*HEADER   CALCIUM-BINDING PROTEIN                 29-MAY-96   1SYM    
*TITLE    3-D SOLUTION STRUCTURE OF REDUCED APO-S100B FROM RAT, NMR,  
*TITLE   2 20 STRUCTURES                                              
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: S100B;                                           
*COMPND  3 CHAIN: A, B;                                               
*COMPND  4 SYNONYM: S100B(BETABETA), S100BETA, S100(BETABETA);        
*COMPND  5 ENGINEERED: YES;                                           
*COMPND  6 OTHER_DETAILS: SYMMETRIC DIMER OF APO-S100BETA SUBUNITS,   
*COMPND  7 JOINED BY NONCOVALENT INTERACTION AT THE DIMER INTERFACE   
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS;                    
*SOURCE  3 ORGANISM_COMMON: RAT;                                      
*SOURCE  4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                       
*SOURCE  5 EXPRESSION_SYSTEM_STRAIN: HMS174;                          
*SOURCE  6 EXPRESSION_SYSTEM_PLASMID: PET11B;                         
*SOURCE  7 EXPRESSION_SYSTEM_GENE: S100BETA FROM RATTUS NORVEGICUS    
*KEYWDS   METAL-BINDING, CALCIUM-BINDING PROTEIN                      
*EXPDTA   NMR, 20 STRUCTURES                                          
*AUTHOR   A.C.DROHAT,D.J.WEBER                                        
*REVDAT  1   07-DEC-96 1SYM    0                                      


!Ser 1

!INTRA

!SEQ
assign (segid a and resid 2 and name hn) (segid a and resid 1 and name hn) 1.8 0 4.2
assign (segid b and resid 2 and name hn) (segid b and resid 1 and name hn) 1.8 0 4.2

!MED
assign (segid a and resid 3 and name hn) (segid a and resid 1 and name hn) 1.8 0 4.2
assign (segid b and resid 3 and name hn) (segid b and resid 1 and name hn) 1.8 0 4.2

assign (segid a and resid 4 and name hb*) (segid a and resid 1 and name hn) 1.8 0 3.2 
assign (segid b and resid 4 and name hb*) (segid b and resid 1 and name hn) 1.8 0 3.2 

assign (segid a and resid 4 and name hg*) (segid a and resid 1 and name hn) 1.8 0 4.2 
assign (segid b and resid 4 and name hg*) (segid b and resid 1 and name hn) 1.8 0 4.2 

assign (segid a and resid 5 and name hn) (segid a and resid 1 and name hn) 1.8 0 4.2
assign (segid b and resid 5 and name hn) (segid b and resid 1 and name hn) 1.8 0 4.2

!LONG

!INTER



!Glu 2

!INTRA
assign (segid a and resid 2 and name hb*) (segid a and resid 2 and name hn) 1.8 0 2.1
assign (segid b and resid 2 and name hb*) (segid b and resid 2 and name hn) 1.8 0 2.1

assign (segid a and resid 2 and name hg*) (segid a and resid 2 and name hn) 1.8 0 2.7
assign (segid b and resid 2 and name hg*) (segid b and resid 2 and name hn) 1.8 0 2.7

!SEQ
assign (segid a and resid 1 and name ha) (segid a and resid 2 and name hn) 1.8 0 1.1
assign (segid b and resid 1 and name ha) (segid b and resid 2 and name hn) 1.8 0 1.1

!MED
assign (segid a and resid 4 and name hn) (segid a and resid 2 and name hn) 1.8 0 4.2
assign (segid b and resid 4 and name hn) (segid b and resid 2 and name hn) 1.8 0 4.2

assign (segid a and resid 5 and name hn) (segid a and resid 2 and name hn) 1.8 0 4.2
assign (segid b and resid 5 and name hn) (segid b and resid 2 and name hn) 1.8 0 4.2

assign (segid a and resid 5 and name hb*) (segid a and resid 2 and name ha) 1.8 0 4.2
assign (segid b and resid 5 and name hb*) (segid b and resid 2 and name ha) 1.8 0 4.2

!LONG

!INTER
assign (segid a and resid 13 and name hg*) (segid b and resid 2 and name hn) 1.8 0 6.1
assign (segid b and resid 13 and name hg*) (segid a and resid 2 and name hn) 1.8 0 6.1



!Leu 3

!INTRA

assign (segid a and resid 3 and name ha) (segid a and resid 3 and name hd1*) 1.8 0 3.0
assign (segid b and resid 3 and name ha) (segid b and resid 3 and name hd1*) 1.8 0 3.0

assign (segid a and resid 3 and name hb1) (segid a and resid 3 and name hn) 1.8 0 1.7
assign (segid b and resid 3 and name hb1) (segid b and resid 3 and name hn) 1.8 0 1.7

assign (segid a and resid 3 and name hb2) (segid a and resid 3 and name hn) 1.8 0 1.7
assign (segid b and resid 3 and name hb2) (segid b and resid 3 and name hn) 1.8 0 1.7

assign (segid a and resid 3 and name hd1*) (segid a and resid 3 and name hn) 1.8 0 4.7
assign (segid b and resid 3 and name hd1*) (segid b and resid 3 and name hn) 1.8 0 4.7

assign (segid a and resid 3 and name hd2*) (segid a and resid 3 and name hn) 1.8 0 5.7
assign (segid b and resid 3 and name hd2*) (segid b and resid 3 and name hn) 1.8 0 5.7

