   1HB   PHE  31          2HB       PHE  31 -28.292  -0.624 -11.279
  257   2HB   PHE  31          1HB       PHE  31 -28.452  -2.383 -11.364
  258    HD1  PHE  31           HD1      PHE  31 -28.634   0.775 -13.262
  259    HD2  PHE  31           HD2      PHE  31 -28.839  -3.503 -13.475
  260    HE1  PHE  31           HE1      PHE  31 -28.505   0.900 -15.722
  261    HE2  PHE  31           HE2      PHE  31 -28.705  -3.387 -15.937
  262    HZ   PHE  31           HZ       PHE  31 -28.533  -1.185 -17.076
  263    H    ARG  32           H        ARG  32 -31.442   0.549 -10.008
  264    HA   ARG  32           HA       ARG  32 -30.461   0.312  -7.428
  265   1HB   ARG  32          2HB       ARG  32 -33.027   1.025  -6.910
  266   2HB   ARG  32          1HB       ARG  32 -31.829   2.134  -7.558
  267   1HG   ARG  32          2HG       ARG  32 -34.079   2.084  -8.758
  268   2HG   ARG  32          1HG       ARG  32 -32.662   1.888  -9.768
  269   1HD   ARG  32          2HD       ARG  32 -33.106  -0.362 -10.206
  270   2HD   ARG  32          1HD       ARG  32 -34.025  -0.562  -8.701
  271    HE   ARG  32           HE       ARG  32 -35.873   0.664  -9.723
  272   1HH1  ARG  32          1HH2      ARG  32 -35.074  -1.486 -11.757
  273   2HH1  ARG  32          2HH2      ARG  32 -35.098  -0.569 -13.226
  274   1HH2  ARG  32          1HH1      ARG  32 -35.084   2.504 -11.622
  275   2HH2  ARG  32          2HH1      ARG  32 -35.102   1.689 -13.150
  276    H    TYR  33           H        TYR  33 -32.631  -1.841  -9.048
  277    HA   TYR  33           HA       TYR  33 -32.974  -3.362  -6.484
  278   1HB   TYR  33          2HB       TYR  33 -34.930  -2.755  -8.715
  279   2HB   TYR  33          1HB       TYR  33 -35.240  -3.963  -7.468
  280    HD1  TYR  33           HD1      TYR  33 -36.397  -0.968  -8.219
  281    HD2  TYR  33           HD2      TYR  33 -34.037  -2.720  -5.085
  282    HE1  TYR  33           HE1      TYR  33 -37.131   0.820  -6.664
  283    HE2  TYR  33           HE2      TYR  33 -34.770  -0.933  -3.532
  284    HH   TYR  33           HH       TYR  33 -35.671   1.661  -4.010
  285    H    CYS  34           H        CYS  34 -31.658  -3.425  -9.555
  286    HA   CYS  34           HA       CYS  34 -32.233  -5.901 -10.705
  287   1HB   CYS  34          2HB       CYS  34 -30.589  -4.174 -11.514
  288   2HB   CYS  34          1HB       CYS  34 -29.506  -4.669 -10.212
  289    H    THR  35           H        THR  35 -30.787  -7.948 -10.464
  290    HA   THR  35           HA       THR  35 -29.934  -8.366  -7.632
  291    HB   THR  35           HB       THR  35 -31.171 -10.647  -7.950
  292    HG1  THR  35           HG1      THR  35 -31.537 -10.163 -10.218
  293   1HG2  THR  35          1HG2      THR  35 -33.170  -9.706  -7.011
  294   2HG2  THR  35          2HG2      THR  35 -32.864  -8.145  -7.771
  295   3HG2  THR  35          3HG2      THR  35 -31.830  -8.703  -6.456
  296    H    CYS  36           H        CYS  36 -28.979  -8.458 -10.778
  297    HA   CYS  36           HA       CYS  36 -27.850 -10.967 -11.287
  298   1HB   CYS  36          2HB       CYS  36 -26.342  -9.762 -12.718
  299   2HB   CYS  36          1HB       CYS  36 -27.856  -8.860 -12.699
  300    H    GLU  37           H        GLU  37 -25.275 -11.326 -11.067
  301    HA   GLU  37           HA       GLU  37 -24.719 -11.312  -8.186
  302   1HB   GLU  37          2HB       GLU  37 -22.802 -12.680  -8.888
  303   2HB   GLU  37          1HB       GLU  37 -24.261 -13.215  -9.722
  304   1HG   GLU  37          2HG       GLU  37 -23.366 -11.318 -11.457
  305   2HG   GLU  37          1HG       GLU  37 -21.836 -11.913 -10.810
  306    H    LYS  38           H        LYS  38 -24.282  -8.978 -10.506
  307    HA   LYS  38           HA       LYS  38 -21.668  -8.013  -9.422
  308   1HB   LYS  38          2HB       LYS  38 -23.080  -7.973 -11.956
  309   2HB   LYS  38          1HB       LYS  38 -22.690  -6.326 -11.458
  310   1HG   LYS  38          2HG       LYS  38 -20.325  -7.228 -10.961
  311   2HG   LYS  38          1HG       LYS  38 -20.803  -8.638 -11.909
  312   1HD   LYS  38          2HD       LYS  38 -20.745  -7.494 -13.878
  313   2HD   LYS  38          1HD       LYS  38 -21.426  -6.034 -13.161
  314   1HE   LYS  38          2HE       LYS  38 -19.367  -5.117 -12.925
  315   2HE   LYS  38          1HE       LYS  38 -18.759  -6.573 -12.111
  316   1HZ   LYS  38          1HZ       LYS  38 -18.411  -7.643 -14.174
  317   2HZ   LYS  38          2HZ       LYS  38 -17.735  -6.093 -14.341
  318   3HZ   LYS  38          3HZ       LYS  38 -19.246  -6.443 -15.033
  319    H    CYS  39           H        CYS  39 -25.057  -7.557  -9.314
  320    HA   CYS  39           HA       CYS  39 -24.955  -4.792  -8.289
  321   1HB   CYS  39          2HB       CYS  39 -26.910  -6.805  -9.252
  322   2HB   CYS  39          1HB       CYS  39 -27.496  -5.769  -7.964
  323    H    ARG  40           H        ARG  40 -25.641  -8.122  -7.242
  324    HA   ARG  40           HA       ARG  40 -26.114  -7.433  -4.456
  325   1HB   ARG  40          2HB       ARG  40 -25.740  -9.872  -6.156
  326   2HB   ARG  40          1HB       ARG  40 -25.540 -10.053  -4.413
  327   1HG   ARG  40          2HG       ARG  40 -27.764  -9.207  -3.999
  328   2HG   ARG  40          1HG       ARG  40 -27.965  -8.771  -5.697
  329   1HD   ARG  40          2HD       ARG  40 -29.124 -10.895  -5.252
  330   2HD   ARG  40          1HD       ARG  40 -27.721 -11.204  -6.294
  331    HE   ARG  40           HE       ARG  40 -26.487 -11.951  -4.288
  332   1HH1  ARG  40          1HH2      ARG  40 -29.724 -12.665  -4.540
  333   2HH1  ARG  40          2HH2      ARG  40 -29.961 -13.073  -2.874
  334   1HH2  ARG  40          1HH1      ARG  40 -26.843 -11.928  -1.877
  335   2HH2  ARG  40          2HH1      ARG  40 -28.328 -12.658  -1.366
  336    H    LEU  41           H        LEU  41 -23.409  -8.363  -6.474
  337    HA   LEU  41           HA       LEU  41 -21.465  -8.838  -4.406
  338   1HB   LEU  41          2HB       LEU  41 -20.869  -9.662  -6.500
  339   2HB   LEU  41          1HB       LEU  41 -21.556  -8.277  -7.345
  340    HG   LEU  41           HG       LEU  41 -19.683  -6.905  -6.834
  341   1HD1  LEU  41          1HD1      LEU  41 -18.640  -7.101  -4.849
  342   2HD1  LEU  41          2HD1      LEU  41 -17.940  -8.631  -5.375
  343   3HD1  LEU  41          3HD1      LEU  41 -19.494  -8.613  -4.541
  344   1HD2  LEU  41          1HD2      LEU  41 -17.871  -8.087  -7.875
  345   2HD2  LEU  41          2HD2      LEU  41 -19.356  -8.742  -8.565
  346   3HD2  LEU  41          3HD2      LEU  41 -18.489  -9.644  -7.322
  347    H    THR  42           H        THR  42 -22.709  -5.996  -6.011
  348    HA   THR  42           HA       THR  42 -20.685  -4.127  -5.123
  349    HB   THR  42           HB       THR  42 -23.518  -3.974  -6.146
  350    HG1  THR  42           HG1      THR  42 -20.958  -3.306  -7.159
  351   1HG2  THR  42          1HG2      THR  42 -23.264  -1.533  -6.264
  352   2HG2  THR  42          2HG2      THR  42 -21.687  -1.650  -5.483
  353   3HG2  THR  42          3HG2      THR  42 -23.146  -2.083  -4.593
  354    H    ALA  43           H        ALA  43 -24.099  -4.305  -4.164
  355    HA   ALA  43           HA       ALA  43 -24.068  -2.813  -1.825
  356   1HB   ALA  43          1HB       ALA  43 -26.182  -3.609  -2.176
  357   2HB   ALA  43          2HB       ALA  43 -25.675  -4.980  -1.189
  358   3HB   ALA  43          3HB       ALA  43 -25.585  -5.078  -2.948
  359    H    ASP  44           H        ASP  44 -22.805  -6.035  -2.384
  360    HA   ASP  44           HA       ASP  44 -22.299  -6.743   0.376
  361   1HB   ASP  44          2HB       ASP  44 -22.456  -8.159  -1.798
  362   2HB   ASP  44          1HB       ASP  44 -20.784  -7.670  -2.073
  363    H    ARG  45           H        ARG  45 -20.378  -5.265  -2.231
  364    HA   ARG  45           HA       ARG  45 -17.861  -5.107  -0.935
  365   1HB   ARG  45          2HB       ARG  45 -19.034  -4.343  -3.319
  366   2HB   ARG  45          1HB       ARG  45 -18.658  -2.790  -2.572
  367   1HG   ARG  45          2HG       ARG  45 -16.380  -3.160  -2.618
  368   2HG   ARG  45          1HG       ARG  45 -16.556  -4.912  -2.497
  369   1HD   ARG  45          2HD       ARG  45 -15.857  -4.569  -4.743
  370   2HD   ARG  45          1HD       ARG  45 -17.618  -4.731  -4.883
  371    HE   ARG  45           HE       ARG  45 -17.725  -2.219  -4.844
  372   1HH1  ARG  45          1HH2      ARG  45 -14.918  -1.690  -3.963
  373   2HH1  ARG  45          2HH2      ARG  45 -14.138  -1.277  -5.453
  374   1HH2  ARG  45          1HH1      ARG  45 -16.650  -2.598  -7.443
  375   2HH2  ARG  45          2HH1      ARG  45 -15.118  -1.789  -7.422
  376    H    GLN  46           H        GLN  46 -20.718  -3.015  -0.697
  377    HA   GLN  46           HA       GLN  46 -19.334  -1.060   1.020
  378   1HB   GLN  46          2HB       GLN  46 -21.084  -0.507  -0.690
  379   2HB   GLN  46          1HB       GLN  46 -22.259  -1.395   0.281
  380   1HG   GLN  46          2HG       GLN  46 -22.259   0.186   1.980
  381   2HG   GLN  46          1HG       GLN  46 -20.630   0.745   1.601
  382   1HE2  GLN  46          1HE2      GLN  46 -23.280   0.334  -0.763
  383   2HE2  GLN  46          2HE2      GLN  46 -23.393   1.979  -1.166
  384    H    ARG  47           H        ARG  47 -21.323  -3.913   1.394
  385    HA   ARG  47           HA       ARG  47 -22.326  -3.420   4.039
  386   1HB   ARG  47          2HB       ARG  47 -23.290  -5.129   2.669
  387   2HB   ARG  47          1HB       ARG  47 -21.722  -5.887   2.393
  388   1HG   ARG  47          2HG       ARG  47 -22.144  -7.234   4.148
  389   2HG   ARG  47          1HG       ARG  47 -22.034  -5.819   5.192
  390   1HD   ARG  47          2HD       ARG  47 -24.607  -5.745   3.964
  391   2HD   ARG  47          1HD       ARG  47 -24.360  -7.385   4.598
  392    HE   ARG  47           HE       ARG  47 -23.621  -6.215   6.760
  393   1HH1  ARG  47          1HH2      ARG  47 -24.685  -3.879   4.641
  394   2HH1  ARG  47          2HH2      ARG  47 -25.891  -3.208   5.686
  395   1HH2  ARG  47          1HH1      ARG  47 -25.627  -5.736   8.047
  396   2HH2  ARG  47          2HH1      ARG  47 -26.426  -4.260   7.617
  397    H    VAL  48           H        VAL  48 -21.327  -3.642   6.015
  398    HA   VAL  48           HA       VAL  48 -18.508  -4.671   6.029
  399    HB   VAL  48           HB       VAL  48 -18.904  -2.227   6.468
  400   1HG1  VAL  48          1HG1      VAL  48 -20.183  -3.126   9.054
  401   2HG1  VAL  48          2HG1      VAL  48 -21.145  -2.726   7.631
  402   3HG1  VAL  48          3HG1      VAL  48 -20.120  -1.500   8.376
  403   1HG2  VAL  48          1HG2      VAL  48 -17.130  -3.849   7.636
  404   2HG2  VAL  48          2HG2      VAL  48 -18.028  -3.384   9.081
  405   3HG2  VAL  48          3HG2      VAL  48 -17.256  -2.149   8.087
  406    H    MET  49           H        MET  49 -18.505  -6.699   6.931
  407    HA   MET  49           HA       MET  49 -20.609  -7.529   8.815
  408   1HB   MET  49          2HB       MET  49 -18.120  -8.922   7.778
  409   2HB   MET  49          1HB       MET  49 -19.479  -9.703   8.587
  410   1HG   MET  49          2HG       MET  49 -19.653  -8.171   5.973
  411   2HG   MET  49          1HG       MET  49 -19.631  -9.929   6.120
  412   1HE   MET  49          1HE       MET  49 -22.436 -11.146   6.090
  413   2HE   MET  49          2HE       MET  49 -21.280 -10.405   4.985
  414   3HE   MET  49          3HE       MET  49 -22.950  -9.838   5.015
  415    H    ALA  50           H        ALA  50 -18.286  -5.494   9.440
  416    HA   ALA  50           HA       ALA  50 -17.346  -6.866  11.941
  417   1HB   ALA  50          1HB       ALA  50 -15.831  -5.991   9.885
  418   2HB   ALA  50          2HB       ALA  50 -15.265  -5.948  11.555
  419   3HB   ALA  50          3HB       ALA  50 -15.934  -4.495  10.813
  420    H    LEU  51           H        LEU  51 -18.181  -5.964  13.783
  421    HA   LEU  51           HA       LEU  51 -19.129  -3.118  13.657
  422   1HB   LEU  51          2HB       LEU  51 -20.507  -5.498  14.163
  423   2HB   LEU  51          1HB       LEU  51 -20.257  -4.797  15.761
  424    HG   LEU  51           HG       LEU  51 -22.368  -4.002  14.716
  425   1HD1  LEU  51          1HD1      LEU  51 -21.474  -1.443  14.699
  426   2HD1  LEU  51          2HD1      LEU  51 -20.115  -2.234  15.498
  427   3HD1  LEU  51          3HD1      LEU  51 -21.737  -2.362  16.181
  428   1HD2  LEU  51          1HD2      LEU  51 -20.881  -2.294  12.798
  429   2HD2  LEU  51          2HD2      LEU  51 -22.450  -3.078  12.622
  430   3HD2  LEU  51          3HD2      LEU  51 -20.970  -4.006  12.383
  431    H    GLN  52           H        GLN  52 -17.223  -2.158  14.522
  432    HA   GLN  52           HA       GLN  52 -16.793  -2.648  17.421
  433   1HB   GLN  52          2HB       GLN  52 -15.250  -3.893  15.498
  434   2HB   GLN  52          1HB       GLN  52 -14.302  -2.450  15.861
  435   1HG   GLN  52          2HG       GLN  52 -15.339  -4.444  17.898
  436   2HG   GLN  52          1HG       GLN  52 -13.667  -4.297  17.359
  437   1HE2  GLN  52          1HE2      GLN  52 -12.528  -2.226  17.906
  438   2HE2  GLN  52          2HE2      GLN  52 -13.047  -1.317  19.242
  Start of MODEL   15
    1   1H    SER   1          1H        SER   1  -5.447   5.316 -17.629
    2   2H    SER   1          2H        SER   1  -7.046   5.040 -17.127
    3   3H    SER   1          3H        SER   1  -5.794   4.029 -16.582
    4    HA   SER   1           HA       SER   1  -6.702   5.897 -15.027
    5   1HB   SER   1          2HB       SER   1  -4.123   6.085 -14.387
    6   2HB   SER   1          1HB       SER   1  -4.981   4.554 -14.232
    7    HG   SER   1           HG       SER   1  -2.999   5.324 -15.980
    8    H    ILE   2           H        ILE   2  -7.401   7.913 -15.860
    9    HA   ILE   2           HA       ILE   2  -5.256   9.690 -16.980
   10    HB   ILE   2           HB       ILE   2  -7.057  10.763 -18.210
   11   1HG1  ILE   2          2HG1      ILE   2  -9.225   8.967 -17.483
   12   2HG1  ILE   2          1HG1      ILE   2  -8.636   9.846 -16.071
   13   1HG2  ILE   2          1HG2      ILE   2  -7.780   7.861 -18.443
   14   2HG2  ILE   2          2HG2      ILE   2  -6.131   8.361 -18.817
   15   3HG2  ILE   2          3HG2      ILE   2  -7.485   9.043 -19.718
   16   1HD1  ILE   2          1HD1      ILE   2  -8.869  11.536 -18.455
   17   2HD1  ILE   2          2HD1      ILE   2  -9.464  11.816 -16.820
   18   3HD1  ILE   2          3HD1      ILE   2 -10.409  10.843 -17.948
   19    H    SER   3           H        SER   3  -7.163   9.130 -14.254
   20    HA   SER   3           HA       SER   3  -6.471  11.760 -13.125
   21   1HB   SER   3          2HB       SER   3  -9.174  10.977 -14.089
   22   2HB   SER   3          1HB       SER   3  -9.111  11.810 -12.539
   23    HG   SER   3           HG       SER   3  -8.797  12.792 -15.021
   24    HA   PRO   4           HA       PRO   4  -6.421   8.691  -9.847
   25   1HB   PRO   4          2HB       PRO   4  -4.830  10.136  -8.160
   26   2HB   PRO   4          1HB       PRO   4  -4.191   9.216  -9.536
   27   1HG   PRO   4          2HG       PRO   4  -4.621  12.129  -9.249
   28   2HG   PRO   4          1HG       PRO   4  -3.384  11.250 -10.158
   29   1HD   PRO   4          2HD       PRO   4  -5.647  12.436 -11.248
   30   2HD   PRO   4          1HD       PRO   4  -4.655  11.191 -12.035
   31    H    ARG   5           H        ARG   5  -8.443   8.718  -8.848
   32    HA   ARG   5           HA       ARG   5  -8.882  10.656  -6.678
   33   1HB   ARG   5          2HB       ARG   5 -10.882  11.612  -7.644
   34   2HB   ARG   5          1HB       ARG   5  -9.598  11.751  -8.846
   35   1HG   ARG   5          2HG       ARG   5 -10.632   9.267  -9.411
   36   2HG   ARG   5          1HG       ARG   5 -12.073  10.162  -8.928
   37   1HD   ARG   5          2HD       ARG   5 -10.632  11.944 -10.565
   38   2HD   ARG   5          1HD       ARG   5 -10.556  10.375 -11.392
   39    HE   ARG   5           HE       ARG   5 -13.099  11.695 -10.523
   40   1HH1  ARG   5          1HH2      ARG   5 -13.260   8.724 -10.828
   41   2HH1  ARG   5          2HH2      ARG   5 -13.741   8.553 -12.483
   42   1HH2  ARG   5          1HH1      ARG   5 -12.871  11.796 -13.349
   43   2HH2  ARG   5          2HH1      ARG   5 -13.518  10.290 -13.911
   44    H    THR   6           H        THR   6 -11.521  10.197  -6.124
   45    HA   THR   6           HA       THR   6 -11.520   7.353  -5.347
   46    HB   THR   6           HB       THR   6 -13.925   8.837  -4.721
   47    HG1  THR   6           HG1      THR   6 -12.885  10.719  -4.887
   48   1HG2  THR   6          1HG2      THR   6 -12.166   8.598  -2.494
   49   2HG2  THR   6          2HG2      THR   6 -11.972   7.151  -3.485
   50   3HG2  THR   6          3HG2      THR   6 -13.568   7.601  -2.884
   51    HA   PRO   7           HA       PRO   7 -14.262   5.962  -8.479
   52   1HB   PRO   7          2HB       PRO   7 -15.751   4.113  -7.119
   53   2HB   PRO   7          1HB       PRO   7 -14.053   3.849  -7.562
   54   1HG   PRO   7          2HG       PRO   7 -15.224   4.641  -4.946
   55   2HG   PRO   7          1HG       PRO   7 -13.860   3.568  -5.295
   56   1HD   PRO   7          2HD       PRO   7 -13.590   6.156  -4.448
   57   2HD   PRO   7          1HD       PRO   7 -12.367   5.292  -5.405
   58    HA   PRO   8           HA       PRO   8 -17.884   8.443  -7.436
   59   1HB   PRO   8          2HB       PRO   8 -18.095   9.588  -9.903
   60   2HB   PRO   8          1HB       PRO   8 -16.949  10.155  -8.676
   61   1HG   PRO   8          2HG       PRO   8 -16.441   8.718 -11.165
   62   2HG   PRO   8          1HG       PRO   8 -15.331   9.651 -10.155
   63   1HD   PRO   8          2HD       PRO   8 -15.659   6.792 -10.287
   64   2HD   PRO   8          1HD       PRO   8 -14.486   7.727  -9.338
   65    H    ASN   9           H        ASN   9 -19.752   8.888  -9.452
   66    HA   ASN   9           HA       ASN   9 -21.605   7.892 -10.483
   67   1HB   ASN   9          2HB       ASN   9 -20.998   6.550 -12.252
   68   2HB   ASN   9          1HB       ASN   9 -19.417   7.199 -11.822
   69   1HD2  ASN   9          1HD2      ASN   9 -21.540   4.368 -11.106
   70   2HD2  ASN   9          2HD2      ASN   9 -20.257   3.275 -10.907
   71    H    CYS  10           H        CYS  10 -23.022   5.975 -10.485
   72    HA   CYS  10           HA       CYS  10 -23.160   4.783  -7.802
   73   1HB   CYS  10          2HB       CYS  10 -25.154   5.659  -8.920
   74   2HB   CYS  10          1HB       CYS  10 -24.841   4.681 -10.317
   75    H    ALA  11           H        ALA  11 -22.724   2.585  -7.344
   76    HA   ALA  11           HA       ALA  11 -21.342   1.094  -9.441
   77   1HB   ALA  11          1HB       ALA  11 -20.481   1.188  -7.149
   78   2HB   ALA  11          2HB       ALA  11 -20.864  -0.477  -7.589
   79   3HB   ALA  11          3HB       ALA  11 -21.964   0.438  -6.559
   80    H    ARG  12           H        ARG  12 -24.463   1.022  -7.910
   81    HA   ARG  12           HA       ARG  12 -25.279  -1.649  -8.499
   82   1HB   ARG  12          2HB       ARG  12 -26.417   0.105  -7.112
   83   2HB   ARG  12          1HB       ARG  12 -26.823   0.959  -8.588
   84   1HG   ARG  12          2HG       ARG  12 -28.588  -0.363  -8.937
   85   2HG   ARG  12          1HG       ARG  12 -27.574  -1.804  -8.838
   86   1HD   ARG  12          2HD       ARG  12 -28.237  -0.437  -6.263
   87   2HD   ARG  12          1HD       ARG  12 -29.527  -1.365  -7.052
   88    HE   ARG  12           HE       ARG  12 -27.264  -2.997  -7.209
   89   1HH1  ARG  12          1HH2      ARG  12 -27.402  -1.222  -4.484
   90   2HH1  ARG  12          2HH2      ARG  12 -27.816  -2.506  -3.398
   91   1HH2  ARG  12          1HH1      ARG  12 -28.535  -4.768  -5.923
   92   2HH2  ARG  12          2HH1      ARG  12 -28.455  -4.512  -4.212
   93    H    CYS  13           H        CYS  13 -25.576   1.326 -10.391
   94    HA   CYS  13           HA       CYS  13 -26.621  -0.174 -12.675
   95   1HB   CYS  13          2HB       CYS  13 -26.737   2.119 -13.664
   96   2HB   CYS  13          1HB       CYS  13 -27.450   2.041 -12.073
   97    H    ARG  14           H        ARG  14 -23.333   0.852 -11.722
   98    HA   ARG  14           HA       ARG  14 -22.307   0.877 -14.454
   99   1HB   ARG  14          2HB       ARG  14 -20.099   0.468 -13.290
  100   2HB   ARG  14          1HB       ARG  14 -20.997   1.853 -12.672
  101   1HG   ARG  14          2HG       ARG  14 -20.199   0.621 -10.772
  102   2HG   ARG  14          1HG       ARG  14 -21.922   0.346 -10.896
  103   1HD   ARG  14          2HD       ARG  14 -21.612  -1.878 -11.031
  104   2HD   ARG  14          1HD       ARG  14 -20.488  -1.675 -12.389
  105    HE   ARG  14           HE       ARG  14 -19.066  -0.814 -10.140
  106   1HH1  ARG  14          1HH2      ARG  14 -18.945  -3.392 -12.035
  107   2HH1  ARG  14          2HH2      ARG  14 -18.670  -4.592 -10.817
  108   1HH2  ARG  14          1HH1      ARG  14 -19.456  -2.474  -8.186
  109   2HH2  ARG  14          2HH1      ARG  14 -18.961  -4.072  -8.635
  110    H    ASN  15           H        ASN  15 -23.070  -1.609 -12.171
  111    HA   ASN  15           HA       ASN  15 -21.561  -3.801 -12.847
  112   1HB   ASN  15          2HB       ASN  15 -24.504  -3.409 -12.318
  113   2HB   ASN  15          1HB       ASN  15 -23.795  -5.015 -12.410
  114   1HD2  ASN  15          1HD2      ASN  15 -24.685  -2.773 -10.224
  115   2HD2  ASN  15          2HD2      ASN  15 -23.494  -2.965  -9.038
  116    H    HIS  16           H        HIS  16 -24.170  -2.344 -14.617
  117    HA   HIS  16           HA       HIS  16 -23.962  -4.341 -16.804
  118   1HB   HIS  16          2HB       HIS  16 -25.905  -2.131 -16.098
  119   2HB   HIS  16          1HB       HIS  16 -26.128  -3.293 -17.387
  120    HD1  HIS  16           HD1      HIS  16 -26.898  -5.636 -16.797
  121    HD2  HIS  16           HD2      HIS  16 -25.847  -3.338 -13.483
  122    HE1  HIS  16           HE1      HIS  16 -27.560  -6.989 -14.746
  123    H    GLY  17           H        GLY  17 -22.944  -1.139 -16.018
  124   1HA   GLY  17          2HA       GLY  17 -21.227  -0.230 -17.622
  125   2HA   GLY  17          1HA       GLY  17 -22.345  -0.663 -18.916
  126    H    LEU  18           H        LEU  18 -23.465   0.691 -15.902
  127    HA   LEU  18           HA       LEU  18 -24.449   3.067 -17.406
  128   1HB   LEU  18          2HB       LEU  18 -25.625   1.259 -15.710
  129   2HB   LEU  18          1HB       LEU  18 -25.243   2.578 -14.605
  130    HG   LEU  18           HG       LEU  18 -27.480   2.891 -15.553
  131   1HD1  LEU  18          1HD1      LEU  18 -25.533   4.770 -15.371
  132   2HD1  LEU  18          2HD1      LEU  18 -27.199   5.134 -15.823
  133   3HD1  LEU  18          3HD1      LEU  18 -25.970   4.932 -17.071
  134   1HD2  LEU  18          1HD2      LEU  18 -26.448   1.736 -17.812
  135   2HD2  LEU  18          2HD2      LEU  18 -26.483   3.436 -18.282
  136   3HD2  LEU  18          3HD2      LEU  18 -27.966   2.633 -17.765
  137    H    LYS  19           H        LYS  19 -24.088   5.187 -16.516
  138    HA   LYS  19           HA       LYS  19 -22.232   5.473 -14.228
  139   1HB   LYS  19          2HB       LYS  19 -21.684   6.175 -17.115
  140   2HB   LYS  19          1HB       LYS  19 -20.879   7.049 -15.812
  141   1HG   LYS  19          2HG       LYS  19 -20.830   4.037 -16.183
  142   2HG   LYS  19          1HG       LYS  19 -19.514   5.135 -16.602
  143   1HD   LYS  19          2HD       LYS  19 -20.241   5.761 -13.940
  144   2HD   LYS  19          1HD       LYS  19 -20.167   4.000 -14.029
  145   1HE   LYS  19          2HE       LYS  19 -17.916   4.329 -13.720
  146   2HE   LYS  19          1HE       LYS  19 -17.922   4.710 -15.453
  147   1HZ   LYS  19          1HZ       LYS  19 -18.653   6.770 -13.476
  148   2HZ   LYS  19          2HZ       LYS  19 -18.053   6.967 -15.053
  149   3HZ   LYS  19          3HZ       LYS  19 -17.018   6.462 -13.804
  150    H    ILE  20           H        ILE  20 -24.078   6.457 -13.266
  151    HA   ILE  20           HA       ILE  20 -25.191   8.887 -14.550
  152    HB   ILE  20           HB       ILE  20 -27.084   8.321 -13.398
  153   1HG1  ILE  20          2HG1      ILE  20 -25.784   8.885 -11.210
  154   2HG1  ILE  20          1HG1      ILE  20 -27.296   8.027 -11.174
  155   1HG2  ILE  20          1HG2      ILE  20 -25.689   5.728 -12.865
  156   2HG2  ILE  20          2HG2      ILE  20 -26.279   6.215 -14.450
  157   3HG2  ILE  20          3HG2      ILE  20 -27.413   5.997 -13.121
  158   1HD1  ILE  20          1HD1      ILE  20 -26.157   5.897 -11.072
  159   2HD1  ILE  20          2HD1      ILE  20 -25.601   6.956  -9.786
  160   3HD1  ILE  20          3HD1      ILE  20 -24.599   6.711 -11.205
  161    H    THR  21           H        THR  21 -22.689   8.176 -12.452
  162    HA   THR  21           HA       THR  21 -21.295   9.691 -11.226
  163    HB   THR  21           HB       THR  21 -23.516  11.717 -11.363
  164    HG1  THR  21           HG1      THR  21 -21.629  11.201 -13.412
  165   1HG2  THR  21          1HG2      THR  21 -21.053  11.823 -10.254
  166   2HG2  THR  21          2HG2      THR  21 -21.861  13.235 -10.936
  167   3HG2  THR  21          3HG2      THR  21 -20.668  12.355 -11.891
  168    H    LEU  22           H        LEU  22 -24.202   8.424 -10.452
  169    HA   LEU  22           HA       LEU  22 -25.429   8.040  -8.464
  170   1HB   LEU  22          2HB       LEU  22 -23.327   6.898  -8.023
  171   2HB   LEU  22          1HB       LEU  22 -22.587   8.404  -7.480
  172    HG   LEU  22           HG       LEU  22 -25.085   7.884  -6.084
  173   1HD1  LEU  22          1HD1      LEU  22 -24.201   5.963  -4.748
  174   2HD1  LEU  22          2HD1      LEU  22 -22.875   5.814  -5.900
  175   3HD1  LEU  22          3HD1      LEU  22 -24.535   5.533  -6.425
  176   1HD2  LEU  22          1HD2      LEU  22 -23.924   8.959  -4.466
  177   2HD2  LEU  22          2HD2      LEU  22 -22.641   9.158  -5.660
  178   3HD2  LEU  22          3HD2      LEU  22 -22.604   7.793  -4.545
  179    H    LYS  23           H        LYS  23 -24.887  10.963  -9.344
  180    HA   LYS  23           HA       LYS  23 -24.852  12.449  -6.819
  181   1HB   LYS  23          2HB       LYS  23 -24.533  12.911  -9.615
  182   2HB   LYS  23          1HB       LYS  23 -25.874  13.923  -9.075
  183   1HG   LYS  23          2HG       LYS  23 -23.827  15.183  -8.796
  184   2HG   LYS  23          1HG       LYS  23 -24.413  14.732  -7.194
  185   1HD   LYS  23          2HD       LYS  23 -22.881  12.719  -7.304
  186   2HD   LYS  23          1HD       LYS  23 -22.188  13.412  -8.770
  187   1HE   LYS  23          2HE       LYS  23 -22.015  15.579  -7.171
  188   2HE   LYS  23          1HE       LYS  23 -21.892  14.302  -5.943
  189   1HZ   LYS  23          1HZ       LYS  23 -20.168  13.242  -7.205
  190   2HZ   LYS  23          2HZ       LYS  23 -19.727  14.864  -6.960
  191   3HZ   LYS  23          3HZ       LYS  23 -20.327  14.363  -8.468
  192    H    GLY  24           H        GLY  24 -26.705  12.244  -5.516
  193   1HA   GLY  24          2HA       GLY  24 -29.001  12.013  -4.975
  194   2HA   GLY  24          1HA       GLY  24 -29.248  13.206  -6.262
  195    H    HIS  25           H        HIS  25 -28.163   9.826  -6.133
  196    HA   HIS  25           HA       HIS  25 -29.962   9.223  -8.452
  197   1HB   HIS  25          2HB       HIS  25 -27.570   9.219  -8.864
  198   2HB   HIS  25          1HB       HIS  25 -27.302   8.151  -7.493
  199    HD1  HIS  25           HD1      HIS  25 -29.483   8.027 -10.638
  200    HD2  HIS  25           HD2      HIS  25 -26.924   5.607  -8.425
  201    HE1  HIS  25           HE1      HIS  25 -29.131   5.899 -11.960
  202    H    LYS  26           H        LYS  26 -28.339   6.596  -6.959
  203    HA   LYS  26           HA       LYS  26 -29.214   4.644  -6.005
  204   1HB   LYS  26          2HB       LYS  26 -28.935   6.232  -4.107
  205   2HB   LYS  26          1HB       LYS  26 -30.589   6.792  -4.344
  206   1HG   LYS  26          2HG       LYS  26 -30.655   3.942  -4.209
  207   2HG   LYS  26          1HG       LYS  26 -29.682   4.519  -2.856
  208   1HD   LYS  26          2HD       LYS  26 -32.432   5.592  -3.547
  209   2HD   LYS  26          1HD       LYS  26 -32.127   4.363  -2.321
  210   1HE   LYS  26          2HE       LYS  26 -30.379   6.687  -1.987
  211   2HE   LYS  26          1HE       LYS  26 -32.099   7.110  -1.877
  212   1HZ   LYS  26          1HZ       LYS  26 -31.020   4.702  -0.545
  213   2HZ   LYS  26          2HZ       LYS  26 -32.468   5.533  -0.223
  214   3HZ   LYS  26          3HZ       LYS  26 -30.976   6.215   0.221
  215    H    ARG  27           H        ARG  27 -32.156   6.409  -5.182
  216    HA   ARG  27           HA       ARG  27 -33.962   4.509  -6.197
  217   1HB   ARG  27          2HB       ARG  27 -34.777   6.192  -4.752
  218   2HB   ARG  27          1HB       ARG  27 -34.033   7.483  -5.692
  219   1HG   ARG  27          2HG       ARG  27 -35.625   7.149  -7.504
  220   2HG   ARG  27          1HG       ARG  27 -36.320   5.753  -6.679
  221   1HD   ARG  27          2HD       ARG  27 -36.630   7.532  -4.703
  222   2HD   ARG  27          1HD       ARG  27 -36.651   8.662  -6.072
  223    HE   ARG  27           HE       ARG  27 -38.302   6.268  -6.464
  224   1HH1  ARG  27          1HH2      ARG  27 -39.232   7.874  -4.017
  225   2HH1  ARG  27          2HH2      ARG  27 -40.419   8.906  -4.741
  226   1HH2  ARG  27          1HH1      ARG  27 -39.346   8.310  -7.983
  227   2HH2  ARG  27          2HH1      ARG  27 -40.484   9.153  -6.987
  228    H    TYR  28           H        TYR  28 -32.130   6.970  -7.852
  229    HA   TYR  28           HA       TYR  28 -33.693   6.763 -10.352
  230   1HB   TYR  28          2HB       TYR  28 -31.159   8.222  -9.521
  231   2HB   TYR  28          1HB       TYR  28 -31.983   8.447 -11.069
  232    HD1  TYR  28           HD1      TYR  28 -31.618   9.887  -7.955
  233    HD2  TYR  28           HD2      TYR  28 -34.712   8.691 -10.681
  234    HE1  TYR  28           HE1      TYR  28 -33.165  11.520  -6.912
  235    HE2  TYR  28           HE2      TYR  28 -36.262  10.322  -9.636
  236    HH   TYR  28           HH       TYR  28 -36.514  11.495  -7.477
  237    H    CYS  29           H        CYS  29 -32.028   4.459  -9.124
  238    HA   CYS  29           HA       CYS  29 -29.933   4.085 -11.193
  239   1HB   CYS  29          2HB       CYS  29 -29.693   3.627  -8.681
  240   2HB   CYS  29          1HB       CYS  29 -30.749   2.245  -8.934
  241    H    LYS  30           H        LYS  30 -30.656   3.187 -13.125
  242    HA   LYS  30           HA       LYS  30 -33.057   1.756 -13.553
  243   1HB   LYS  30          2HB       LYS  30 -31.116   2.661 -15.119
  244   2HB   LYS  30          1HB       LYS  30 -30.488   1.023 -14.943
  245   1HG   LYS  30          2HG       LYS  30 -32.954   0.321 -15.537
  246   2HG   LYS  30          1HG       LYS  30 -33.041   1.942 -16.229
  247   1HD   LYS  30          2HD       LYS  30 -30.744   1.258 -17.339
  248   2HD   LYS  30          1HD       LYS  30 -31.330  -0.381 -17.052
  249   1HE   LYS  30          2HE       LYS  30 -33.091  -0.161 -18.552
  250   2HE   LYS  30          1HE       LYS  30 -33.204   1.595 -18.317
  251   1HZ   LYS  30          1HZ       LYS  30 -32.063   0.659 -20.442
  252   2HZ   LYS  30          2HZ       LYS  30 -30.731   0.438 -19.409
  253   3HZ   LYS  30          3HZ       LYS  30 -31.386   1.989 -19.639
  254    H    PHE  31           H        PHE  31 -30.095   0.873 -12.034
  255    HA   PHE  31           HA       PHE  31 -30.809  -2.020 -11.878
  256   1HB   PHE  31          2HB       PHE  31 -28.276  -0.424 -11.311
  257   2HB   PHE  31          1HB       PHE  31 -28.357  -2.189 -11.344
  258    HD1  PHE  31           HD1      PHE  31 -28.595   0.898 -13.357
  259    HD2  PHE  31           HD2      PHE  31 -28.600  -3.393 -13.434
  260    HE1  PHE  31           HE1      PHE  31 -28.354   0.947 -15.817
  261    HE2  PHE  31           HE2      PHE  31 -28.370  -3.349 -15.897
  262    HZ   PHE  31           HZ       PHE  31 -28.243  -1.179 -17.097
  263    H    ARG  32           H        ARG  32 -31.754   0.530 -10.265
  264    HA   ARG  32           HA       ARG  32 -30.828   0.489  -7.621
  265   1HB   ARG  32          2HB       ARG  32 -32.814   1.689  -7.138
  266   2HB   ARG  32          1HB       ARG  32 -32.531   2.012  -8.843
  267   1HG   ARG  32          2HG       ARG  32 -34.278  -0.287  -7.983
  268   2HG   ARG  32          1HG       ARG  32 -34.923   1.342  -8.109
  269   1HD   ARG  32          2HD       ARG  32 -34.226   1.461 -10.467
  270   2HD   ARG  32          1HD       ARG  32 -33.545  -0.175 -10.354
  271    HE   ARG  32           HE       ARG  32 -36.340   0.046  -9.482
  272   1HH1  ARG  32          1HH2      ARG  32 -34.468   0.064 -12.332
  273   2HH1  ARG  32          2HH2      ARG  32 -35.434  -1.117 -13.151
  274   1HH2  ARG  32          1HH1      ARG  32 -37.453  -1.756 -10.405
  275   2HH2  ARG  32          2HH1      ARG  32 -37.127  -2.146 -12.061
  276    H    TYR  33           H        TYR  33 -32.960  -1.753  -9.253
  277    HA   TYR  33           HA       TYR  33 -33.179  -3.319  -6.699
  278   1HB   TYR  33          2HB       TYR  33 -35.130  -2.945  -8.989
  279   2HB   TYR  33          1HB       TYR  33 -35.375  -4.087  -7.669
  280    HD1  TYR  33           HD1      TYR  33 -37.032  -1.536  -8.509
  281    HD2  TYR  33           HD2      TYR  33 -34.071  -2.302  -5.490
  282    HE1  TYR  33           HE1      TYR  33 -37.971   0.288  -7.119
  283    HE2  TYR  33           HE2      TYR  33 -35.010  -0.478  -4.105
  284    HH   TYR  33           HH       TYR  33 -37.804   0.675  -4.235
  285    H    CYS  34           H        CYS  34 -31.707  -3.338  -9.684
  286    HA   CYS  34           HA       CYS  34 -32.135  -5.815 -10.884
  287   1HB   CYS  34          2HB       CYS  34 -30.468  -4.047 -11.559
  288   2HB   CYS  34          1HB       CYS  34 -29.455  -4.567 -10.210
  289    H    THR  35           H        THR  35 -30.702  -7.841 -10.593
  290    HA   THR  35           HA       THR  35 -29.979  -8.318  -7.733
  291    HB   THR  35           HB       THR  35 -31.226 -10.540  -8.029
  292    HG1  THR  35           HG1      THR  35 -32.416  -9.108 -10.162
  293   1HG2  THR  35          1HG2      THR  35 -33.188  -9.603  -7.205
  294   2HG2  THR  35          2HG2      THR  35 -33.132  -8.246  -8.330
  295   3HG2  THR  35          3HG2      THR  35 -32.046  -8.284  -6.942
  296    H    CYS  36           H        CYS  36 -28.932  -8.393 -10.873
  297    HA   CYS  36           HA       CYS  36 -27.785 -10.892 -11.361
  298   1HB   CYS  36          2HB       CYS  36 -26.221  -9.684 -12.724
  299   2HB   CYS  36          1HB       CYS  36 -27.722  -8.759 -12.742
  300    H    GLU  37           H        GLU  37 -25.268 -11.344 -11.025
  301    HA   GLU  37           HA       GLU  37 -24.798 -11.320  -8.134