!SEQ
assign (segid a and resid 2 and name hn) (segid a and resid 3 and name hn) 1.8 0 1.1
assign (segid b and resid 2 and name hn) (segid b and resid 3 and name hn) 1.8 0 1.1

assign (segid a and resid 2 and name ha) (segid a and resid 3 and name hn) 1.8 0 3.2
assign (segid b and resid 2 and name ha) (segid b and resid 3 and name hn) 1.8 0 3.2

assign (segid a and resid 2 and name hb*) (segid a and resid 3 and name hn) 1.8 0 2.7
assign (segid b and resid 2 and name hb*) (segid b and resid 3 and name hn) 1.8 0 2.7

!MED
assign (segid a and resid 6 and name hb*) (segid a and resid 3 and name ha) 1.8 0 3.0
assign (segid b and resid 6 and name hb*) (segid b and resid 3 and name ha) 1.8 0 3.0

assign (segid a and resid 7 and name he*) (segid a and resid 3 and name hd1*) 1.8 0 6.2
assign (segid b and resid 7 and name he*) (segid b and resid 3 and name hd1*) 1.8 0 6.2

!LONG

!INTER
assign (segid a and resid 9 and name hb*) (segid b and resid 3 and name hd1*) 1.8 0 6.2
assign (segid b and resid 9 and name hb*) (segid a and resid 3 and name hd1*) 1.8 0 6.2

assign (segid a and resid 10 and name ha) (segid b and resid 3 and name hd1*) 1.8 0 4.7
assign (segid b and resid 10 and name ha) (segid a and resid 3 and name hd1*) 1.8 0 4.7

assign (segid a and resid 10 and name hg) (segid b and resid 3 and name hd1*) 1.8 0 4.7
assign (segid b and resid 10 and name hg) (segid a and resid 3 and name hd1*) 1.8 0 4.7

assign (segid a and resid 13 and name hg*) (segid b and resid 3 and name hn) 1.8 0 4.4
assign (segid b and resid 13 and name hg*) (segid a and resid 3 and name hn) 1.8 0 4.4

assign (segid a and resid 13 and name hb) (segid b and resid 3 and name hd1*) 1.8 0 4.7
assign (segid b and resid 13 and name hb) (segid a and resid 3 and name hd1*) 1.8 0 4.7

assign (segid a and resid 39 and name hb*) (segid b and resid 3 and name hd2*) 1.8 0 5.7
assign (segid b and resid 39 and name hb*) (segid a and resid 3 and name hd2*) 1.8 0 5.7

assign (segid a and resid 40 and name hg) (segid b and resid 3 and name hd2*) 1.8 0 4.7
assign (segid b and resid 40 and name hg) (segid a and resid 3 and name hd2*) 1.8 0 4.7

assign (segid a and resid 41 and name hb*) (segid b and resid 3 and name hd2*) 1.8 0 6.7
assign (segid b and resid 41 and name hb*) (segid a and resid 3 and name hd2*) 1.8 0 6.7

assign (segid a and resid 73 and name he*) (segid b and resid 3 and name hd1*) 1.8 0 7.1
assign (segid b and resid 73 and name he*) (segid a and resid 3 and name hd1*) 1.8 0 7.1

assign (segid a and resid 73 and name hz) (segid b and resid 3 and name hd1*) 1.8 0 4.7
assign (segid b and resid 73 and name hz) (segid a and resid 3 and name hd1*) 1.8 0 4.7

assign (segid a and resid 74 and name he*) (segid b and resid 3 and name hd1*) 1.8 0 6.2
assign (segid b and resid 74 and name he*) (segid a and resid 3 and name hd1*) 1.8 0 6.2

assign (segid a and resid 80 and name hg2*) (segid b and resid 3 and name hd2*) 1.8 0 7.2
assign (segid b and resid 80 and name hg2*) (segid a and resid 3 and name hd2*) 1.8 0 7.2




!Glu 4

!INTRA
assign (segid a and resid 4 and name hb*) (segid a and resid 4 and name hn) 1.8 0 2.7
assign (segid b and resid 4 and name hb*) (segid b and resid 4 and name hn) 1.8 0 2.7

!SEQ
assign (segid a and resid 3 and name hn) (segid a and resid 4 and name hn) 1.8 0 1.1
assign (segid b and resid 3 and name hn) (segid b and resid 4 and name hn) 1.8 0 1.1

assign (segid a and resid 3 and name hb2) (segid a and resid 4 and name hn) 1.8 0 1.7
assign (segid b and resid 3 and name hb2) (segid b and resid 4 and name hn) 1.8 0 1.7

assign (segid a and resid 3 and name hd2*) (segid a and resid 4 and name hn) 1.8 0 4.7
assign (segid b and resid 3 and name hd2*) (segid b and resid 4 and name hn) 1.8 0 4.7

assign (segid a and resid 5 and name hn) (segid a and resid 4 and name hn) 1.8 0 1.1
assign (segid b and resid 5 and name hn) (segid b and resid 4 and name hn) 1.8 0 1.1