  302   1HB   GLU  37          2HB       GLU  37 -24.328 -13.237  -9.643
  303   2HB   GLU  37          1HB       GLU  37 -23.101 -12.271 -10.464
  304   1HG   GLU  37          2HG       GLU  37 -21.597 -12.888  -8.911
  305   2HG   GLU  37          1HG       GLU  37 -22.577 -12.108  -7.670
  306    H    LYS  38           H        LYS  38 -24.231  -8.995 -10.442
  307    HA   LYS  38           HA       LYS  38 -21.639  -8.087  -9.253
  308   1HB   LYS  38          2HB       LYS  38 -22.649  -8.231 -11.851
  309   2HB   LYS  38          1HB       LYS  38 -22.835  -6.527 -11.434
  310   1HG   LYS  38          2HG       LYS  38 -20.615  -6.168 -11.574
  311   2HG   LYS  38          1HG       LYS  38 -20.266  -7.555 -10.542
  312   1HD   LYS  38          2HD       LYS  38 -19.291  -7.828 -12.808
  313   2HD   LYS  38          1HD       LYS  38 -20.495  -9.069 -12.459
  314   1HE   LYS  38          2HE       LYS  38 -21.110  -8.351 -14.623
  315   2HE   LYS  38          1HE       LYS  38 -22.169  -7.374 -13.587
  316   1HZ   LYS  38          1HZ       LYS  38 -19.462  -6.394 -14.147
  317   2HZ   LYS  38          2HZ       LYS  38 -20.886  -5.518 -13.844
  318   3HZ   LYS  38          3HZ       LYS  38 -20.633  -6.235 -15.364
  319    H    CYS  39           H        CYS  39 -25.012  -7.572  -9.240
  320    HA   CYS  39           HA       CYS  39 -24.876  -4.786  -8.258
  321   1HB   CYS  39          2HB       CYS  39 -26.845  -6.746  -9.285
  322   2HB   CYS  39          1HB       CYS  39 -27.451  -5.710  -8.009
  323    H    ARG  40           H        ARG  40 -25.632  -8.098  -7.215
  324    HA   ARG  40           HA       ARG  40 -26.224  -7.379  -4.455
  325   1HB   ARG  40          2HB       ARG  40 -26.058  -9.746  -6.201
  326   2HB   ARG  40          1HB       ARG  40 -25.552 -10.064  -4.542
  327   1HG   ARG  40          2HG       ARG  40 -27.654  -9.170  -3.685
  328   2HG   ARG  40          1HG       ARG  40 -28.158  -8.720  -5.314
  329   1HD   ARG  40          2HD       ARG  40 -28.865 -10.829  -5.774
  330   2HD   ARG  40          1HD       ARG  40 -27.379 -11.543  -5.119
  331    HE   ARG  40           HE       ARG  40 -28.636 -10.684  -2.848
  332   1HH1  ARG  40          1HH2      ARG  40 -31.235 -10.825  -4.338
  333   2HH1  ARG  40          2HH2      ARG  40 -31.744 -12.451  -4.027
  334   1HH2  ARG  40          1HH1      ARG  40 -28.616 -13.509  -2.970
  335   2HH2  ARG  40          2HH1      ARG  40 -30.262 -13.970  -3.250
  336    H    LEU  41           H        LEU  41 -23.460  -8.412  -6.345
  337    HA   LEU  41           HA       LEU  41 -21.625  -8.883  -4.172
  338   1HB   LEU  41          2HB       LEU  41 -20.968  -9.803  -6.214
  339   2HB   LEU  41          1HB       LEU  41 -21.558  -8.419  -7.131
  340    HG   LEU  41           HG       LEU  41 -19.661  -7.104  -6.566
  341   1HD1  LEU  41          1HD1      LEU  41 -18.053  -8.832  -4.972
  342   2HD1  LEU  41          2HD1      LEU  41 -19.647  -8.767  -4.222
  343   3HD1  LEU  41          3HD1      LEU  41 -18.747  -7.277  -4.511
  344   1HD2  LEU  41          1HD2      LEU  41 -17.768  -9.044  -6.911
  345   2HD2  LEU  41          2HD2      LEU  41 -18.731  -8.365  -8.223
  346   3HD2  LEU  41          3HD2      LEU  41 -19.213  -9.885  -7.470
  347    H    THR  42           H        THR  42 -22.691  -6.078  -5.966
  348    HA   THR  42           HA       THR  42 -20.678  -4.216  -5.074
  349    HB   THR  42           HB       THR  42 -23.511  -3.991  -6.099
  350    HG1  THR  42           HG1      THR  42 -21.354  -4.596  -7.292
  351   1HG2  THR  42          1HG2      THR  42 -23.397  -1.931  -5.091
  352   2HG2  THR  42          2HG2      THR  42 -22.509  -1.543  -6.565
  353   3HG2  THR  42          3HG2      THR  42 -21.632  -1.919  -5.082
  354    H    ALA  43           H        ALA  43 -24.112  -4.300  -4.187
  355    HA   ALA  43           HA       ALA  43 -24.122  -2.726  -1.907
  356   1HB   ALA  43          1HB       ALA  43 -26.224  -3.538  -2.349
  357   2HB   ALA  43          2HB       ALA  43 -25.777  -4.794  -1.194
  358   3HB   ALA  43          3HB       ALA  43 -25.602  -5.084  -2.925
  359    H    ASP  44           H        ASP  44 -22.918  -6.003  -2.293
  360    HA   ASP  44           HA       ASP  44 -22.450  -6.610   0.488
  361   1HB   ASP  44          2HB       ASP  44 -22.587  -8.172  -1.507
  362   2HB   ASP  44          1HB       ASP  44 -21.003  -7.575  -2.001
  363    H    ARG  45           H        ARG  45 -20.452  -5.249  -2.125
  364    HA   ARG  45           HA       ARG  45 -17.987  -5.025  -0.721
  365   1HB   ARG  45          2HB       ARG  45 -18.928  -4.554  -3.227
  366   2HB   ARG  45          1HB       ARG  45 -18.784  -2.898  -2.639
  367   1HG   ARG  45          2HG       ARG  45 -16.619  -3.121  -3.329
  368   2HG   ARG  45          1HG       ARG  45 -16.421  -3.925  -1.772
  369   1HD   ARG  45          2HD       ARG  45 -17.449  -5.772  -3.780
  370   2HD   ARG  45          1HD       ARG  45 -15.899  -5.063  -4.274
  371    HE   ARG  45           HE       ARG  45 -16.355  -6.670  -1.824
  372   1HH1  ARG  45          1HH2      ARG  45 -14.450  -4.107  -2.940
  373   2HH1  ARG  45          2HH2      ARG  45 -12.934  -4.844  -2.540
  374   1HH2  ARG  45          1HH1      ARG  45 -14.345  -7.887  -1.657
  375   2HH2  ARG  45          2HH1      ARG  45 -12.875  -6.985  -1.813
  376    H    GLN  46           H        GLN  46 -20.946  -3.201  -0.452
  377    HA   GLN  46           HA       GLN  46 -19.557  -1.038   1.070
  378   1HB   GLN  46          2HB       GLN  46 -21.130  -0.593  -0.876
  379   2HB   GLN  46          1HB       GLN  46 -22.435  -1.214   0.137
  380   1HG   GLN  46          2HG       GLN  46 -22.163   0.528   1.736
  381   2HG   GLN  46          1HG       GLN  46 -20.606   1.007   1.059
  382   1HE2  GLN  46          1HE2      GLN  46 -22.121   3.150   1.136
  383   2HE2  GLN  46          2HE2      GLN  46 -22.903   3.492  -0.331
  384    H    ARG  47           H        ARG  47 -21.807  -3.713   1.422
  385    HA   ARG  47           HA       ARG  47 -22.603  -2.870   4.149
  386   1HB   ARG  47          2HB       ARG  47 -23.711  -4.359   2.043
  387   2HB   ARG  47          1HB       ARG  47 -23.365  -5.547   3.299
  388   1HG   ARG  47          2HG       ARG  47 -25.067  -4.800   4.572
  389   2HG   ARG  47          1HG       ARG  47 -24.499  -3.134   4.444
  390   1HD   ARG  47          2HD       ARG  47 -25.770  -2.716   2.503
  391   2HD   ARG  47          1HD       ARG  47 -25.941  -4.444   2.134
  392    HE   ARG  47           HE       ARG  47 -27.304  -4.547   4.318
  393   1HH1  ARG  47          1HH2      ARG  47 -26.627  -1.380   4.135
  394   2HH1  ARG  47          2HH2      ARG  47 -28.249  -0.809   3.919
  395   1HH2  ARG  47          1HH1      ARG  47 -29.555  -3.956   3.283
  396   2HH2  ARG  47          2HH1      ARG  47 -29.904  -2.266   3.433
  397    H    VAL  48           H        VAL  48 -19.949  -3.137   4.324
  398    HA   VAL  48           HA       VAL  48 -19.597  -5.587   5.938
  399    HB   VAL  48           HB       VAL  48 -17.483  -6.083   4.570
  400   1HG1  VAL  48          1HG1      VAL  48 -18.689  -7.426   3.016
  401   2HG1  VAL  48          2HG1      VAL  48 -20.040  -6.294   2.970
  402   3HG1  VAL  48          3HG1      VAL  48 -19.755  -7.269   4.412
  403   1HG2  VAL  48          1HG2      VAL  48 -16.951  -4.728   2.848
  404   2HG2  VAL  48          2HG2      VAL  48 -18.256  -3.655   3.356
  405   3HG2  VAL  48          3HG2      VAL  48 -18.564  -4.909   2.155
  406    H    MET  49           H        MET  49 -19.662  -3.025   6.909
  407    HA   MET  49           HA       MET  49 -16.776  -2.411   7.455
  408   1HB   MET  49          2HB       MET  49 -19.175  -0.689   6.878
  409   2HB   MET  49          1HB       MET  49 -17.828  -0.037   7.812
  410   1HG   MET  49          2HG       MET  49 -16.417  -1.114   5.812
  411   2HG   MET  49          1HG       MET  49 -17.928  -0.849   4.942
  412   1HE   MET  49          1HE       MET  49 -18.977   1.994   4.650
  413   2HE   MET  49          2HE       MET  49 -18.266   0.681   3.717
  414   3HE   MET  49          3HE       MET  49 -17.589   2.302   3.598
  415    H    ALA  50           H        ALA  50 -19.517  -0.843   8.939
  416    HA   ALA  50           HA       ALA  50 -18.599  -1.597  11.615
  417   1HB   ALA  50          1HB       ALA  50 -20.152   0.419  10.345
  418   2HB   ALA  50          2HB       ALA  50 -19.679   0.342  12.043
  419   3HB   ALA  50          3HB       ALA  50 -21.205  -0.369  11.519
  420    H    LEU  51           H        LEU  51 -20.992  -2.695   9.320
  421    HA   LEU  51           HA       LEU  51 -22.261  -4.438  11.396
  422   1HB   LEU  51          2HB       LEU  51 -23.104  -2.970   9.005
  423   2HB   LEU  51          1HB       LEU  51 -23.682  -4.636   9.014
  424    HG   LEU  51           HG       LEU  51 -25.239  -3.013  10.145
  425   1HD1  LEU  51          1HD1      LEU  51 -23.985  -5.337  11.593
  426   2HD1  LEU  51          2HD1      LEU  51 -25.558  -5.245  10.801
  427   3HD1  LEU  51          3HD1      LEU  51 -25.296  -4.423  12.340
  428   1HD2  LEU  51          1HD2      LEU  51 -24.550  -1.683  11.860
  429   2HD2  LEU  51          2HD2      LEU  51 -22.932  -1.984  11.227
  430   3HD2  LEU  51          3HD2      LEU  51 -23.549  -2.952  12.564
  431    H    GLN  52           H        GLN  52 -19.883  -5.499  10.899
  432    HA   GLN  52           HA       GLN  52 -20.402  -7.669   8.896
  433   1HB   GLN  52          2HB       GLN  52 -18.816  -5.916   8.086
  434   2HB   GLN  52          1HB       GLN  52 -17.781  -6.251   9.475
  435   1HG   GLN  52          2HG       GLN  52 -18.478  -8.711   8.114
  436   2HG   GLN  52          1HG       GLN  52 -17.741  -7.569   6.991
  437   1HE2  GLN  52          1HE2      GLN  52 -15.741  -6.341   8.187
  438   2HE2  GLN  52          2HE2      GLN  52 -14.666  -7.392   8.974
  Start of MODEL   16
    1   1H    SER   1          1H        SER   1 -28.686  21.204 -15.082
    2   2H    SER   1          2H        SER   1 -29.254  20.960 -13.499
    3   3H    SER   1          3H        SER   1 -28.278  19.786 -14.247
    4    HA   SER   1           HA       SER   1 -27.129  22.459 -14.035
    5   1HB   SER   1          2HB       SER   1 -27.079  20.707 -11.613
    6   2HB   SER   1          1HB       SER   1 -26.984  22.462 -11.723
    7    HG   SER   1           HG       SER   1 -29.145  20.846 -11.418
    8    H    ILE   2           H        ILE   2 -24.940  21.548 -12.498
    9    HA   ILE   2           HA       ILE   2 -23.898  19.003 -13.383
   10    HB   ILE   2           HB       ILE   2 -24.070  20.327 -15.522
   11   1HG1  ILE   2          2HG1      ILE   2 -21.176  19.858 -14.776
   12   2HG1  ILE   2          1HG1      ILE   2 -22.303  18.522 -15.015
   13   1HG2  ILE   2          1HG2      ILE   2 -23.285  22.444 -14.057
   14   2HG2  ILE   2          2HG2      ILE   2 -23.023  22.354 -15.799
   15   3HG2  ILE   2          3HG2      ILE   2 -21.715  21.948 -14.688
   16   1HD1  ILE   2          1HD1      ILE   2 -21.319  20.541 -17.019
   17   2HD1  ILE   2          2HD1      ILE   2 -22.857  19.718 -17.271
   18   3HD1  ILE   2          3HD1      ILE   2 -21.366  18.784 -17.151
   19    H    SER   3           H        SER   3 -21.527  18.829 -12.818
   20    HA   SER   3           HA       SER   3 -20.388  21.026 -11.203
   21   1HB   SER   3          2HB       SER   3 -21.877  18.763 -10.127
   22   2HB   SER   3          1HB       SER   3 -20.242  18.828  -9.479
   23    HG   SER   3           HG       SER   3 -20.651  20.761  -8.610
   24    HA   PRO   4           HA       PRO   4 -17.045  18.769 -13.200
   25   1HB   PRO   4          2HB       PRO   4 -15.197  20.768 -12.907
   26   2HB   PRO   4          1HB       PRO   4 -16.424  20.771 -14.189
   27   1HG   PRO   4          2HG       PRO   4 -16.383  22.254 -11.610
   28   2HG   PRO   4          1HG       PRO   4 -16.943  22.779 -13.206
   29   1HD   PRO   4          2HD       PRO   4 -18.616  21.977 -11.202
   30   2HD   PRO   4          1HD       PRO   4 -19.011  21.845 -12.930
   31    H    ARG   5           H        ARG   5 -17.501  17.696 -10.822
   32    HA   ARG   5           HA       ARG   5 -15.086  18.231  -9.122
   33   1HB   ARG   5          2HB       ARG   5 -17.819  17.063  -8.496
   34   2HB   ARG   5          1HB       ARG   5 -16.515  17.242  -7.321
   35   1HG   ARG   5          2HG       ARG   5 -16.552  19.629  -7.505
   36   2HG   ARG   5          1HG       ARG   5 -17.602  19.568  -8.921
   37   1HD   ARG   5          2HD       ARG   5 -19.135  20.062  -7.207
   38   2HD   ARG   5          1HD       ARG   5 -19.238  18.292  -7.271
   39    HE   ARG   5           HE       ARG   5 -17.084  19.046  -5.539
   40   1HH1  ARG   5          1HH2      ARG   5 -19.662  20.781  -4.970
   41   2HH1  ARG   5          2HH2      ARG   5 -20.292  19.902  -3.617
   42   1HH2  ARG   5          1HH1      ARG   5 -18.259  17.138  -4.130
   43   2HH2  ARG   5          2HH1      ARG   5 -19.497  17.839  -3.141
   44    H    THR   6           H        THR   6 -15.394  15.779  -7.634
   45    HA   THR   6           HA       THR   6 -14.698  13.740  -9.727
   46    HB   THR   6           HB       THR   6 -12.900  13.053  -8.285
   47    HG1  THR   6           HG1      THR   6 -14.466  14.289  -6.414
   48   1HG2  THR   6          1HG2      THR   6 -11.542  14.952  -8.402
   49   2HG2  THR   6          2HG2      THR   6 -12.857  16.039  -7.955
   50   3HG2  THR   6          3HG2      THR   6 -12.810  15.327  -9.568
   51    HA   PRO   7           HA       PRO   7 -17.992  12.397  -6.588
   52   1HB   PRO   7          2HB       PRO   7 -20.130  12.381  -8.307
   53   2HB   PRO   7          1HB       PRO   7 -19.682  13.792  -7.327
   54   1HG   PRO   7          2HG       PRO   7 -19.120  13.229 -10.200
   55   2HG   PRO   7          1HG       PRO   7 -19.587  14.749  -9.418
   56   1HD   PRO   7          2HD       PRO   7 -17.028  14.186 -10.141
   57   2HD   PRO   7          1HD       PRO   7 -17.435  15.223  -8.755
   58    HA   PRO   8           HA       PRO   8 -17.338   8.376  -8.327
   59   1HB   PRO   8          2HB       PRO   8 -18.654   6.949  -6.403
   60   2HB   PRO   8          1HB       PRO   8 -17.053   7.668  -6.141
   61   1HG   PRO   8          2HG       PRO   8 -19.717   8.602  -5.231
   62   2HG   PRO   8          1HG       PRO   8 -18.145   8.712  -4.429
   63   1HD   PRO   8          2HD       PRO   8 -19.387  10.791  -5.752
   64   2HD   PRO   8          1HD       PRO   8 -17.643  10.693  -5.425
   65    H    ASN   9           H        ASN   9 -18.628   6.699  -9.368
   66    HA   ASN   9           HA       ASN   9 -21.353   7.619 -10.126
   67   1HB   ASN   9          2HB       ASN   9 -21.052   6.073 -11.951
   68   2HB   ASN   9          1HB       ASN   9 -19.543   6.967 -11.759
   69   1HD2  ASN   9          1HD2      ASN   9 -21.102   3.847 -10.901
   70   2HD2  ASN   9          2HD2      ASN   9 -19.649   2.985 -10.751
   71    H    CYS  10           H        CYS  10 -23.114   6.057 -10.162
   72    HA   CYS  10           HA       CYS  10 -23.429   4.598  -7.701
   73   1HB   CYS  10          2HB       CYS  10 -25.312   5.567  -8.951
   74   2HB   CYS  10          1HB       CYS  10 -24.923   4.598 -10.340
   75    H    ALA  11           H        ALA  11 -23.028   2.414  -7.286
   76    HA   ALA  11           HA       ALA  11 -21.613   0.874  -9.349
   77   1HB   ALA  11          1HB       ALA  11 -21.086  -0.583  -7.559
   78   2HB   ALA  11          2HB       ALA  11 -22.484  -0.058  -6.622
   79   3HB   ALA  11          3HB       ALA  11 -21.107   1.024  -6.833
   80    H    ARG  12           H        ARG  12 -24.779   0.799  -7.739
   81    HA   ARG  12           HA       ARG  12 -25.698  -1.742  -8.484
   82   1HB   ARG  12          2HB       ARG  12 -26.829   0.132  -7.193
   83   2HB   ARG  12          1HB       ARG  12 -27.176   0.900  -8.737
   84   1HG   ARG  12          2HG       ARG  12 -29.003  -0.352  -8.907
   85   2HG   ARG  12          1HG       ARG  12 -27.980  -1.783  -9.008
   86   1HD   ARG  12          2HD       ARG  12 -29.075  -0.530  -6.459
   87   2HD   ARG  12          1HD       ARG  12 -29.529  -2.104  -7.143
   88    HE   ARG  12           HE       ARG  12 -26.651  -1.737  -6.643
   89   1HH1  ARG  12          1HH2      ARG  12 -28.598  -4.226  -6.738
   90   2HH1  ARG  12          2HH2      ARG  12 -28.429  -4.771  -5.103
   91   1HH2  ARG  12          1HH1      ARG  12 -26.908  -1.854  -4.007
   92   2HH2  ARG  12          2HH1      ARG  12 -27.471  -3.429  -3.558
   93    H    CYS  13           H        CYS  13 -25.765   1.222 -10.393
   94    HA   CYS  13           HA       CYS  13 -26.602  -0.298 -12.782
   95   1HB   CYS  13          2HB       CYS  13 -26.822   1.983 -13.718
   96   2HB   CYS  13          1HB       CYS  13 -27.530   1.910 -12.124
   97    H    ARG  14           H        ARG  14 -23.604   0.517 -11.333
   98    HA   ARG  14           HA       ARG  14 -22.000   0.877 -13.738
   99   1HB   ARG  14          2HB       ARG  14 -20.528   1.417 -12.111
  100   2HB   ARG  14          1HB       ARG  14 -21.784   1.038 -10.950
  101   1HG   ARG  14          2HG       ARG  14 -19.834  -1.016 -12.048
  102   2HG   ARG  14          1HG       ARG  14 -19.600  -0.168 -10.528
  103   1HD   ARG  14          2HD       ARG  14 -21.386  -1.292  -9.491
  104   2HD   ARG  14          1HD       ARG  14 -22.106  -1.757 -11.034
  105    HE   ARG  14           HE       ARG  14 -20.718  -3.651 -10.942
  106   1HH1  ARG  14          1HH2      ARG  14 -19.730  -2.145  -8.252
  107   2HH1  ARG  14          2HH2      ARG  14 -18.032  -2.443  -8.428
  108   1HH2  ARG  14          1HH1      ARG  14 -18.294  -3.523 -11.713
  109   2HH2  ARG  14          2HH1      ARG  14 -17.218  -3.223 -10.389
  110    H    ASN  15           H        ASN  15 -23.524  -1.805 -12.340
  111    HA   ASN  15           HA       ASN  15 -21.587  -3.855 -12.938
  112   1HB   ASN  15          2HB       ASN  15 -24.521  -3.677 -12.279
  113   2HB   ASN  15          1HB       ASN  15 -23.710  -5.223 -12.463
  114   1HD2  ASN  15          1HD2      ASN  15 -24.441  -2.778 -10.290
  115   2HD2  ASN  15          2HD2      ASN  15 -23.226  -3.021  -9.139
  116    H    HIS  16           H        HIS  16 -24.373  -2.498 -14.562
  117    HA   HIS  16           HA       HIS  16 -24.153  -4.405 -16.804
  118   1HB   HIS  16          2HB       HIS  16 -26.051  -2.145 -16.118
  119   2HB   HIS  16          1HB       HIS  16 -26.300  -3.346 -17.366
  120    HD1  HIS  16           HD1      HIS  16 -27.344  -5.527 -16.694
  121    HD2  HIS  16           HD2      HIS  16 -25.783  -3.405 -13.469
  122    HE1  HIS  16           HE1      HIS  16 -27.957  -6.846 -14.601
  123    H    GLY  17           H        GLY  17 -22.965  -1.297 -15.965
  124   1HA   GLY  17          2HA       GLY  17 -21.245  -0.411 -17.562
  125   2HA   GLY  17          1HA       GLY  17 -22.386  -0.771 -18.859
  126    H    LEU  18           H        LEU  18 -23.585   0.499 -15.876
  127    HA   LEU  18           HA       LEU  18 -24.442   2.957 -17.295
  128   1HB   LEU  18          2HB       LEU  18 -25.642   1.168 -15.609
  129   2HB   LEU  18          1HB       LEU  18 -25.182   2.441 -14.480
  130    HG   LEU  18           HG       LEU  18 -27.428   2.858 -15.364
  131   1HD1  LEU  18          1HD1      LEU  18 -27.083   5.101 -15.615
  132   2HD1  LEU  18          2HD1      LEU  18 -25.840   4.877 -16.846
  133   3HD1  LEU  18          3HD1      LEU  18 -25.442   4.665 -15.140
  134   1HD2  LEU  18          1HD2      LEU  18 -27.951   2.486 -17.527
  135   2HD2  LEU  18          2HD2      LEU  18 -26.324   1.837 -17.734
  136   3HD2  LEU  18          3HD2      LEU  18 -26.645   3.537 -18.077
  137    H    LYS  19           H        LYS  19 -23.997   5.058 -16.377
  138    HA   LYS  19           HA       LYS  19 -22.084   5.284 -14.140
  139   1HB   LYS  19          2HB       LYS  19 -21.108   4.973 -16.665
  140   2HB   LYS  19          1HB       LYS  19 -21.307   6.726 -16.620
  141   1HG   LYS  19          2HG       LYS  19 -19.074   6.173 -15.820
  142   2HG   LYS  19          1HG       LYS  19 -20.034   6.766 -14.464
  143   1HD   LYS  19          2HD       LYS  19 -19.394   4.871 -13.403
  144   2HD   LYS  19          1HD       LYS  19 -20.570   4.055 -14.433
  145   1HE   LYS  19          2HE       LYS  19 -18.925   3.299 -15.931
  146   2HE   LYS  19          1HE       LYS  19 -17.769   4.552 -15.438
  147   1HZ   LYS  19          1HZ       LYS  19 -17.100   2.571 -14.356
  148   2HZ   LYS  19          2HZ       LYS  19 -18.686   2.210 -13.863
  149   3HZ   LYS  19          3HZ       LYS  19 -17.854   3.519 -13.168
  150    H    ILE  20           H        ILE  20 -23.764   6.447 -13.143
  151    HA   ILE  20           HA       ILE  20 -24.719   8.936 -14.478
  152    HB   ILE  20           HB       ILE  20 -26.712   8.462 -13.452
  153   1HG1  ILE  20          2HG1      ILE  20 -25.442   8.874 -11.173
  154   2HG1  ILE  20          1HG1      ILE  20 -27.053   8.227 -11.252
  155   1HG2  ILE  20          1HG2      ILE  20 -25.463   5.794 -12.925
  156   2HG2  ILE  20          2HG2      ILE  20 -26.016   6.344 -14.502
  157   3HG2  ILE  20          3HG2      ILE  20 -27.172   6.143 -13.188
  158   1HD1  ILE  20          1HD1      ILE  20 -24.548   6.584 -11.138
  159   2HD1  ILE  20          2HD1      ILE  20 -26.192   5.959 -11.160
  160   3HD1  ILE  20          3HD1      ILE  20 -25.626   6.904  -9.793
  161    H    THR  21           H        THR  21 -22.469   7.951 -12.150
  162    HA   THR  21           HA       THR  21 -21.039   9.336 -10.811
  163    HB   THR  21           HB       THR  21 -23.069  11.539 -11.049
  164    HG1  THR  21           HG1      THR  21 -22.120  12.087 -13.029
  165   1HG2  THR  21          1HG2      THR  21 -21.408  12.616  -9.983
  166   2HG2  THR  21          2HG2      THR  21 -20.433  12.437 -11.443
  167   3HG2  THR  21          3HG2      THR  21 -20.334  11.229 -10.161
  168    H    LEU  22           H        LEU  22 -24.005   8.200 -10.261
  169    HA   LEU  22           HA       LEU  22 -25.418   7.866  -8.385
  170   1HB   LEU  22          2HB       LEU  22 -23.541   6.571  -7.749
  171   2HB   LEU  22          1HB       LEU  22 -22.578   7.996  -7.374
  172    HG   LEU  22           HG       LEU  22 -23.909   8.459  -5.408
  173   1HD1  LEU  22          1HD1      LEU  22 -26.034   7.498  -6.672
  174   2HD1  LEU  22          2HD1      LEU  22 -25.953   7.460  -4.913
  175   3HD1  LEU  22          3HD1      LEU  22 -25.583   6.010  -5.845
  176   1HD2  LEU  22          1HD2      LEU  22 -22.204   6.836  -4.982
  177   2HD2  LEU  22          2HD2      LEU  22 -23.150   5.548  -5.726
  178   3HD2  LEU  22          3HD2      LEU  22 -23.657   6.237  -4.183
  179    H    LYS  23           H        LYS  23 -24.648  10.809  -9.142
  180    HA   LYS  23           HA       LYS  23 -24.855  12.180  -6.547
  181   1HB   LYS  23          2HB       LYS  23 -23.619  12.909  -8.705
  182   2HB   LYS  23          1HB       LYS  23 -25.215  13.349  -9.313
  183   1HG   LYS  23          2HG       LYS  23 -24.242  15.322  -8.306
  184   2HG   LYS  23          1HG       LYS  23 -25.529  14.754  -7.242
  185   1HD   LYS  23          2HD       LYS  23 -23.900  13.639  -5.804
  186   2HD   LYS  23          1HD       LYS  23 -22.591  14.095  -6.894
  187   1HE   LYS  23          2HE       LYS  23 -23.888  16.517  -6.348
  188   2HE   LYS  23          1HE       LYS  23 -23.839  15.673  -4.787
  189   1HZ   LYS  23          1HZ       LYS  23 -21.509  15.231  -5.097
  190   2HZ   LYS  23          2HZ       LYS  23 -21.771  16.902  -5.255
  191   3HZ   LYS  23          3HZ       LYS  23 -21.528  15.943  -6.637
  192    H    GLY  24           H        GLY  24 -26.873  12.266  -5.548
  193   1HA   GLY  24          2HA       GLY  24 -29.231  12.219  -5.347
  194   2HA   GLY  24          1HA       GLY  24 -29.190  13.378  -6.683
  195    H    HIS  25           H        HIS  25 -28.235   9.972  -6.490
  196    HA   HIS  25           HA       HIS  25 -29.890   9.426  -8.920
  197   1HB   HIS  25          2HB       HIS  25 -27.468   9.263  -9.108
  198   2HB   HIS  25          1HB       HIS  25 -27.405   8.191  -7.716
  199    HD1  HIS  25           HD1      HIS  25 -29.261   8.196 -11.072
  200    HD2  HIS  25           HD2      HIS  25 -27.143   5.610  -8.587
  201    HE1  HIS  25           HE1      HIS  25 -28.981   6.008 -12.326
  202    H    LYS  26           H        LYS  26 -28.609   6.690  -7.310
  203    HA   LYS  26           HA       LYS  26 -29.738   4.825  -6.424
  204   1HB   LYS  26          2HB       LYS  26 -30.193   7.268  -4.833
  205   2HB   LYS  26          1HB       LYS  26 -31.361   5.986  -4.509
  206   1HG   LYS  26          2HG       LYS  26 -28.438   5.312  -4.646
  207   2HG   LYS  26          1HG       LYS  26 -29.095   6.038  -3.178
  208   1HD   LYS  26          2HD       LYS  26 -30.933   4.215  -3.352
  209   2HD   LYS  26          1HD       LYS  26 -29.820   3.408  -4.457
  210   1HE   LYS  26          2HE       LYS  26 -28.251   2.989  -2.789
  211   2HE   LYS  26          1HE       LYS  26 -28.771   4.378  -1.812
  212   1HZ   LYS  26          1HZ       LYS  26 -29.881   1.700  -1.949
  213   2HZ   LYS  26          2HZ       LYS  26 -31.029   2.954  -1.950
  214   3HZ   LYS  26          3HZ       LYS  26 -29.911   2.820  -0.676
  215    H    ARG  27           H        ARG  27 -32.464   6.905  -5.690
  216    HA   ARG  27           HA       ARG  27 -34.486   5.277  -6.752
  217   1HB   ARG  27          2HB       ARG  27 -34.472   8.310  -6.804
  218   2HB   ARG  27          1HB       ARG  27 -35.857   7.249  -6.553
  219   1HG   ARG  27          2HG       ARG  27 -34.294   6.405  -4.530
  220   2HG   ARG  27          1HG       ARG  27 -33.731   8.072  -4.648
  221   1HD   ARG  27          2HD       ARG  27 -36.671   7.773  -4.777
  222   2HD   ARG  27          1HD       ARG  27 -35.945   7.328  -3.221
  223    HE   ARG  27           HE       ARG  27 -35.402   9.602  -2.912
  224   1HH1  ARG  27          1HH2      ARG  27 -36.844   9.211  -5.942
  225   2HH1  ARG  27          2HH2      ARG  27 -36.231  10.686  -6.609
  226   1HH2  ARG  27          1HH1      ARG  27 -34.195  11.381  -3.889
  227   2HH2  ARG  27          2HH1      ARG  27 -34.730  11.914  -5.448
  228    H    TYR  28           H        TYR  28 -32.217   7.326  -8.414
  229    HA   TYR  28           HA       TYR  28 -33.757   7.345 -10.946
  230   1HB   TYR  28          2HB       TYR  28 -31.086   8.451 -10.018
  231   2HB   TYR  28          1HB       TYR  28 -31.728   8.693 -11.644
  232    HD1  TYR  28           HD1      TYR  28 -32.896   8.995  -8.078
  233    HD2  TYR  28           HD2      TYR  28 -32.921  10.642 -12.044
  234    HE1  TYR  28           HE1      TYR  28 -34.245  10.905  -7.270
  235    HE2  TYR  28           HE2      TYR  28 -34.271  12.556 -11.235
  236    HH   TYR  28           HH       TYR  28 -35.158  12.862  -7.799
  237    H    CYS  29           H        CYS  29 -31.767   5.169  -9.387
  238    HA   CYS  29           HA       CYS  29 -29.946   4.353 -11.453
  239   1HB   CYS  29          2HB       CYS  29 -30.048   3.818  -8.904
  240   2HB   CYS  29          1HB       CYS  29 -31.168   2.551  -9.376
  241    H    LYS  30           H        LYS  30 -30.083   2.687 -12.941
  242    HA   LYS  30           HA       LYS  30 -32.843   1.818 -13.677
  243   1HB   LYS  30          2HB       LYS  30 -30.529   2.576 -15.090
  244   2HB   LYS  30          1HB       LYS  30 -30.627   0.828 -15.299
  245   1HG   LYS  30          2HG       LYS  30 -33.262   1.799 -15.591
  246   2HG   LYS  30          1HG       LYS  30 -32.229   2.867 -16.543
  247   1HD   LYS  30          2HD       LYS  30 -31.323   0.193 -16.950
  248   2HD   LYS  30          1HD       LYS  30 -33.072   0.207 -17.173
  249   1HE   LYS  30          2HE       LYS  30 -32.174   2.541 -18.459
  250   2HE   LYS  30          1HE       LYS  30 -31.016   1.279 -18.921
  251   1HZ   LYS  30          1HZ       LYS  30 -32.636  -0.022 -19.832
  252   2HZ   LYS  30          2HZ       LYS  30 -33.303   1.507 -20.158
  253   3HZ   LYS  30          3HZ       LYS  30 -33.863   0.596 -18.838
  254    H    PHE  31           H        PHE  31 -30.849   0.985 -11.412
  255    HA   PHE  31           HA       PHE  31 -31.289  -1.958 -11.585
  256   1HB   PHE  31          2HB       PHE  31 -28.705  -0.509 -10.880
  257   2HB   PHE  31          1HB       PHE  31 -28.900  -2.260 -10.980
  258    HD1  PHE  31           HD1      PHE  31 -28.837   0.895 -12.905
  259    HD2  PHE  31           HD2      PHE  31 -29.014  -3.386 -13.116
  260    HE1  PHE  31           HE1      PHE  31 -28.389   1.002 -15.330
  261    HE2  PHE  31           HE2      PHE  31 -28.572  -3.283 -15.545
  262    HZ   PHE  31           HZ       PHE  31 -28.248  -1.090 -16.662
  263    H    ARG  32           H        ARG  32 -32.106   0.700 -10.064
  264    HA   ARG  32           HA       ARG  32 -31.301   0.841  -7.444
  265   1HB   ARG  32          2HB       ARG  32 -34.005   1.116  -7.131
  266   2HB   ARG  32          1HB       ARG  32 -32.951   2.376  -7.754
  267   1HG   ARG  32          2HG       ARG  32 -35.040   1.914  -9.126
  268   2HG   ARG  32          1HG       ARG  32 -33.529   1.860 -10.016
  269   1HD   ARG  32          2HD       ARG  32 -33.642  -0.438 -10.343
  270   2HD   ARG  32          1HD       ARG  32 -34.573  -0.695  -8.852
  271    HE   ARG  32           HE       ARG  32 -36.538   0.272 -10.008
  272   1HH1  ARG  32          1HH2      ARG  32 -35.002   1.701 -12.183
  273   2HH1  ARG  32          2HH2      ARG  32 -35.308   0.686 -13.552
  274   1HH2  ARG  32          1HH1      ARG  32 -36.403  -2.001 -11.650
  275   2HH2  ARG  32          2HH1      ARG  32 -36.095  -1.412 -13.250
  276    H    TYR  33           H        TYR  33 -33.062  -1.758  -8.918
  277    HA   TYR  33           HA       TYR  33 -33.117  -3.158  -6.267
  278   1HB   TYR  33          2HB       TYR  33 -35.256  -3.016  -8.415
  279   2HB   TYR  33          1HB       TYR  33 -35.339  -4.068  -7.001
  280    HD1  TYR  33           HD1      TYR  33 -36.531  -1.084  -8.215
  281    HD2  TYR  33           HD2      TYR  33 -34.569  -2.656  -4.733
  282    HE1  TYR  33           HE1      TYR  33 -37.415   0.800  -6.866
  283    HE2  TYR  33           HE2      TYR  33 -35.452  -0.772  -3.385
  284    HH   TYR  33           HH       TYR  33 -36.716   1.047  -3.375
  285    H    CYS  34           H        CYS  34 -31.780  -3.193  -9.264
  286    HA   CYS  34           HA       CYS  34 -32.152  -5.680 -10.449
  287   1HB   CYS  34          2HB       CYS  34 -30.550  -3.859 -11.140
  288   2HB   CYS  34          1HB       CYS  34 -29.494  -4.365  -9.830
  289    H    THR  35           H        THR  35 -30.711  -7.653 -10.193
  290    HA   THR  35           HA       THR  35 -29.774  -8.110  -7.402
  291    HB   THR  35           HB       THR  35 -31.139 -10.213  -7.374
  292    HG1  THR  35           HG1      THR  35 -31.884 -10.805  -9.228
  293   1HG2  THR  35          1HG2      THR  35 -32.982  -7.911  -7.970
  294   2HG2  THR  35          2HG2      THR  35 -31.921  -7.861  -6.563
  295   3HG2  THR  35          3HG2      THR  35 -33.121  -9.145  -6.716
  296    H    CYS  36           H        CYS  36 -29.020  -8.240 -10.603
  297    HA   CYS  36           HA       CYS  36 -28.042 -10.785 -11.196
  298   1HB   CYS  36          2HB       CYS  36 -26.527  -9.639 -12.664
  299   2HB   CYS  36          1HB       CYS  36 -27.980  -8.647 -12.563
  300    H    GLU  37           H        GLU  37 -25.628 -11.510 -10.946
  301    HA   GLU  37           HA       GLU  37 -24.953 -11.383  -8.108
  302   1HB   GLU  37          2HB       GLU  37 -23.260 -13.012  -8.749
  303   2HB   GLU  37          1HB       GLU  37 -24.760 -13.386  -9.598
  304   1HG   GLU  37          2HG       GLU  37 -23.812 -11.933 -11.514
  305   2HG   GLU  37          1HG       GLU  37 -22.260 -12.100 -10.691
  306    H    LYS  38           H        LYS  38 -24.433  -9.125 -10.416
  307    HA   LYS  38           HA       LYS  38 -21.655  -8.457  -9.506
  308   1HB   LYS  38          2HB       LYS  38 -23.196  -8.253 -11.976
  309   2HB   LYS  38          1HB       LYS  38 -22.502  -6.694 -11.526
  310   1HG   LYS  38          2HG       LYS  38 -20.472  -7.378 -12.203
  311   2HG   LYS  38          1HG       LYS  38 -20.536  -8.727 -11.068
  312   1HD   LYS  38          2HD       LYS  38 -20.250  -9.469 -13.441
  313   2HD   LYS  38          1HD       LYS  38 -21.718 -10.101 -12.695
  314   1HE   LYS  38          2HE       LYS  38 -22.456  -7.608 -13.797
  315   2HE   LYS  38          1HE       LYS  38 -21.475  -8.417 -15.036
  316   1HZ   LYS  38          1HZ       LYS  38 -22.821 -10.488 -14.275
  317   2HZ   LYS  38          2HZ       LYS  38 -23.514  -9.395 -15.373
  318   3HZ   LYS  38          3HZ       LYS  38 -23.945  -9.342 -13.731
  319    H    CYS  39           H        CYS  39 -24.968  -7.603  -9.294
  320    HA   CYS  39           HA       CYS  39 -24.494  -4.854  -8.327
  321   1HB   CYS  39          2HB       CYS  39 -26.734  -6.623  -9.165
  322   2HB   CYS  39          1HB       CYS  39 -27.124  -5.506  -7.870
  323    H    ARG  40           H        ARG  40 -25.451  -8.087  -7.207
  324    HA   ARG  40           HA       ARG  40 -25.731  -7.323  -4.408
  325   1HB   ARG  40          2HB       ARG  40 -25.655  -9.843  -6.055
  326   2HB   ARG  40          1HB       ARG  40 -25.538  -9.960  -4.299
  327   1HG   ARG  40          2HG       ARG  40 -27.692  -9.191  -3.962
  328   2HG   ARG  40          1HG       ARG  40 -27.697  -8.240  -5.448
  329   1HD   ARG  40          2HD       ARG  40 -29.135 -10.056  -5.958
  330   2HD   ARG  40          1HD       ARG  40 -27.582 -10.573  -6.645
  331    HE   ARG  40           HE       ARG  40 -27.478 -11.439  -4.006
  332   1HH1  ARG  40          1HH2      ARG  40 -27.583 -13.285  -6.403
  333   2HH1  ARG  40          2HH2      ARG  40 -29.000 -14.221  -6.059
  334   1HH2  ARG  40          1HH1      ARG  40 -30.197 -12.016  -3.662
  335   2HH2  ARG  40          2HH1      ARG  40 -30.481 -13.502  -4.508
  336    H    LEU  41           H        LEU  41 -23.283  -8.725  -6.512
  337    HA   LEU  41           HA       LEU  41 -21.300  -9.343  -4.536
  338   1HB   LEU  41          2HB       LEU  41 -20.960 -10.283  -6.659
  339   2HB   LEU  41          1HB       LEU  41 -21.419  -8.797  -7.486
  340    HG   LEU  41           HG       LEU  41 -19.332  -7.772  -7.063
  341   1HD1  LEU  41          1HD1      LEU  41 -19.376  -9.465  -4.723
  342   2HD1  LEU  41          2HD1      LEU  41 -18.375  -8.049  -5.043
  343   3HD1  LEU  41          3HD1      LEU  41 -17.834  -9.645  -5.560
  344   1HD2  LEU  41          1HD2      LEU  41 -19.431 -10.397  -8.215
  345   2HD2  LEU  41          2HD2      LEU  41 -17.889 -10.207  -7.381
  346   3HD2  LEU  41          3HD2      LEU  41 -18.361  -9.058  -8.632
  347    H    THR  42           H        THR  42 -22.155  -6.436  -6.313
  348    HA   THR  42           HA       THR  42 -19.918  -4.803  -5.511
  349    HB   THR  42           HB       THR  42 -22.723  -4.369  -6.517
  350    HG1  THR  42           HG1      THR  42 -20.112  -4.291  -7.527
  351   1HG2  THR  42          1HG2      THR  42 -22.234  -2.456  -5.084
  352   2HG2  THR  42          2HG2      THR  42 -22.139  -1.965  -6.774
  353   3HG2  THR  42          3HG2      THR  42 -20.661  -2.250  -5.856
  354    H    ALA  43           H        ALA  43 -23.280  -4.283  -4.567
  355    HA   ALA  43           HA       ALA  43 -22.979  -2.783  -2.267
  356   1HB   ALA  43          1HB       ALA  43 -25.193  -3.382  -1.887
  357   2HB   ALA  43          2HB       ALA  43 -24.888  -5.090  -2.202
  358   3HB   ALA  43          3HB       ALA  43 -25.024  -3.957  -3.546
  359    H    ASP  44           H        ASP  44 -22.335  -6.197  -2.708
  360    HA   ASP  44           HA       ASP  44 -21.962  -6.774   0.145
  361   1HB   ASP  44          2HB       ASP  44 -22.799  -8.371  -1.604
  362   2HB   ASP  44          1HB       ASP  44 -21.209  -8.309  -2.366
  363    H    ARG  45           H        ARG  45 -19.925  -6.189  -2.718
  364    HA   ARG  45           HA       ARG  45 -17.373  -6.793  -1.795
  365   1HB   ARG  45          2HB       ARG  45 -18.335  -5.699  -3.993
  366   2HB   ARG  45          1HB       ARG  45 -17.931  -4.183  -3.185
  367   1HG   ARG  45          2HG       ARG  45 -15.962  -4.671  -4.365
  368   2HG   ARG  45          1HG       ARG  45 -15.615  -5.306  -2.756
  369   1HD   ARG  45          2HD       ARG  45 -16.911  -7.422  -4.064
  370   2HD   ARG  45          1HD       ARG  45 -15.806  -6.749  -5.278
  371    HE   ARG  45           HE       ARG  45 -14.276  -6.787  -2.978
  372   1HH1  ARG  45          1HH2      ARG  45 -16.018  -9.101  -2.142
  373   2HH1  ARG  45          2HH2      ARG  45 -15.141 -10.452  -2.778
  374   1HH2  ARG  45          1HH1      ARG  45 -13.199  -8.524  -4.908
  375   2HH2  ARG  45          2HH1      ARG  45 -13.546 -10.125  -4.347
  376    H    GLN  46           H        GLN  46 -19.109  -3.697  -1.285
  377    HA   GLN  46           HA       GLN  46 -17.145  -3.030   0.872
  378   1HB   GLN  46          2HB       GLN  46 -18.868  -1.532  -1.061
  379   2HB   GLN  46          1HB       GLN  46 -18.484  -0.753   0.474
  380   1HG   GLN  46          2HG       GLN  46 -16.217  -0.636   0.008
  381   2HG   GLN  46          1HG       GLN  46 -16.258  -2.040  -1.059
  382   1HE2  GLN  46          1HE2      GLN  46 -18.045   1.101  -1.020
  383   2HE2  GLN  46          2HE2      GLN  46 -17.712   1.474  -2.642
  384    H    ARG  47           H        ARG  47 -18.400  -4.613   2.279
  385    HA   ARG  47           HA       ARG  47 -21.127  -3.799   3.067
  386   1HB   ARG  47          2HB       ARG  47 -20.390  -6.166   2.802
  387   2HB   ARG  47          1HB       ARG  47 -19.232  -5.930   4.111
  388   1HG   ARG  47          2HG       ARG  47 -21.213  -5.222   5.559
  389   2HG   ARG  47          1HG       ARG  47 -22.250  -5.836   4.272
  390   1HD   ARG  47          2HD       ARG  47 -21.719  -8.039   4.711
  391   2HD   ARG  47          1HD       ARG  47 -20.068  -7.642   5.227
  392    HE   ARG  47           HE       ARG  47 -21.209  -6.589   7.285
  393   1HH1  ARG  47          1HH2      ARG  47 -23.994  -7.296   6.273
  394   2HH1  ARG  47          2HH2      ARG  47 -24.334  -8.723   7.194
  395   1HH2  ARG  47          1HH1      ARG  47 -21.032  -9.235   8.118
  396   2HH2  ARG  47          2HH1      ARG  47 -22.658  -9.818   8.242
  397    H    VAL  48           H        VAL  48 -20.259  -1.606   3.847
  398    HA   VAL  48           HA       VAL  48 -19.701  -1.783   6.745
  399    HB   VAL  48           HB       VAL  48 -17.487  -1.907   5.726
  400   1HG1  VAL  48          1HG1      VAL  48 -18.704  -0.169   3.802
  401   2HG1  VAL  48          2HG1      VAL  48 -17.125  -0.953   3.723
  402   3HG1  VAL  48          3HG1      VAL  48 -17.282   0.641   4.462
  403   1HG2  VAL  48          1HG2      VAL  48 -18.154   0.848   6.810
  404   2HG2  VAL  48          2HG2      VAL  48 -16.511   0.238   6.606
  405   3HG2  VAL  48          3HG2      VAL  48 -17.610  -0.550   7.738
  406    H    MET  49           H        MET  49 -21.926  -0.794   6.568
  407    HA   MET  49           HA       MET  49 -21.826   2.103   5.799
  408   1HB   MET  49          2HB       MET  49 -23.390   0.674   4.535
  409   2HB   MET  49          1HB       MET  49 -24.132   0.143   6.046
  410   1HG   MET  49          2HG       MET  49 -25.513   1.901   5.120
  411   2HG   MET  49          1HG       MET  49 -24.687   2.548   6.537
  412   1HE   MET  49          1HE       MET  49 -25.720   3.855   3.099
  413   2HE   MET  49          2HE       MET  49 -25.160   2.188   2.998
  414   3HE   MET  49          3HE       MET  49 -24.277   3.459   2.154
  415    H    ALA  50           H        ALA  50 -22.005  -0.042   8.446
  416    HA   ALA  50           HA       ALA  50 -23.403   1.949  10.176
  417   1HB   ALA  50          1HB       ALA  50 -22.461  -0.761  11.057
  418   2HB   ALA  50          2HB       ALA  50 -23.823  -0.656   9.940
  419   3HB   ALA  50          3HB       ALA  50 -23.919   0.116  11.522
  420    H    LEU  51           H        LEU  51 -21.549   3.437  10.279
  421    HA   LEU  51           HA       LEU  51 -19.512   2.530  12.258
  422   1HB   LEU  51          2HB       LEU  51 -17.804   3.708  10.748
  423   2HB   LEU  51          1HB       LEU  51 -18.433   2.171  10.151
  424    HG   LEU  51           HG       LEU  51 -20.161   4.347   9.342
  425   1HD1  LEU  51          1HD1      LEU  51 -17.409   4.523   8.135
  426   2HD1  LEU  51          2HD1      LEU  51 -17.803   5.457   9.579
  427   3HD1  LEU  51          3HD1      LEU  51 -18.716   5.707   8.092
  428   1HD2  LEU  51          1HD2      LEU  51 -19.996   2.062   8.338
  429   2HD2  LEU  51          2HD2      LEU  51 -18.388   2.473   7.743
  430   3HD2  LEU  51          3HD2      LEU  51 -19.800   3.344   7.143
  431    H    GLN  52           H        GLN  52 -21.322   4.040  13.319
  432    HA   GLN  52           HA       GLN  52 -20.125   6.758  13.464
  433   1HB   GLN  52          2HB       GLN  52 -22.034   6.494  11.706
  434   2HB   GLN  52          1HB       GLN  52 -23.100   6.406  13.109
  435   1HG   GLN  52          2HG       GLN  52 -21.091   8.618  13.009
  436   2HG   GLN  52          1HG       GLN  52 -22.519   8.744  11.979
  437   1HE2  GLN  52          1HE2      GLN  52 -24.687   8.449  13.158
  438   2HE2  GLN  52          2HE2      GLN  52 -24.795   9.000  14.760
  Start of MODEL   17
    1   1H    SER   1          1H        SER   1  -6.659   1.188 -15.893
    2   2H    SER   1          2H        SER   1  -5.279   0.929 -16.849
    3   3H    SER   1          3H        SER   1  -5.267   0.504 -15.204
    4    HA   SER   1           HA       SER   1  -6.877  -0.786 -17.351
    5   1HB   SER   1          2HB       SER   1  -4.579  -1.704 -15.593
    6   2HB   SER   1          1HB       SER   1  -5.368  -2.667 -16.839
    7    HG   SER   1           HG       SER   1  -3.331  -1.379 -17.322
    8    H    ILE   2           H        ILE   2  -5.751  -1.370 -13.995
    9    HA   ILE   2           HA       ILE   2  -8.568  -2.128 -13.289
   10    HB   ILE   2           HB       ILE   2  -7.243  -4.127 -13.546
   11   1HG1  ILE   2          2HG1      ILE   2  -6.884  -3.916 -10.625
   12   2HG1  ILE   2          1HG1      ILE   2  -8.488  -3.446 -11.190
   13   1HG2  ILE   2          1HG2      ILE   2  -5.162  -3.965 -11.704
   14   2HG2  ILE   2          2HG2      ILE   2  -5.153  -2.382 -12.481
   15   3HG2  ILE   2          3HG2      ILE   2  -5.001  -3.843 -13.456
   16   1HD1  ILE   2          1HD1      ILE   2  -7.538  -6.067 -10.814
   17   2HD1  ILE   2          2HD1      ILE   2  -7.588  -5.835 -12.561
   18   3HD1  ILE   2          3HD1      ILE   2  -9.045  -5.590 -11.598
   19    H    SER   3           H        SER   3  -9.285  -0.680 -11.769
   20    HA   SER   3           HA       SER   3  -7.425   0.099  -9.565
   21   1HB   SER   3          2HB       SER   3  -9.222   2.141 -10.829
   22   2HB   SER   3          1HB       SER   3  -7.685   2.373 -10.002
   23    HG   SER   3           HG       SER   3  -7.311   2.601 -12.178
   24    HA   PRO   4           HA       PRO   4 -10.982  -0.494  -7.062
   25   1HB   PRO   4          2HB       PRO   4 -10.532   1.304  -5.050
   26   2HB   PRO   4          1HB       PRO   4  -9.595  -0.193  -5.235
   27   1HG   PRO   4          2HG       PRO   4  -8.870   2.595  -5.966
   28   2HG   PRO   4          1HG       PRO   4  -7.858   1.296  -5.318
   29   1HD   PRO   4          2HD       PRO   4  -7.904   2.044  -7.958
   30   2HD   PRO   4          1HD       PRO   4  -7.426   0.432  -7.382
   31    H    ARG   5           H        ARG   5 -13.046   0.213  -7.462
   32    HA   ARG   5           HA       ARG   5 -13.521   3.167  -7.707
   33   1HB   ARG   5          2HB       ARG   5 -14.384   0.827  -9.412
   34   2HB   ARG   5          1HB       ARG   5 -15.279   2.347  -9.437
   35   1HG   ARG   5          2HG       ARG   5 -12.296   2.142  -9.921
   36   2HG   ARG   5          1HG       ARG   5 -13.499   2.189 -11.210
   37   1HD   ARG   5          2HD       ARG   5 -14.342   4.353  -9.944
   38   2HD   ARG   5          1HD       ARG   5 -12.685   4.365  -9.307
   39    HE   ARG   5           HE       ARG   5 -12.411   3.872 -12.046
   40   1HH1  ARG   5          1HH2      ARG   5 -13.288   6.352  -9.847
   41   2HH1  ARG   5          2HH2      ARG   5 -13.233   7.617 -11.029
   42   1HH2  ARG   5          1HH1      ARG   5 -12.549   5.476 -13.672
   43   2HH2  ARG   5          2HH1      ARG   5 -12.816   7.121 -13.197
   44    H    THR   6           H        THR   6 -15.233   3.880  -6.447
   45    HA   THR   6           HA       THR   6 -17.400   2.048  -5.695
   46    HB   THR   6           HB       THR   6 -15.152   2.844  -3.889
   47    HG1  THR   6           HG1      THR   6 -16.758   0.528  -3.906
   48   1HG2  THR   6          1HG2      THR   6 -17.056   3.776  -2.710
   49   2HG2  THR   6          2HG2      THR   6 -16.620   2.254  -1.933
   50   3HG2  THR   6          3HG2      THR   6 -18.008   2.324  -3.019
   51    HA   PRO   7           HA       PRO   7 -18.454   6.271  -3.745
   52   1HB   PRO   7          2HB       PRO   7 -16.555   8.249  -3.798
   53   2HB   PRO   7          1HB       PRO   7 -16.755   7.095  -2.465
   54   1HG   PRO   7          2HG       PRO   7 -14.801   7.065  -4.714
   55   2HG   PRO   7          1HG       PRO   7 -14.564   6.665  -3.006
   56   1HD   PRO   7          2HD       PRO   7 -14.847   4.761  -4.908
   57   2HD   PRO   7          1HD       PRO   7 -15.412   4.538  -3.238
   58    HA   PRO   8           HA       PRO   8 -17.880   8.727  -7.752
   59   1HB   PRO   8          2HB       PRO   8 -16.563   7.556  -9.836
   60   2HB   PRO   8          1HB       PRO   8 -15.743   8.535  -8.606
   61   1HG   PRO   8          2HG       PRO   8 -15.734   5.626  -8.997
   62   2HG   PRO   8          1HG       PRO   8 -14.547   6.665  -8.199
   63   1HD   PRO   8          2HD       PRO   8 -16.511   5.033  -6.975
   64   2HD   PRO   8          1HD       PRO   8 -15.416   6.179  -6.183
   65    H    ASN   9           H        ASN   9 -19.610   8.721  -9.199
   66    HA   ASN   9           HA       ASN   9 -21.534   7.886 -10.283
   67   1HB   ASN   9          2HB       ASN   9 -20.945   6.519 -12.059
   68   2HB   ASN   9          1HB       ASN   9 -19.356   7.106 -11.575
   69   1HD2  ASN   9          1HD2      ASN   9 -17.834   5.468 -11.337
   70   2HD2  ASN   9          2HD2      ASN   9 -18.186   3.855 -10.943
   71    H    CYS  10           H        CYS  10 -23.049   5.992 -10.400
   72    HA   CYS  10           HA       CYS  10 -23.322   4.787  -7.733
   73   1HB   CYS  10          2HB       CYS  10 -25.267   5.697  -8.920
   74   2HB   CYS  10          1HB       CYS  10 -24.918   4.716 -10.308
   75    H    ALA  11           H        ALA  11 -22.826   2.608  -7.266
   76    HA   ALA  11           HA       ALA  11 -21.464   1.115  -9.372
   77   1HB   ALA  11          1HB       ALA  11 -20.606   1.202  -7.070
   78   2HB   ALA  11          2HB       ALA  11 -20.968  -0.460  -7.536
   79   3HB   ALA  11          3HB       ALA  11 -22.082   0.426  -6.494
   80    H    ARG  12           H        ARG  12 -24.587   1.097  -7.882
   81    HA   ARG  12           HA       ARG  12 -25.447  -1.570  -8.412
   82   1HB   ARG  12          2HB       ARG  12 -26.565   0.257  -7.099
   83   2HB   ARG  12          1HB       ARG  12 -26.939   1.063  -8.613
   84   1HG   ARG  12          2HG       ARG  12 -28.804  -0.151  -8.718
   85   2HG   ARG  12          1HG       ARG  12 -27.792  -1.571  -8.981
   86   1HD   ARG  12          2HD       ARG  12 -28.865  -0.529  -6.338
   87   2HD   ARG  12          1HD       ARG  12 -29.154  -2.115  -7.081
   88    HE   ARG  12           HE       ARG  12 -26.481  -2.202  -6.900
   89   1HH1  ARG  12          1HH2      ARG  12 -28.320  -3.339  -4.722
   90   2HH1  ARG  12          2HH2      ARG  12 -27.600  -2.660  -3.301
   91   1HH2  ARG  12          1HH1      ARG  12 -25.747  -0.304  -5.046
   92   2HH2  ARG  12          2HH1      ARG  12 -26.141  -0.943  -3.485
   93    H    CYS  13           H        CYS  13 -25.643   1.354 -10.387
   94    HA   CYS  13           HA       CYS  13 -26.669  -0.181 -12.663
   95   1HB   CYS  13          2HB       CYS  13 -26.766   2.107 -13.675
   96   2HB   CYS  13          1HB       CYS  13 -27.502   2.044 -12.093
   97    H    ARG  14           H        ARG  14 -23.394   0.834 -11.656
   98    HA   ARG  14           HA       ARG  14 -22.303   0.837 -14.360
   99   1HB   ARG  14          2HB       ARG  14 -20.126   0.408 -13.146
  100   2HB   ARG  14          1HB       ARG  14 -21.025   1.799 -12.544
  101   1HG   ARG  14          2HG       ARG  14 -20.279   0.556 -10.630
  102   2HG   ARG  14          1HG       ARG  14 -22.001   0.300 -10.794
  103   1HD   ARG  14          2HD       ARG  14 -21.714  -1.926 -10.922
  104   2HD   ARG  14          1HD       ARG  14 -20.557  -1.736 -12.254
  105    HE   ARG  14           HE       ARG  14 -19.445  -0.968  -9.667
  106   1HH1  ARG  14          1HH2      ARG  14 -20.636  -3.901 -10.703
  107   2HH1  ARG  14          2HH2      ARG  14 -19.128  -4.751 -10.640
  108   1HH2  ARG  14          1HH1      ARG  14 -17.237  -1.897 -10.090
  109   2HH2  ARG  14          2HH1      ARG  14 -17.205  -3.616 -10.294
  110    H    ASN  15           H        ASN  15 -23.144  -1.638 -12.091
  111    HA   ASN  15           HA       ASN  15 -21.629  -3.836 -12.767
  112   1HB   ASN  15          2HB       ASN  15 -24.561  -3.423 -12.203
  113   2HB   ASN  15          1HB       ASN  15 -23.872  -5.036 -12.311
  114   1HD2  ASN  15          1HD2      ASN  15 -24.715  -2.804 -10.108
  115   2HD2  ASN  15          2HD2      ASN  15 -23.518  -3.017  -8.932
  116    H    HIS  16           H        HIS  16 -24.243  -2.368 -14.525
  117    HA   HIS  16           HA       HIS  16 -24.080  -4.383 -16.699
  118   1HB   HIS  16          2HB       HIS  16 -25.986  -2.137 -15.993
  119   2HB   HIS  16          1HB       HIS  16 -26.240  -3.308 -17.268
  120    HD1  HIS  16           HD1      HIS  16 -27.054  -5.626 -16.647
  121    HD2  HIS  16           HD2      HIS  16 -25.907  -3.329 -13.366
  122    HE1  HIS  16           HE1      HIS  16 -27.709  -6.954 -14.578
  123    H    GLY  17           H        GLY  17 -22.948  -1.227 -15.946
  124   1HA   GLY  17          2HA       GLY  17 -21.258  -0.328 -17.565
  125   2HA   GLY  17          1HA       GLY  17 -22.379  -0.774 -18.854
  126    H    LEU  18           H        LEU  18 -23.434   0.648 -15.837
  127    HA   LEU  18           HA       LEU  18 -24.435   2.999 -17.376
  128   1HB   LEU  18          2HB       LEU  18 -25.618   1.219 -15.663
  129   2HB   LEU  18          1HB       LEU  18 -25.224   2.541 -14.564
  130    HG   LEU  18           HG       LEU  18 -27.478   2.804 -15.572
  131   1HD1  LEU  18          1HD1      LEU  18 -25.993   4.965 -16.917
  132   2HD1  LEU  18          2HD1      LEU  18 -25.537   4.699 -15.235
  133   3HD1  LEU  18          3HD1      LEU  18 -27.215   5.056 -15.647
  134   1HD2  LEU  18          1HD2      LEU  18 -26.637   3.631 -18.198
  135   2HD2  LEU  18          2HD2      LEU  18 -27.801   2.380 -17.762
  136   3HD2  LEU  18          3HD2      LEU  18 -26.089   1.980 -17.910
  137    H    LYS  19           H        LYS  19 -24.105   5.138 -16.459
  138    HA   LYS  19           HA       LYS  19 -22.208   5.439 -14.212
  139   1HB   LYS  19          2HB       LYS  19 -21.198   5.182 -16.709
  140   2HB   LYS  19          1HB       LYS  19 -21.534   6.914 -16.714
  141   1HG   LYS  19          2HG       LYS  19 -19.259   6.518 -15.897
  142   2HG   LYS  19          1HG       LYS  19 -20.264   7.145 -14.589
  143   1HD   LYS  19          2HD       LYS  19 -19.525   5.360 -13.400
  144   2HD   LYS  19          1HD       LYS  19 -20.649   4.416 -14.380
  145   1HE   LYS  19          2HE       LYS  19 -18.969   3.485 -15.637
  146   2HE   LYS  19          1HE       LYS  19 -18.003   4.975 -15.624
  147   1HZ   LYS  19          1HZ       LYS  19 -16.946   3.352 -14.219
  148   2HZ   LYS  19          2HZ       LYS  19 -18.387   3.093 -13.355
  149   3HZ   LYS  19          3HZ       LYS  19 -17.582   4.584 -13.243
  150    H    ILE  20           H        ILE  20 -23.964   6.495 -13.210
  151    HA   ILE  20           HA       ILE  20 -25.059   8.926 -14.529
  152    HB   ILE  20           HB       ILE  20 -26.989   8.362 -13.450
  153   1HG1  ILE  20          2HG1      ILE  20 -25.734   8.964 -11.226
  154   2HG1  ILE  20          1HG1      ILE  20 -27.278   8.164 -11.231
  155   1HG2  ILE  20          1HG2      ILE  20 -25.595   5.788 -12.824
  156   2HG2  ILE  20          2HG2      ILE  20 -26.193   6.235 -14.416
  157   3HG2  ILE  20          3HG2      ILE  20 -27.321   6.039 -13.079
  158   1HD1  ILE  20          1HD1      ILE  20 -26.203   5.990 -11.061
  159   2HD1  ILE  20          2HD1      ILE  20 -25.710   7.048  -9.749
  160   3HD1  ILE  20          3HD1      ILE  20 -24.621   6.767 -11.099
  161    H    THR  21           H        THR  21 -22.619   8.144 -12.364
  162    HA   THR  21           HA       THR  21 -21.211   9.640 -11.126
  163    HB   THR  21           HB       THR  21 -23.386  11.712 -11.251
  164    HG1  THR  21           HG1      THR  21 -22.315  12.265 -13.315
  165   1HG2  THR  21          1HG2      THR  21 -20.362  11.818 -11.433
  166   2HG2  THR  21          2HG2      THR  21 -21.319  12.191 -10.000
  167   3HG2  THR  21          3HG2      THR  21 -21.435  13.217 -11.430
  168    H    LEU  22           H        LEU  22 -24.200   8.468 -10.391
  169    HA   LEU  22           HA       LEU  22 -25.403   8.039  -8.397
  170   1HB   LEU  22          2HB       LEU  22 -23.513   6.819  -7.787
  171   2HB   LEU  22          1HB       LEU  22 -22.493   8.251  -7.688
  172    HG   LEU  22           HG       LEU  22 -23.590   8.954  -5.636
  173   1HD1  LEU  22          1HD1      LEU  22 -25.270   6.445  -5.743
  174   2HD1  LEU  22          2HD1      LEU  22 -25.847   7.963  -6.430
  175   3HD1  LEU  22          3HD1      LEU  22 -25.479   7.858  -4.709
  176   1HD2  LEU  22          1HD2      LEU  22 -21.784   7.170  -5.581
  177   2HD2  LEU  22          2HD2      LEU  22 -23.075   5.977  -5.434
  178   3HD2  LEU  22          3HD2      LEU  22 -22.850   7.193  -4.176
  179    H    LYS  23           H        LYS  23 -24.689  11.030  -9.227
  180    HA   LYS  23           HA       LYS  23 -24.875  12.425  -6.656
  181   1HB   LYS  23          2HB       LYS  23 -24.005  13.032  -9.186
  182   2HB   LYS  23          1HB       LYS  23 -25.591  13.801  -9.181
  183   1HG   LYS  23          2HG       LYS  23 -24.972  14.908  -7.008
  184   2HG   LYS  23          1HG       LYS  23 -23.342  14.261  -7.204
  185   1HD   LYS  23          2HD       LYS  23 -22.859  16.080  -8.442
  186   2HD   LYS  23          1HD       LYS  23 -23.948  15.442  -9.675
  187   1HE   LYS  23          2HE       LYS  23 -25.258  17.261  -9.335
  188   2HE   LYS  23          1HE       LYS  23 -25.621  16.618  -7.720
  189   1HZ   LYS  23          1HZ       LYS  23 -23.276  17.553  -7.178
  190   2HZ   LYS  23          2HZ       LYS  23 -24.611  18.604  -7.200
  191   3HZ   LYS  23          3HZ       LYS  23 -23.549  18.547  -8.525
  192    H    GLY  24           H        GLY  24 -26.849  12.309  -5.556
  193   1HA   GLY  24          2HA       GLY  24 -29.191  12.121  -5.253
  194   2HA   GLY  24          1HA       GLY  24 -29.276  13.341  -6.533
  195    H    HIS  25           H        HIS  25 -28.510   9.873  -6.232
  196    HA   HIS  25           HA       HIS  25 -30.076   9.392  -8.746
  197   1HB   HIS  25          2HB       HIS  25 -27.686   9.303  -9.060
  198   2HB   HIS  25          1HB       HIS  25 -27.491   8.275  -7.647
  199    HD1  HIS  25           HD1      HIS  25 -29.510   8.073 -10.902
  200    HD2  HIS  25           HD2      HIS  25 -27.080   5.698  -8.493
  201    HE1  HIS  25           HE1      HIS  25 -29.100   5.906 -12.150
  202    H    LYS  26           H        LYS  26 -28.582   6.753  -7.090
  203    HA   LYS  26           HA       LYS  26 -29.579   4.800  -6.223
  204   1HB   LYS  26          2HB       LYS  26 -30.759   7.151  -4.725
  205   2HB   LYS  26          1HB       LYS  26 -31.100   5.489  -4.241
  206   1HG   LYS  26          2HG       LYS  26 -28.930   5.097  -3.552
  207   2HG   LYS  26          1HG       LYS  26 -28.246   6.250  -4.700
  208   1HD   LYS  26          2HD       LYS  26 -29.222   8.111  -3.347
  209   2HD   LYS  26          1HD       LYS  26 -29.765   6.921  -2.162
  210   1HE   LYS  26          2HE       LYS  26 -27.724   6.996  -1.187
  211   2HE   LYS  26          1HE       LYS  26 -26.995   6.421  -2.699
  212   1HZ   LYS  26          1HZ       LYS  26 -27.339   8.809  -3.494
  213   2HZ   LYS  26          2HZ       LYS  26 -26.067   8.525  -2.405
  214   3HZ   LYS  26          3HZ       LYS  26 -27.523   9.206  -1.856
  215    H    ARG  27           H        ARG  27 -32.538   6.550  -5.546
  216    HA   ARG  27           HA       ARG  27 -34.312   4.741  -6.724
  217   1HB   ARG  27          2HB       ARG  27 -34.632   6.899  -5.281
  218   2HB   ARG  27          1HB       ARG  27 -34.749   7.725  -6.834
  219   1HG   ARG  27          2HG       ARG  27 -36.888   7.061  -7.029
  220   2HG   ARG  27          1HG       ARG  27 -36.368   5.376  -6.968
  221   1HD   ARG  27          2HD       ARG  27 -37.714   5.413  -5.075
  222   2HD   ARG  27          1HD       ARG  27 -36.194   5.957  -4.338
  223    HE   ARG  27           HE       ARG  27 -37.215   8.315  -5.217
  224   1HH1  ARG  27          1HH2      ARG  27 -37.556   6.772  -2.419
  225   2HH1  ARG  27          2HH2      ARG  27 -39.186   7.242  -2.073
  226   1HH2  ARG  27          1HH1      ARG  27 -39.792   8.459  -5.264
  227   2HH2  ARG  27          2HH1      ARG  27 -40.453   8.195  -3.685
  228    H    TYR  28           H        TYR  28 -32.314   7.172  -8.255
  229    HA   TYR  28           HA       TYR  28 -33.697   6.988 -10.856
  230   1HB   TYR  28          2HB       TYR  28 -31.187   8.358  -9.831
  231   2HB   TYR  28          1HB       TYR  28 -31.792   8.533 -11.480
  232    HD1  TYR  28           HD1      TYR  28 -31.739  10.146  -8.440
  233    HD2  TYR  28           HD2      TYR  28 -34.543   8.905 -11.450
  234    HE1  TYR  28           HE1      TYR  28 -33.323  11.896  -7.685
  235    HE2  TYR  28           HE2      TYR  28 -36.127  10.657 -10.693
  236    HH   TYR  28           HH       TYR  28 -36.006  12.132  -7.838
  237    H    CYS  29           H        CYS  29 -32.120   4.695  -9.402
  238    HA   CYS  29           HA       CYS  29 -30.024   4.132 -11.425
  239   1HB   CYS  29          2HB       CYS  29 -29.767   3.889  -8.896
  240   2HB   CYS  29          1HB       CYS  29 -30.875   2.525  -9.004
  241    H    LYS  30           H        LYS  30 -30.738   3.056 -13.264
  242    HA   LYS  30           HA       LYS  30 -33.194   1.636 -13.517
  243   1HB   LYS  30          2HB       LYS  30 -31.028   2.321 -15.105
  244   2HB   LYS  30          1HB       LYS  30 -30.908   0.562 -15.035
  245   1HG   LYS  30          2HG       LYS  30 -33.589   0.873 -15.431
  246   2HG   LYS  30          1HG       LYS  30 -32.960   2.259 -16.322
  247   1HD   LYS  30          2HD       LYS  30 -31.840  -0.528 -16.669
  248   2HD   LYS  30          1HD       LYS  30 -33.171   0.084 -17.650
  249   1HE   LYS  30          2HE       LYS  30 -30.594   1.645 -17.382
  250   2HE   LYS  30          1HE       LYS  30 -30.791   0.384 -18.616
  251   1HZ   LYS  30          1HZ       LYS  30 -32.507   1.503 -19.627
  252   2HZ   LYS  30          2HZ       LYS  30 -31.546   2.810 -19.123
  253   3HZ   LYS  30          3HZ       LYS  30 -32.925   2.372 -18.231
  254    H    PHE  31           H        PHE  31 -30.230   0.874 -11.966
  255    HA   PHE  31           HA       PHE  31 -30.906  -2.016 -11.642
  256   1HB   PHE  31          2HB       PHE  31 -28.380  -0.385 -11.127
  257   2HB   PHE  31          1HB       PHE  31 -28.457  -2.154 -11.158
  258    HD1  PHE  31           HD1      PHE  31 -28.765   0.930 -13.178
  259    HD2  PHE  31           HD2      PHE  31 -28.661  -3.360 -13.244
  260    HE1  PHE  31           HE1      PHE  31 -28.569   0.978 -15.641
  261    HE2  PHE  31           HE2      PHE  31 -28.460  -3.318 -15.708
  262    HZ   PHE  31           HZ       PHE  31 -28.410  -1.150 -16.917
  263    H    ARG  32           H        ARG  32 -31.708   0.735 -10.176
  264    HA   ARG  32           HA       ARG  32 -30.884   0.896  -7.558
  265   1HB   ARG  32          2HB       ARG  32 -32.946   1.992  -7.165
  266   2HB   ARG  32          1HB       ARG  32 -32.691   2.185  -8.893
  267   1HG   ARG  32          2HG       ARG  32 -34.272  -0.167  -7.853
  268   2HG   ARG  32          1HG       ARG  32 -35.034   1.405  -8.041
  269   1HD   ARG  32          2HD       ARG  32 -33.451   0.267 -10.337
  270   2HD   ARG  32          1HD       ARG  32 -35.114  -0.274 -10.054
  271    HE   ARG  32           HE       ARG  32 -35.171   2.525  -9.818
  272   1HH1  ARG  32          1HH2      ARG  32 -36.236   0.363 -11.955
  273   2HH1  ARG  32          2HH2      ARG  32 -35.883   1.255 -13.397
  274   1HH2  ARG  32          1HH1      ARG  32 -33.907   3.601 -11.777
  275   2HH2  ARG  32          2HH1      ARG  32 -34.561   3.090 -13.296
  276    H    TYR  33           H        TYR  33 -32.871  -1.587  -8.982
  277    HA   TYR  33           HA       TYR  33 -32.878  -3.001  -6.333
  278   1HB   TYR  33          2HB       TYR  33 -35.062  -2.561  -8.371
  279   2HB   TYR  33          1HB       TYR  33 -35.166  -3.850  -7.169
  280    HD1  TYR  33           HD1      TYR  33 -36.611  -0.923  -7.673
  281    HD2  TYR  33           HD2      TYR  33 -33.894  -2.632  -4.819
  282    HE1  TYR  33           HE1      TYR  33 -37.358   0.722  -5.975
  283    HE2  TYR  33           HE2      TYR  33 -34.640  -0.988  -3.121
  284    HH   TYR  33           HH       TYR  33 -36.645   1.717  -3.942
  285    H    CYS  34           H        CYS  34 -31.523  -3.141  -9.272
  286    HA   CYS  34           HA       CYS  34 -32.100  -5.616 -10.454
  287   1HB   CYS  34          2HB       CYS  34 -30.419  -3.878 -11.204
  288   2HB   CYS  34          1HB       CYS  34 -29.356  -4.444  -9.915
  289    H    THR  35           H        THR  35 -30.719  -7.664 -10.202
  290    HA   THR  35           HA       THR  35 -29.805  -8.123  -7.398
  291    HB   THR  35           HB       THR  35 -31.212 -10.424  -8.075
  292    HG1  THR  35           HG1      THR  35 -33.004  -8.366  -8.602
  293   1HG2  THR  35          1HG2      THR  35 -31.125  -8.739  -5.992
  294   2HG2  THR  35          2HG2      THR  35 -32.419  -9.922  -6.186
  295   3HG2  THR  35          3HG2      THR  35 -32.677  -8.246  -6.669
  296    H    CYS  36           H        CYS  36 -29.015  -8.276 -10.591
  297    HA   CYS  36           HA       CYS  36 -28.053 -10.832 -11.175
  298   1HB   CYS  36          2HB       CYS  36 -26.521  -9.695 -12.640
  299   2HB   CYS  36          1HB       CYS  36 -27.979  -8.706 -12.553
  300    H    GLU  37           H        GLU  37 -25.513 -11.365 -11.085
  301    HA   GLU  37           HA       GLU  37 -24.817 -11.447  -8.239
  302   1HB   GLU  37          2HB       GLU  37 -24.555 -13.172 -10.240
  303   2HB   GLU  37          1HB       GLU  37 -23.006 -12.351 -10.445
  304   1HG   GLU  37          2HG       GLU  37 -22.296 -12.913  -8.245
  305   2HG   GLU  37          1HG       GLU  37 -23.924 -13.384  -7.759
  306    H    LYS  38           H        LYS  38 -24.323  -9.096 -10.548
  307    HA   LYS  38           HA       LYS  38 -21.608  -8.335  -9.549
  308   1HB   LYS  38          2HB       LYS  38 -23.271  -7.069 -11.748
  309   2HB   LYS  38          1HB       LYS  38 -21.525  -6.967 -11.523
  310   1HG   LYS  38          2HG       LYS  38 -21.397  -9.449 -11.894
  311   2HG   LYS  38          1HG       LYS  38 -23.116  -9.429 -12.292
  312   1HD   LYS  38          2HD       LYS  38 -22.512  -8.956 -14.413
  313   2HD   LYS  38          1HD       LYS  38 -22.025  -7.364 -13.829
  314   1HE   LYS  38          2HE       LYS  38 -19.792  -7.877 -13.913
  315   2HE   LYS  38          1HE       LYS  38 -20.060  -9.550 -13.382
  316   1HZ   LYS  38          1HZ       LYS  38 -21.132  -9.949 -15.573
  317   2HZ   LYS  38          2HZ       LYS  38 -19.472  -9.611 -15.679
  318   3HZ   LYS  38          3HZ       LYS  38 -20.611  -8.413 -16.070
  319    H    CYS  39           H        CYS  39 -24.942  -7.650  -9.277
  320    HA   CYS  39           HA       CYS  39 -24.589  -4.905  -8.243
  321   1HB   CYS  39          2HB       CYS  39 -26.739  -6.741  -9.150
  322   2HB   CYS  39          1HB       CYS  39 -27.187  -5.681  -7.830
  323    H    ARG  40           H        ARG  40 -25.346  -8.212  -7.231
  324    HA   ARG  40           HA       ARG  40 -25.750  -7.565  -4.423
  325   1HB   ARG  40          2HB       ARG  40 -25.201 -10.116  -5.975
  326   2HB   ARG  40          1HB       ARG  40 -25.601 -10.087  -4.257
  327   1HG   ARG  40          2HG       ARG  40 -27.770  -9.171  -4.682
  328   2HG   ARG  40          1HG       ARG  40 -27.363  -8.817  -6.362
  329   1HD   ARG  40          2HD       ARG  40 -28.728 -10.845  -6.310
  330   2HD   ARG  40          1HD       ARG  40 -27.066 -11.311  -6.724
  331    HE   ARG  40           HE       ARG  40 -27.100 -11.399  -3.954
  332   1HH1  ARG  40          1HH2      ARG  40 -27.614 -13.477  -6.458
  333   2HH1  ARG  40          2HH2      ARG  40 -28.627 -14.590  -5.600
  334   1HH2  ARG  40          1HH1      ARG  40 -29.002 -12.531  -2.837
  335   2HH2  ARG  40          2HH1      ARG  40 -29.412 -14.055  -3.551
  336    H    LEU  41           H        LEU  41 -23.116  -8.625  -6.494
  337    HA   LEU  41           HA       LEU  41 -21.176  -9.164  -4.436
  338   1HB   LEU  41          2HB       LEU  41 -20.509 -10.060  -6.447
  339   2HB   LEU  41          1HB       LEU  41 -21.339  -8.815  -7.374
  340    HG   LEU  41           HG       LEU  41 -19.541  -7.247  -7.016
  341   1HD1  LEU  41          1HD1      LEU  41 -17.580  -8.895  -5.727
  342   2HD1  LEU  41          2HD1      LEU  41 -19.038  -8.879  -4.735
  343   3HD1  LEU  41          3HD1      LEU  41 -18.254  -7.362  -5.175
  344   1HD2  LEU  41          1HD2      LEU  41 -17.918  -8.247  -8.370
  345   2HD2  LEU  41          2HD2      LEU  41 -19.323  -9.269  -8.680
  346   3HD2  LEU  41          3HD2      LEU  41 -18.067  -9.810  -7.565
  347    H    THR  42           H        THR  42 -22.194  -6.296  -6.176
  348    HA   THR  42           HA       THR  42 -20.065  -4.568  -5.190
  349    HB   THR  42           HB       THR  42 -22.783  -4.063  -6.414
  350    HG1  THR  42           HG1      THR  42 -20.172  -4.151  -7.521
  351   1HG2  THR  42          1HG2      THR  42 -20.442  -2.165  -6.425
  352   2HG2  THR  42          2HG2      THR  42 -21.613  -2.157  -5.107
  353   3HG2  THR  42          3HG2      THR  42 -22.138  -1.817  -6.757
  354    H    ALA  43           H        ALA  43 -23.557  -4.251  -4.722
  355    HA   ALA  43           HA       ALA  43 -23.663  -2.633  -2.485
  356   1HB   ALA  43          1HB       ALA  43 -25.406  -4.159  -3.940
  357   2HB   ALA  43          2HB       ALA  43 -25.859  -3.314  -2.460
  358   3HB   ALA  43          3HB       ALA  43 -25.423  -5.022  -2.403
  359    H    ASP  44           H        ASP  44 -22.719  -5.997  -2.674
  360    HA   ASP  44           HA       ASP  44 -22.674  -6.453   0.218
  361   1HB   ASP  44          2HB       ASP  44 -23.123  -8.210  -1.449
  362   2HB   ASP  44          1HB       ASP  44 -21.541  -7.934  -2.179
  363    H    ARG  45           H        ARG  45 -20.316  -5.776  -2.364
  364    HA   ARG  45           HA       ARG  45 -17.912  -6.057  -0.894
  365   1HB   ARG  45          2HB       ARG  45 -18.641  -5.420  -3.427
  366   2HB   ARG  45          1HB       ARG  45 -18.174  -3.821  -2.843
  367   1HG   ARG  45          2HG       ARG  45 -16.339  -6.084  -2.206
  368   2HG   ARG  45          1HG       ARG  45 -16.385  -5.532  -3.882
  369   1HD   ARG  45          2HD       ARG  45 -15.616  -3.380  -3.331
  370   2HD   ARG  45          1HD       ARG  45 -16.119  -3.532  -1.636
  371    HE   ARG  45           HE       ARG  45 -14.125  -4.739  -1.196
  372   1HH1  ARG  45          1HH2      ARG  45 -13.454  -3.163  -3.902
  373   2HH1  ARG  45          2HH2      ARG  45 -12.502  -4.386  -4.677
  374   1HH2  ARG  45          1HH1      ARG  45 -13.456  -6.895  -2.482
  375   2HH2  ARG  45          2HH1      ARG  45 -12.503  -6.498  -3.874
  376    H    GLN  46           H        GLN  46 -20.359  -3.560  -0.804
  377    HA   GLN  46           HA       GLN  46 -18.600  -1.719   0.732
  378   1HB   GLN  46          2HB       GLN  46 -20.956  -1.590  -0.977
  379   2HB   GLN  46          1HB       GLN  46 -21.202  -0.693   0.522
  380   1HG   GLN  46          2HG       GLN  46 -18.549  -0.172  -0.440
  381   2HG   GLN  46          1HG       GLN  46 -19.695   0.104  -1.753
  382   1HE2  GLN  46          1HE2      GLN  46 -19.748   0.698   1.818
  383   2HE2  GLN  46          2HE2      GLN  46 -20.282   2.304   1.684
  384    H    ARG  47           H        ARG  47 -21.458  -3.778   1.117
  385    HA   ARG  47           HA       ARG  47 -22.434  -2.938   3.610
  386   1HB   ARG  47          2HB       ARG  47 -22.991  -4.898   1.853
  387   2HB   ARG  47          1HB       ARG  47 -22.157  -5.860   3.075
  388   1HG   ARG  47          2HG       ARG  47 -24.169  -5.931   4.121
  389   2HG   ARG  47          1HG       ARG  47 -23.800  -4.278   4.616
  390   1HD   ARG  47          2HD       ARG  47 -25.061  -3.350   2.795
  391   2HD   ARG  47          1HD       ARG  47 -25.207  -4.935   2.009
  392    HE   ARG  47           HE       ARG  47 -26.366  -4.475   4.728
  393   1HH1  ARG  47          1HH2      ARG  47 -26.273  -6.754   2.371
  394   2HH1  ARG  47          2HH2      ARG  47 -27.982  -6.857   2.104
  395   1HH2  ARG  47          1HH1      ARG  47 -28.712  -4.038   3.988
  396   2HH2  ARG  47          2HH1      ARG  47 -29.363  -5.318   3.017
  397    H    VAL  48           H        VAL  48 -20.797  -2.331   5.099
  398    HA   VAL  48           HA       VAL  48 -19.211  -4.610   6.223
  399    HB   VAL  48           HB       VAL  48 -17.349  -2.913   6.479
  400   1HG1  VAL  48          1HG1      VAL  48 -18.136  -4.416   4.252
  401   2HG1  VAL  48          2HG1      VAL  48 -16.537  -3.727   4.539
  402   3HG1  VAL  48          3HG1      VAL  48 -17.727  -2.830   3.595
  403   1HG2  VAL  48          1HG2      VAL  48 -19.432  -1.153   5.694
  404   2HG2  VAL  48          2HG2      VAL  48 -18.254  -1.159   4.381
  405   3HG2  VAL  48          3HG2      VAL  48 -17.747  -0.745   6.018
  406    H    MET  49           H        MET  49 -21.538  -4.007   7.451
  407    HA   MET  49           HA       MET  49 -20.872  -2.088   9.650
  408   1HB   MET  49          2HB       MET  49 -23.342  -2.998   8.238
  409   2HB   MET  49          1HB       MET  49 -23.495  -2.509   9.926
  410   1HG   MET  49          2HG       MET  49 -21.906  -0.722   8.156
  411   2HG   MET  49          1HG       MET  49 -23.650  -0.744   7.900
  412   1HE   MET  49          1HE       MET  49 -25.437   0.583  10.065
  413   2HE   MET  49          2HE       MET  49 -24.993  -0.482  11.395
  414   3HE   MET  49          3HE       MET  49 -25.115  -1.130   9.762
  415    H    ALA  50           H        ALA  50 -23.386  -4.472   9.954
  416    HA   ALA  50           HA       ALA  50 -21.678  -6.202  11.677
  417   1HB   ALA  50          1HB       ALA  50 -23.819  -5.933  13.279
  418   2HB   ALA  50          2HB       ALA  50 -23.900  -4.371  12.463
  419   3HB   ALA  50          3HB       ALA  50 -22.450  -4.824  13.361
  420    H    LEU  51           H        LEU  51 -25.216  -5.879  11.326
  421    HA   LEU  51           HA       LEU  51 -25.417  -8.764  10.733
  422   1HB   LEU  51          2HB       LEU  51 -27.367  -6.497  11.216
  423   2HB   LEU  51          1HB       LEU  51 -27.893  -8.139  10.846
  424    HG   LEU  51           HG       LEU  51 -26.068  -8.610  12.826
  425   1HD1  LEU  51          1HD1      LEU  51 -26.431  -6.969  14.596
  426   2HD1  LEU  51          2HD1      LEU  51 -27.515  -6.046  13.554
  427   3HD1  LEU  51          3HD1      LEU  51 -25.797  -6.151  13.168
  428   1HD2  LEU  51          1HD2      LEU  51 -27.988  -9.041  14.235
  429   2HD2  LEU  51          2HD2      LEU  51 -28.451  -9.422  12.577
  430   3HD2  LEU  51          3HD2      LEU  51 -28.979  -7.910  13.313
  431    H    GLN  52           H        GLN  52 -26.180  -9.607   8.761
  432    HA   GLN  52           HA       GLN  52 -26.776  -7.684   6.555
  433   1HB   GLN  52          2HB       GLN  52 -24.391  -8.194   6.454
  434   2HB   GLN  52          1HB       GLN  52 -24.726  -9.922   6.574
  435   1HG   GLN  52          2HG       GLN  52 -25.793  -9.952   4.423
  436   2HG   GLN  52          1HG       GLN  52 -25.793  -8.191   4.332
  437   1HE2  GLN  52          1HE2      GLN  52 -24.582  -8.902   2.185
  438   2HE2  GLN  52          2HE2      GLN  52 -22.892  -9.010   2.301
  Start of MODEL   18
    1   1H    SER   1          1H        SER   1 -11.654   5.954 -25.648
    2   2H    SER   1          2H        SER   1 -12.180   4.825 -26.803
    3   3H    SER   1          3H        SER   1 -12.175   4.418 -25.153
    4    HA   SER   1           HA       SER   1 -14.029   6.189 -26.618
    5   1HB   SER   1          2HB       SER   1 -14.191   3.633 -26.034
    6   2HB   SER   1          1HB       SER   1 -14.555   4.210 -24.410
    7    HG   SER   1           HG       SER   1 -16.095   5.655 -25.709
    8    H    ILE   2           H        ILE   2 -12.747   8.047 -25.458
    9    HA   ILE   2           HA       ILE   2 -12.737   9.695 -23.764
   10    HB   ILE   2           HB       ILE   2 -15.340   8.229 -23.235
   11   1HG1  ILE   2          2HG1      ILE   2 -14.950  10.903 -24.578
   12   2HG1  ILE   2          1HG1      ILE   2 -14.840   9.401 -25.495
   13   1HG2  ILE   2          1HG2      ILE   2 -14.923   9.444 -21.246
   14   2HG2  ILE   2          2HG2      ILE   2 -15.940  10.520 -22.203
   15   3HG2  ILE   2          3HG2      ILE   2 -14.200  10.793 -22.123
   16   1HD1  ILE   2          1HD1      ILE   2 -17.112  10.038 -25.696
   17   2HD1  ILE   2          2HD1      ILE   2 -17.215  10.507 -23.998
   18   3HD1  ILE   2          3HD1      ILE   2 -17.114   8.801 -24.438
   19    H    SER   3           H        SER   3 -12.756   9.921 -21.281
   20    HA   SER   3           HA       SER   3 -11.611   7.429 -20.083
   21   1HB   SER   3          2HB       SER   3 -10.042   8.826 -19.212
   22   2HB   SER   3          1HB       SER   3 -10.664  10.019 -20.348
   23    HG   SER   3           HG       SER   3 -11.291  11.095 -18.667
   24    HA   PRO   4           HA       PRO   4 -14.623   7.320 -16.888
   25   1HB   PRO   4          2HB       PRO   4 -13.237   7.391 -14.527
   26   2HB   PRO   4          1HB       PRO   4 -13.239   5.983 -15.607
   27   1HG   PRO   4          2HG       PRO   4 -11.175   8.092 -15.249
   28   2HG   PRO   4          1HG       PRO   4 -10.981   6.357 -15.548
   29   1HD   PRO   4          2HD       PRO   4 -10.693   8.283 -17.471
   30   2HD   PRO   4          1HD       PRO   4 -11.147   6.600 -17.812
   31    H    ARG   5           H        ARG   5 -14.884   8.502 -14.388
   32    HA   ARG   5           HA       ARG   5 -14.736  11.437 -15.004
   33   1HB   ARG   5          2HB       ARG   5 -16.914   9.605 -14.174
   34   2HB   ARG   5          1HB       ARG   5 -16.882  11.164 -13.347
   35   1HG   ARG   5          2HG       ARG   5 -16.445  11.320 -16.262
   36   2HG   ARG   5          1HG       ARG   5 -18.045  10.745 -15.791
   37   1HD   ARG   5          2HD       ARG   5 -18.630  12.759 -14.812
   38   2HD   ARG   5          1HD       ARG   5 -16.958  13.133 -14.346
   39    HE   ARG   5           HE       ARG   5 -16.901  13.110 -17.124
   40   1HH1  ARG   5          1HH2      ARG   5 -19.612  14.242 -15.547
   41   2HH1  ARG   5          2HH2      ARG   5 -19.483  15.877 -16.104
   42   1HH2  ARG   5          1HH1      ARG   5 -16.330  15.441 -17.478
   43   2HH2  ARG   5          2HH1      ARG   5 -17.624  16.556 -17.194
   44    H    THR   6           H        THR   6 -15.042  12.731 -12.868
   45    HA   THR   6           HA       THR   6 -12.989  11.866 -10.990
   46    HB   THR   6           HB       THR   6 -14.725  14.264 -11.461
   47    HG1  THR   6           HG1      THR   6 -12.417  13.557 -12.243
   48   1HG2  THR   6          1HG2      THR   6 -13.313  15.222  -9.444
   49   2HG2  THR   6          2HG2      THR   6 -13.306  13.537  -8.924
   50   3HG2  THR   6          3HG2      THR   6 -14.837  14.386  -9.143
   51    HA   PRO   7           HA       PRO   7 -16.692  11.806  -7.952
   52   1HB   PRO   7          2HB       PRO   7 -19.214  11.810  -9.008
   53   2HB   PRO   7          1HB       PRO   7 -18.338  13.295  -8.586
   54   1HG   PRO   7          2HG       PRO   7 -18.737  12.027 -11.245
   55   2HG   PRO   7          1HG       PRO   7 -18.727  13.741 -10.801
   56   1HD   PRO   7          2HD       PRO   7 -16.625  12.466 -11.984
   57   2HD   PRO   7          1HD       PRO   7 -16.448  13.893 -10.941
   58    HA   PRO   8           HA       PRO   8 -17.144   7.464  -8.532
   59   1HB   PRO   8          2HB       PRO   8 -18.491   6.876  -6.225
   60   2HB   PRO   8          1HB       PRO   8 -16.766   7.287  -6.254
   61   1HG   PRO   8          2HG       PRO   8 -19.101   8.976  -5.524
   62   2HG   PRO   8          1HG       PRO   8 -17.480   8.920  -4.815
   63   1HD   PRO   8          2HD       PRO   8 -18.320  10.853  -6.563
   64   2HD   PRO   8          1HD       PRO   8 -16.621  10.377  -6.347
   65    H    ASN   9           H        ASN   9 -18.613   6.932 -10.162
   66    HA   ASN   9           HA       ASN   9 -21.408   7.737 -10.152
   67   1HB   ASN   9          2HB       ASN   9 -21.493   6.270 -12.116
   68   2HB   ASN   9          1HB       ASN   9 -20.042   7.272 -12.170
   69   1HD2  ASN   9          1HD2      ASN   9 -17.966   6.221 -11.817
   70   2HD2  ASN   9          2HD2      ASN   9 -17.808   4.531 -11.827
   71    H    CYS  10           H        CYS  10 -23.206   6.325  -9.954
   72    HA   CYS  10           HA       CYS  10 -23.367   4.703  -7.674
   73   1HB   CYS  10          2HB       CYS  10 -25.276   5.639  -8.901
   74   2HB   CYS  10          1HB       CYS  10 -24.890   4.673 -10.287
   75    H    ALA  11           H        ALA  11 -22.787   2.549  -7.269
   76    HA   ALA  11           HA       ALA  11 -21.405   1.119  -9.408
   77   1HB   ALA  11          1HB       ALA  11 -20.823   1.296  -6.878
   78   2HB   ALA  11          2HB       ALA  11 -20.595  -0.257  -7.684
   79   3HB   ALA  11          3HB       ALA  11 -22.023   0.017  -6.684
   80    H    ARG  12           H        ARG  12 -24.528   1.052  -7.930
   81    HA   ARG  12           HA       ARG  12 -25.380  -1.610  -8.487
   82   1HB   ARG  12          2HB       ARG  12 -26.497   0.237  -7.177
   83   2HB   ARG  12          1HB       ARG  12 -26.884   1.014  -8.703
   84   1HG   ARG  12          2HG       ARG  12 -28.771  -0.189  -8.657
   85   2HG   ARG  12          1HG       ARG  12 -27.761  -1.562  -9.109
   86   1HD   ARG  12          2HD       ARG  12 -29.119  -2.119  -7.116
   87   2HD   ARG  12          1HD       ARG  12 -27.401  -2.039  -6.672
   88    HE   ARG  12           HE       ARG  12 -29.042   0.429  -6.397
   89   1HH1  ARG  12          1HH2      ARG  12 -26.186  -0.282  -5.336
   90   2HH1  ARG  12          2HH2      ARG  12 -26.526  -0.403  -3.641
   91   1HH2  ARG  12          1HH1      ARG  12 -29.964  -0.553  -4.074
   92   2HH2  ARG  12          2HH1      ARG  12 -28.666  -0.553  -2.927
   93    H    CYS  13           H        CYS  13 -25.597   1.328 -10.438
   94    HA   CYS  13           HA       CYS  13 -26.586  -0.185 -12.737
   95   1HB   CYS  13          2HB       CYS  13 -26.645   2.114 -13.742
   96   2HB   CYS  13          1HB       CYS  13 -27.424   2.036 -12.180
   97    H    ARG  14           H        ARG  14 -23.315   0.846 -11.706
   98    HA   ARG  14           HA       ARG  14 -22.206   0.839 -14.399
   99   1HB   ARG  14          2HB       ARG  14 -20.039   0.377 -13.176
  100   2HB   ARG  14          1HB       ARG  14 -20.919   1.785 -12.586
  101   1HG   ARG  14          2HG       ARG  14 -20.211   0.547 -10.659
  102   2HG   ARG  14          1HG       ARG  14 -21.932   0.300 -10.841
  103   1HD   ARG  14          2HD       ARG  14 -21.650  -1.928 -10.947
  104   2HD   ARG  14          1HD       ARG  14 -20.502  -1.749 -12.286
  105    HE   ARG  14           HE       ARG  14 -19.649  -1.315  -9.452
  106   1HH1  ARG  14          1HH2      ARG  14 -18.032  -0.976 -12.141
  107   2HH1  ARG  14          2HH2      ARG  14 -17.020  -2.379 -12.035
  108   1HH2  ARG  14          1HH1      ARG  14 -18.875  -3.854  -9.505
  109   2HH2  ARG  14          2HH1      ARG  14 -17.499  -4.007 -10.545
  110    H    ASN  15           H        ASN  15 -23.072  -1.628 -12.134
  111    HA   ASN  15           HA       ASN  15 -21.591  -3.849 -12.801
  112   1HB   ASN  15          2HB       ASN  15 -24.530  -3.416 -12.276
  113   2HB   ASN  15          1HB       ASN  15 -23.825  -5.023 -12.328
  114   1HD2  ASN  15          1HD2      ASN  15 -24.763  -2.803 -10.176
  115   2HD2  ASN  15          2HD2      ASN  15 -23.571  -2.948  -8.983
  116    H    HIS  16           H        HIS  16 -24.195  -2.365 -14.571
  117    HA   HIS  16           HA       HIS  16 -24.013  -4.392 -16.736
  118   1HB   HIS  16          2HB       HIS  16 -25.953  -2.175 -16.034
  119   2HB   HIS  16          1HB       HIS  16 -26.180  -3.333 -17.327
  120    HD1  HIS  16           HD1      HIS  16 -26.958  -5.680 -16.741
  121    HD2  HIS  16           HD2      HIS  16 -25.895  -3.390 -13.428
  122    HE1  HIS  16           HE1      HIS  16 -27.606  -7.043 -14.690
  123    H    GLY  17           H        GLY  17 -22.869  -1.248 -15.995
  124   1HA   GLY  17          2HA       GLY  17 -21.196  -0.357 -17.633
  125   2HA   GLY  17          1HA       GLY  17 -22.335  -0.792 -18.910
  126    H    LEU  18           H        LEU  18 -23.292   0.664 -15.868
  127    HA   LEU  18           HA       LEU  18 -24.292   3.027 -17.399
  128   1HB   LEU  18          2HB       LEU  18 -25.497   1.242 -15.703
  129   2HB   LEU  18          1HB       LEU  18 -25.096   2.555 -14.597
  130    HG   LEU  18           HG       LEU  18 -27.338   2.865 -15.580
  131   1HD1  LEU  18          1HD1      LEU  18 -25.361   4.729 -15.314
  132   2HD1  LEU  18          2HD1      LEU  18 -27.036   5.109 -15.714
  133   3HD1  LEU  18          3HD1      LEU  18 -25.834   4.967 -16.996
  134   1HD2  LEU  18          1HD2      LEU  18 -26.817   3.652 -18.202
  135   2HD2  LEU  18          2HD2      LEU  18 -27.589   2.144 -17.712
  136   3HD2  LEU  18          3HD2      LEU  18 -25.851   2.190 -18.007
  137    H    LYS  19           H        LYS  19 -23.935   5.157 -16.469
  138    HA   LYS  19           HA       LYS  19 -22.046   5.406 -14.205
  139   1HB   LYS  19          2HB       LYS  19 -21.539   6.268 -17.069
  140   2HB   LYS  19          1HB       LYS  19 -20.600   6.882 -15.707
  141   1HG   LYS  19          2HG       LYS  19 -20.898   3.954 -16.446
  142   2HG   LYS  19          1HG       LYS  19 -19.484   4.948 -16.788
  143   1HD   LYS  19          2HD       LYS  19 -19.780   5.404 -14.115
  144   2HD   LYS  19          1HD       LYS  19 -20.369   3.746 -14.230
  145   1HE   LYS  19          2HE       LYS  19 -18.030   3.902 -15.852
  146   2HE   LYS  19          1HE       LYS  19 -17.646   4.651 -14.290
  147   1HZ   LYS  19          1HZ       LYS  19 -19.056   2.637 -13.413
  148   2HZ   LYS  19          2HZ       LYS  19 -17.398   2.462 -13.742
  149   3HZ   LYS  19          3HZ       LYS  19 -18.551   1.922 -14.866
  150    H    ILE  20           H        ILE  20 -23.861   6.427 -13.205
  151    HA   ILE  20           HA       ILE  20 -24.896   8.918 -14.458
  152    HB   ILE  20           HB       ILE  20 -26.856   8.326 -13.462
  153   1HG1  ILE  20          2HG1      ILE  20 -25.679   8.927 -11.195
  154   2HG1  ILE  20          1HG1      ILE  20 -27.221   8.114 -11.248
  155   1HG2  ILE  20          1HG2      ILE  20 -25.485   5.749 -12.792
  156   2HG2  ILE  20          2HG2      ILE  20 -26.038   6.194 -14.400
  157   3HG2  ILE  20          3HG2      ILE  20 -27.203   6.002 -13.094
  158   1HD1  ILE  20          1HD1      ILE  20 -26.150   5.955 -11.043
  159   2HD1  ILE  20          2HD1      ILE  20 -25.661   7.015  -9.731
  160   3HD1  ILE  20          3HD1      ILE  20 -24.569   6.726 -11.075
  161    H    THR  21           H        THR  21 -22.494   8.048 -12.290
  162    HA   THR  21           HA       THR  21 -21.090   9.474 -10.978
  163    HB   THR  21           HB       THR  21 -23.202  11.611 -11.138
  164    HG1  THR  21           HG1      THR  21 -23.098  11.468 -13.217
  165   1HG2  THR  21          1HG2      THR  21 -21.510  12.776 -10.224
  166   2HG2  THR  21          2HG2      THR  21 -20.595  12.539 -11.714
  167   3HG2  THR  21          3HG2      THR  21 -20.426  11.394 -10.383
  168    H    LEU  22           H        LEU  22 -24.129   8.393 -10.328
  169    HA   LEU  22           HA       LEU  22 -25.386   7.969  -8.367
  170   1HB   LEU  22          2HB       LEU  22 -23.490   6.742  -7.729
  171   2HB   LEU  22          1HB       LEU  22 -22.510   8.188  -7.503
  172    HG   LEU  22           HG       LEU  22 -23.722   8.782  -5.501
  173   1HD1  LEU  22          1HD1      LEU  22 -25.776   7.191  -6.715
  174   2HD1  LEU  22          2HD1      LEU  22 -25.894   8.221  -5.287
  175   3HD1  LEU  22          3HD1      LEU  22 -25.430   6.528  -5.119
  176   1HD2  LEU  22          1HD2      LEU  22 -23.627   6.266  -4.412
  177   2HD2  LEU  22          2HD2      LEU  22 -22.221   7.310  -4.626
  178   3HD2  LEU  22          3HD2      LEU  22 -22.594   6.075  -5.828
  179    H    LYS  23           H        LYS  23 -24.568  10.973  -9.149
  180    HA   LYS  23           HA       LYS  23 -24.778  12.359  -6.592
  181   1HB   LYS  23          2HB       LYS  23 -23.684  13.403  -8.489
  182   2HB   LYS  23          1HB       LYS  23 -25.109  13.169  -9.500
  183   1HG   LYS  23          2HG       LYS  23 -25.883  15.172  -8.832
  184   2HG   LYS  23          1HG       LYS  23 -25.962  14.565  -7.177
  185   1HD   LYS  23          2HD       LYS  23 -23.310  15.038  -7.344
  186   2HD   LYS  23          1HD       LYS  23 -23.892  16.257  -8.477
  187   1HE   LYS  23          2HE       LYS  23 -25.636  16.382  -6.248
  188   2HE   LYS  23          1HE       LYS  23 -23.987  16.311  -5.593
  189   1HZ   LYS  23          1HZ       LYS  23 -25.041  18.179  -7.643
  190   2HZ   LYS  23          2HZ       LYS  23 -23.381  17.975  -7.345
  191   3HZ   LYS  23          3HZ       LYS  23 -24.400  18.570  -6.122
  192    H    GLY  24           H        GLY  24 -26.717  12.142  -5.440
  193   1HA   GLY  24          2HA       GLY  24 -29.044  11.902  -5.073
  194   2HA   GLY  24          1HA       GLY  24 -29.189  13.153  -6.318
  195    H    HIS  25           H        HIS  25 -28.448   9.671  -6.067
  196    HA   HIS  25           HA       HIS  25 -30.058   9.239  -8.565
  197   1HB   HIS  25          2HB       HIS  25 -27.677   9.237  -8.975
  198   2HB   HIS  25          1HB       HIS  25 -27.395   8.162  -7.613
  199    HD1  HIS  25           HD1      HIS  25 -29.436   8.056 -10.853
  200    HD2  HIS  25           HD2      HIS  25 -27.032   5.601  -8.508
  201    HE1  HIS  25           HE1      HIS  25 -29.039   5.921 -12.160
  202    H    LYS  26           H        LYS  26 -28.455   6.554  -7.106
  203    HA   LYS  26           HA       LYS  26 -29.393   4.555  -6.265
  204   1HB   LYS  26          2HB       LYS  26 -29.074   5.944  -4.278
  205   2HB   LYS  26          1HB       LYS  26 -30.621   6.745  -4.553
  206   1HG   LYS  26          2HG       LYS  26 -31.685   4.419  -4.401
  207   2HG   LYS  26          1HG       LYS  26 -30.133   3.866  -3.767
  208   1HD   LYS  26          2HD       LYS  26 -30.278   5.577  -1.975
  209   2HD   LYS  26          1HD       LYS  26 -31.858   6.066  -2.590
  210   1HE   LYS  26          2HE       LYS  26 -32.633   4.522  -1.075
  211   2HE   LYS  26          1HE       LYS  26 -32.201   3.352  -2.339
  212   1HZ   LYS  26          1HZ       LYS  26 -29.951   3.274  -1.411
  213   2HZ   LYS  26          2HZ       LYS  26 -31.110   2.763  -0.279
  214   3HZ   LYS  26          3HZ       LYS  26 -30.426   4.313  -0.158
  215    H    ARG  27           H        ARG  27 -32.276   6.296  -5.300
  216    HA   ARG  27           HA       ARG  27 -34.149   4.519  -6.360
  217   1HB   ARG  27          2HB       ARG  27 -34.613   6.386  -4.810
  218   2HB   ARG  27          1HB       ARG  27 -34.307   7.543  -6.105
  219   1HG   ARG  27          2HG       ARG  27 -36.347   7.212  -7.042
  220   2HG   ARG  27          1HG       ARG  27 -36.266   5.465  -6.813
  221   1HD   ARG  27          2HD       ARG  27 -36.680   5.934  -4.312
  222   2HD   ARG  27          1HD       ARG  27 -37.155   7.566  -4.825
  223    HE   ARG  27           HE       ARG  27 -38.497   5.817  -6.556
  224   1HH1  ARG  27          1HH2      ARG  27 -38.141   5.857  -3.150
  225   2HH1  ARG  27          2HH2      ARG  27 -39.823   5.598  -2.827
  226   1HH2  ARG  27          1HH1      ARG  27 -40.755   5.729  -6.164
  227   2HH2  ARG  27          2HH1      ARG  27 -41.303   5.527  -4.533
  228    H    TYR  28           H        TYR  28 -32.246   6.921  -8.036
  229    HA   TYR  28           HA       TYR  28 -33.893   6.802 -10.491
  230   1HB   TYR  28          2HB       TYR  28 -31.199   8.096  -9.970
  231   2HB   TYR  28          1HB       TYR  28 -32.355   8.516 -11.237
  232    HD1  TYR  28           HD1      TYR  28 -31.295  10.542  -9.325
  233    HD2  TYR  28           HD2      TYR  28 -34.704   7.946  -9.039
  234    HE1  TYR  28           HE1      TYR  28 -32.389  12.149  -7.784
  235    HE2  TYR  28           HE2      TYR  28 -35.799   9.554  -7.500
  236    HH   TYR  28           HH       TYR  28 -35.663  11.532  -6.507
  237    H    CYS  29           H        CYS  29 -31.771   4.723  -9.111
  238    HA   CYS  29           HA       CYS  29 -29.981   4.152 -11.340
  239   1HB   CYS  29          2HB       CYS  29 -29.605   3.745  -8.844
  240   2HB   CYS  29          1HB       CYS  29 -30.733   2.408  -8.983
  241    H    LYS  30           H        LYS  30 -30.579   2.980 -13.144
  242    HA   LYS  30           HA       LYS  30 -33.132   1.666 -13.399
  243   1HB   LYS  30          2HB       LYS  30 -31.160   2.471 -15.079
  244   2HB   LYS  30          1HB       LYS  30 -30.777   0.752 -14.987
  245   1HG   LYS  30          2HG       LYS  30 -33.628   1.112 -15.286
  246   2HG   LYS  30          1HG       LYS  30 -32.771   1.962 -16.572
  247   1HD   LYS  30          2HD       LYS  30 -31.481  -0.093 -17.060
  248   2HD   LYS  30          1HD       LYS  30 -32.375  -0.943 -15.801
  249   1HE   LYS  30          2HE       LYS  30 -34.316   0.303 -17.464
  250   2HE   LYS  30          1HE       LYS  30 -33.153  -0.507 -18.533
  251   1HZ   LYS  30          1HZ       LYS  30 -34.773  -2.108 -17.816
  252   2HZ   LYS  30          2HZ       LYS  30 -34.532  -1.696 -16.185
  253   3HZ   LYS  30          3HZ       LYS  30 -33.297  -2.466 -17.062
  254    H    PHE  31           H        PHE  31 -30.198   0.872 -11.853
  255    HA   PHE  31           HA       PHE  31 -30.838  -2.042 -11.658
  256   1HB   PHE  31          2HB       PHE  31 -28.310  -0.425 -11.119
  257   2HB   PHE  31          1HB       PHE  31 -28.386  -2.191 -11.192
  258    HD1  PHE  31           HD1      PHE  31 -28.746   0.939 -13.135
  259    HD2  PHE  31           HD2      PHE  31 -28.553  -3.344 -13.298
  260    HE1  PHE  31           HE1      PHE  31 -28.545   1.047 -15.594
  261    HE2  PHE  31           HE2      PHE  31 -28.366  -3.242 -15.759
  262    HZ   PHE  31           HZ       PHE  31 -28.352  -1.046 -16.918
  263    H    ARG  32           H        ARG  32 -31.545   0.704 -10.082
  264    HA   ARG  32           HA       ARG  32 -30.674   0.702  -7.469
  265   1HB   ARG  32          2HB       ARG  32 -32.584   1.993  -7.060
  266   2HB   ARG  32          1HB       ARG  32 -32.475   2.091  -8.812
  267   1HG   ARG  32          2HG       ARG  32 -34.153   0.031  -7.366
  268   2HG   ARG  32          1HG       ARG  32 -34.784   1.571  -7.936
  269   1HD   ARG  32          2HD       ARG  32 -33.333   0.354 -10.097
  270   2HD   ARG  32          1HD       ARG  32 -34.481  -0.829  -9.445
  271    HE   ARG  32           HE       ARG  32 -35.344   1.965 -10.087
  272   1HH1  ARG  32          1HH2      ARG  32 -35.264  -1.103 -11.409
  273   2HH1  ARG  32          2HH2      ARG  32 -36.970  -1.232 -11.682
  274   1HH2  ARG  32          1HH1      ARG  32 -37.734   1.665  -9.930
  275   2HH2  ARG  32          2HH1      ARG  32 -38.368   0.339 -10.848
  276    H    TYR  33           H        TYR  33 -32.827  -1.583  -8.992
  277    HA   TYR  33           HA       TYR  33 -32.952  -3.110  -6.406
  278   1HB   TYR  33          2HB       TYR  33 -35.020  -2.642  -8.567
  279   2HB   TYR  33          1HB       TYR  33 -35.211  -3.867  -7.313
  280    HD1  TYR  33           HD1      TYR  33 -36.635  -1.005  -8.006
  281    HD2  TYR  33           HD2      TYR  33 -33.970  -2.493  -4.982
  282    HE1  TYR  33           HE1      TYR  33 -37.436   0.742  -6.440
  283    HE2  TYR  33           HE2      TYR  33 -34.771  -0.747  -3.417
  284    HH   TYR  33           HH       TYR  33 -37.494   1.322  -4.210
  285    H    CYS  34           H        CYS  34 -31.590  -3.178  -9.416
  286    HA   CYS  34           HA       CYS  34 -32.125  -5.626 -10.627
  287   1HB   CYS  34          2HB       CYS  34 -30.409  -3.905 -11.308
  288   2HB   CYS  34          1HB       CYS  34 -29.386  -4.492  -9.994
  289    H    THR  35           H        THR  35 -30.769  -7.705 -10.383
  290    HA   THR  35           HA       THR  35 -29.994  -8.235  -7.548
  291    HB   THR  35           HB       THR  35 -31.313 -10.450  -7.931
  292    HG1  THR  35           HG1      THR  35 -31.589  -9.506 -10.253
  293   1HG2  THR  35          1HG2      THR  35 -33.282  -8.255  -7.846
  294   2HG2  THR  35          2HG2      THR  35 -31.938  -8.080  -6.716
  295   3HG2  THR  35          3HG2      THR  35 -32.954  -9.521  -6.663
  296    H    CYS  36           H        CYS  36 -29.055  -8.354 -10.740
  297    HA   CYS  36           HA       CYS  36 -28.005 -10.892 -11.243
  298   1HB   CYS  36          2HB       CYS  36 -26.448  -9.753 -12.665
  299   2HB   CYS  36          1HB       CYS  36 -27.906  -8.759 -12.631
  300    H    GLU  37           H        GLU  37 -25.527 -11.481 -10.948
  301    HA   GLU  37           HA       GLU  37 -24.980 -11.399  -8.074
  302   1HB   GLU  37          2HB       GLU  37 -23.197 -12.953  -8.694
  303   2HB   GLU  37          1HB       GLU  37 -24.666 -13.371  -9.576
  304   1HG   GLU  37          2HG       GLU  37 -23.777 -12.791 -11.592
  305   2HG   GLU  37          1HG       GLU  37 -22.905 -11.413 -10.923
  306    H    LYS  38           H        LYS  38 -24.337  -9.174 -10.468
  307    HA   LYS  38           HA       LYS  38 -21.668  -8.403  -9.356
  308   1HB   LYS  38          2HB       LYS  38 -23.274  -7.671 -11.826
  309   2HB   LYS  38          1HB       LYS  38 -21.794  -6.820 -11.376
  310   1HG   LYS  38          2HG       LYS  38 -20.480  -8.810 -11.571
  311   2HG   LYS  38          1HG       LYS  38 -21.915  -9.827 -11.681
  312   1HD   LYS  38          2HD       LYS  38 -22.074  -7.840 -13.733
  313   2HD   LYS  38          1HD       LYS  38 -20.479  -8.590 -13.812
  314   1HE   LYS  38          2HE       LYS  38 -21.450 -10.804 -13.980
  315   2HE   LYS  38          1HE       LYS  38 -23.076 -10.160 -13.673
  316   1HZ   LYS  38          1HZ       LYS  38 -22.934  -8.835 -15.651
  317   2HZ   LYS  38          2HZ       LYS  38 -22.596 -10.448 -16.066
  318   3HZ   LYS  38          3HZ       LYS  38 -21.333  -9.320 -15.927
  319    H    CYS  39           H        CYS  39 -24.996  -7.695  -9.234
  320    HA   CYS  39           HA       CYS  39 -24.660  -4.900  -8.314
  321   1HB   CYS  39          2HB       CYS  39 -26.785  -6.750  -9.231
  322   2HB   CYS  39          1HB       CYS  39 -27.271  -5.661  -7.949
  323    H    ARG  40           H        ARG  40 -25.658  -8.130  -7.195
  324    HA   ARG  40           HA       ARG  40 -26.112  -7.379  -4.441
  325   1HB   ARG  40          2HB       ARG  40 -26.049  -9.761  -6.159
  326   2HB   ARG  40          1HB       ARG  40 -25.457 -10.086  -4.529
  327   1HG   ARG  40          2HG       ARG  40 -27.491  -9.506  -3.531
  328   2HG   ARG  40          1HG       ARG  40 -27.997  -8.522  -4.904
  329   1HD   ARG  40          2HD       ARG  40 -28.683 -10.373  -6.152
  330   2HD   ARG  40          1HD       ARG  40 -27.592 -11.479  -5.295
  331    HE   ARG  40           HE       ARG  40 -29.176 -10.766  -3.253
  332   1HH1  ARG  40          1HH2      ARG  40 -29.767 -13.297  -4.802
  333   2HH1  ARG  40          2HH2      ARG  40 -31.438 -13.076  -5.203
  334   1HH2  ARG  40          1HH1      ARG  40 -31.434  -9.681  -4.511
  335   2HH2  ARG  40          2HH1      ARG  40 -32.380 -11.034  -5.035
  336    H    LEU  41           H        LEU  41 -23.396  -8.615  -6.315
  337    HA   LEU  41           HA       LEU  41 -21.557  -8.947  -4.110
  338   1HB   LEU  41          2HB       LEU  41 -20.909 -10.088  -6.032
  339   2HB   LEU  41          1HB       LEU  41 -21.517  -8.824  -7.096
  340    HG   LEU  41           HG       LEU  41 -19.611  -7.454  -6.738
  341   1HD1  LEU  41          1HD1      LEU  41 -17.950  -8.949  -4.989
  342   2HD1  LEU  41          2HD1      LEU  41 -19.535  -8.855  -4.220
  343   3HD1  LEU  41          3HD1      LEU  41 -18.690  -7.377  -4.682
  344   1HD2  LEU  41          1HD2      LEU  41 -17.988  -9.876  -6.689
  345   2HD2  LEU  41          2HD2      LEU  41 -18.241  -8.728  -8.003
  346   3HD2  LEU  41          3HD2      LEU  41 -19.383 -10.049  -7.753
  347    H    THR  42           H        THR  42 -22.370  -6.331  -6.312
  348    HA   THR  42           HA       THR  42 -20.329  -4.469  -5.496
  349    HB   THR  42           HB       THR  42 -23.029  -4.314  -6.829
  350    HG1  THR  42           HG1      THR  42 -20.754  -5.023  -7.689
  351   1HG2  THR  42          1HG2      THR  42 -22.937  -2.177  -5.868
  352   2HG2  THR  42          2HG2      THR  42 -22.173  -1.926  -7.438
  353   3HG2  THR  42          3HG2      THR  42 -21.180  -2.095  -5.991
  354    H    ALA  43           H        ALA  43 -23.816  -4.163  -4.939
  355    HA   ALA  43           HA       ALA  43 -23.843  -2.336  -2.849
  356   1HB   ALA  43          1HB       ALA  43 -25.962  -3.487  -2.199
  357   2HB   ALA  43          2HB       ALA  43 -25.496  -4.865  -3.198
  358   3HB   ALA  43          3HB       ALA  43 -25.829  -3.304  -3.948
  359    H    ASP  44           H        ASP  44 -22.889  -5.695  -2.810
  360    HA   ASP  44           HA       ASP  44 -22.768  -5.951   0.103
  361   1HB   ASP  44          2HB       ASP  44 -23.217  -7.836  -1.409
  362   2HB   ASP  44          1HB       ASP  44 -21.677  -7.569  -2.227
  363    H    ARG  45           H        ARG  45 -20.527  -5.289  -2.566
  364    HA   ARG  45           HA       ARG  45 -18.063  -5.453  -1.146
  365   1HB   ARG  45          2HB       ARG  45 -18.927  -4.950  -3.699
  366   2HB   ARG  45          1HB       ARG  45 -18.360  -3.353  -3.211
  367   1HG   ARG  45          2HG       ARG  45 -16.187  -3.996  -3.234
  368   2HG   ARG  45          1HG       ARG  45 -16.543  -5.520  -2.421
  369   1HD   ARG  45          2HD       ARG  45 -16.632  -6.668  -4.387
  370   2HD   ARG  45          1HD       ARG  45 -17.561  -5.386  -5.188
  371    HE   ARG  45           HE       ARG  45 -14.679  -5.655  -5.263
  372   1HH1  ARG  45          1HH2      ARG  45 -16.759  -4.149  -7.068
  373   2HH1  ARG  45          2HH2      ARG  45 -16.128  -2.541  -6.954
  374   1HH2  ARG  45          1HH1      ARG  45 -14.076  -3.256  -4.250
  375   2HH2  ARG  45          2HH1      ARG  45 -14.608  -2.035  -5.356
  376    H    GLN  46           H        GLN  46 -20.598  -3.063  -1.101
  377    HA   GLN  46           HA       GLN  46 -18.836  -1.081   0.267
  378   1HB   GLN  46          2HB       GLN  46 -21.525  -1.065  -1.097
  379   2HB   GLN  46          1HB       GLN  46 -21.058   0.264  -0.034
  380   1HG   GLN  46          2HG       GLN  46 -18.815   0.130  -1.489
  381   2HG   GLN  46          1HG       GLN  46 -19.935  -0.531  -2.682
  382   1HE2  GLN  46          1HE2      GLN  46 -19.241   2.352  -0.708
  383   2HE2  GLN  46          2HE2      GLN  46 -20.215   3.410  -1.610
  384    H    ARG  47           H        ARG  47 -22.131  -2.449   0.689
  385    HA   ARG  47           HA       ARG  47 -22.346  -1.640   3.452
  386   1HB   ARG  47          2HB       ARG  47 -24.050  -2.411   1.525
  387   2HB   ARG  47          1HB       ARG  47 -23.874  -3.958   2.353
  388   1HG   ARG  47          2HG       ARG  47 -24.414  -2.800   4.510
  389   2HG   ARG  47          1HG       ARG  47 -24.739  -1.330   3.593
  390   1HD   ARG  47          2HD       ARG  47 -26.133  -3.935   2.936
  391   2HD   ARG  47          1HD       ARG  47 -26.786  -2.796   4.132
  392    HE   ARG  47           HE       ARG  47 -26.012  -1.547   1.593
  393   1HH1  ARG  47          1HH2      ARG  47 -28.226  -0.762   3.591
  394   2HH1  ARG  47          2HH2      ARG  47 -29.638  -1.089   2.641
  395   1HH2  ARG  47          1HH1      ARG  47 -27.940  -2.985   0.286
  396   2HH2  ARG  47          2HH1      ARG  47 -29.476  -2.348   0.771
  397    H    VAL  48           H        VAL  48 -21.342  -2.599   5.175
  398    HA   VAL  48           HA       VAL  48 -20.416  -5.437   4.871
  399    HB   VAL  48           HB       VAL  48 -19.351  -3.292   6.727
  400   1HG1  VAL  48          1HG1      VAL  48 -18.208  -5.085   7.498
  401   2HG1  VAL  48          2HG1      VAL  48 -17.332  -5.053   5.968
  402   3HG1  VAL  48          3HG1      VAL  48 -18.742  -6.093   6.154
  403   1HG2  VAL  48          1HG2      VAL  48 -18.853  -2.284   4.701
  404   2HG2  VAL  48          2HG2      VAL  48 -18.857  -3.814   3.821
  405   3HG2  VAL  48          3HG2      VAL  48 -17.477  -3.379   4.829
  406    H    MET  49           H        MET  49 -22.735  -5.910   5.634
  407    HA   MET  49           HA       MET  49 -22.895  -5.692   8.624
  408   1HB   MET  49          2HB       MET  49 -25.363  -5.665   8.237
  409   2HB   MET  49          1HB       MET  49 -24.549  -4.314   7.447
  410   1HG   MET  49          2HG       MET  49 -24.862  -5.183   5.323
  411   2HG   MET  49          1HG       MET  49 -24.902  -6.851   5.899
  412   1HE   MET  49          1HE       MET  49 -26.395  -6.142   3.857
  413   2HE   MET  49          2HE       MET  49 -27.578  -4.844   4.002
  414   3HE   MET  49          3HE       MET  49 -28.101  -6.522   4.123
  415    H    ALA  50           H        ALA  50 -25.172  -7.454   8.764
  416    HA   ALA  50           HA       ALA  50 -23.917 -10.055   7.939
  417   1HB   ALA  50          1HB       ALA  50 -25.128  -9.022  10.474
  418   2HB   ALA  50          2HB       ALA  50 -23.713 -10.053  10.250
  419   3HB   ALA  50          3HB       ALA  50 -25.333 -10.733  10.104
  420    H    LEU  51           H        LEU  51 -27.007  -9.944   9.539
  421    HA   LEU  51           HA       LEU  51 -28.571  -9.888   7.060
  422   1HB   LEU  51          2HB       LEU  51 -29.188 -12.194   7.053
  423   2HB   LEU  51          1HB       LEU  51 -27.441 -12.179   7.260
  424    HG   LEU  51           HG       LEU  51 -28.218 -13.753   8.847
  425   1HD1  LEU  51          1HD1      LEU  51 -28.074 -11.193  10.446
  426   2HD1  LEU  51          2HD1      LEU  51 -26.661 -11.974   9.742
  427   3HD1  LEU  51          3HD1      LEU  51 -27.615 -12.814  10.963
  428   1HD2  LEU  51          1HD2      LEU  51 -30.636 -12.544   8.631
  429   2HD2  LEU  51          2HD2      LEU  51 -30.144 -11.966  10.222
  430   3HD2  LEU  51          3HD2      LEU  51 -30.241 -13.698   9.904
  431    H    GLN  52           H        GLN  52 -30.953 -10.650   7.700
  432    HA   GLN  52           HA       GLN  52 -31.564  -9.817  10.505
  433   1HB   GLN  52          2HB       GLN  52 -31.646  -8.060   8.461
  434   2HB   GLN  52          1HB       GLN  52 -33.254  -8.763   8.286
  435   1HG   GLN  52          2HG       GLN  52 -33.488  -8.374  10.833
  436   2HG   GLN  52          1HG       GLN  52 -32.097  -7.303  10.658
  437   1HE2  GLN  52          1HE2      GLN  52 -35.131  -7.896   8.775
  438   2HE2  GLN  52          2HE2      GLN  52 -35.516  -6.252   8.607