!MED
assign (segid a and resid 2 and name ha) (segid a and resid 4 and name hn) 1.8 0 3.2
assign (segid b and resid 2 and name ha) (segid b and resid 4 and name hn) 1.8 0 3.2

assign (segid a and resid 7 and name hb1) (segid a and resid 4 and name ha) 1.8 0 1.5
assign (segid b and resid 7 and name hb1) (segid b and resid 4 and name ha) 1.8 0 1.5

!LONG

!INTER
assign (segid a and resid 17 and name he*) (segid b and resid 4 and name hn) 1.8 0 6.6
assign (segid b and resid 17 and name he*) (segid a and resid 4 and name hn) 1.8 0 6.6



!Lys 5

!INTRA
assign (segid a and resid 5 and name hb*) (segid a and resid 5 and name hn) 1.8 0 2.1
assign (segid b and resid 5 and name hb*) (segid b and resid 5 and name hn) 1.8 0 2.1

assign (segid a and resid 5 and name hd*) (segid a and resid 5 and name hn) 1.8 0 2.5
assign (segid b and resid 5 and name hd*) (segid b and resid 5 and name hn) 1.8 0 2.5

!SEQ
assign (segid a and resid 4 and name ha) (segid a and resid 5 and name hn) 1.8 0 4.2
assign (segid b and resid 4 and name ha) (segid b and resid 5 and name hn) 1.8 0 4.2
 
assign (segid a and resid 4 and name hb*) (segid a and resid 5 and name hn) 1.8 0 4.2
assign (segid b and resid 4 and name hb*) (segid b and resid 5 and name hn) 1.8 0 4.2

assign (segid a and resid 2 and name ha) (segid a and resid 5 and name hn) 1.8 0 3.2
assign (segid b and resid 2 and name ha) (segid b and resid 5 and name hn) 1.8 0 3.2

assign (segid a and resid 3 and name ha) (segid a and resid 5 and name hn) 1.8 0 4.2
assign (segid b and resid 3 and name ha) (segid b and resid 5 and name hn) 1.8 0 4.2

assign (segid a and resid 8 and name hb) (segid a and resid 5 and name ha) 1.8 0 1.5
assign (segid b and resid 8 and name hb) (segid b and resid 5 and name ha) 1.8 0 1.5

assign (segid a and resid 8 and name hg1*) (segid a and resid 5 and name hn) 1.8 0 5.7 
assign (segid b and resid 8 and name hg1*) (segid b and resid 5 and name hn) 1.8 0 5.7 

!LONG

!INTER


!Ala 6

!INTRA
assign (segid a and resid 6 and name hb*) (segid a and resid 6 and name hn) 1.8 0 2.2
assign (segid b and resid 6 and name hb*) (segid b and resid 6 and name hn) 1.8 0 2.2

!SEQ
assign (segid a and resid 5 and name hn) (segid a and resid 6 and name hn) 1.8 0 1.1
assign (segid b and resid 5 and name hn) (segid b and resid 6 and name hn) 1.8 0 1.1

assign (segid a and resid 5 and name ha) (segid a and resid 6 and name hn) 1.8 0 3.2
assign (segid b and resid 5 and name ha) (segid b and resid 6 and name hn) 1.8 0 3.2

assign (segid a and resid 5 and name hb*) (segid a and resid 6 and name hn) 1.8 0 2.1
assign (segid b and resid 5 and name hb*) (segid b and resid 6 and name hn) 1.8 0 2.1
 
!MED
assign (segid a and resid 2 and name ha) (segid a and resid 6 and name hn) 1.8 0 4.2
assign (segid b and resid 2 and name ha) (segid b and resid 6 and name hn) 1.8 0 4.2

assign (segid a and resid 3 and name ha) (segid a and resid 6 and name hn) 1.8 0 3.2
assign (segid b and resid 3 and name ha) (segid b and resid 6 and name hn) 1.8 0 3.2

assign (segid a and resid 4 and name hn) (segid a and resid 6 and name hn) 1.8 0 3.2
assign (segid b and resid 4 and name hn) (segid b and resid 6 and name hn) 1.8 0 3.2

assign (segid a and resid 9 and name hb*) (segid a and resid 6 and name ha) 1.8 0 3.0
assign (segid b and resid 9 and name hb*) (segid b and resid 6 and name ha) 1.8 0 3.0

!LONG

!INTER
assign (segid a and resid 6 and name ha) (segid b and resid 6 and name hb*) 1.8 0 4.7
assign (segid b and resid 6 and name ha) (segid a and resid 6 and name hb*) 1.8 0 4.7

assign (segid a and resid 10 and name ha) (segid b and resid 6 and name hb*) 1.8 0 4.7
assign (segid b and resid 10 and name ha) (segid a and resid 6 and name hb*) 1.8 0 4.7

assign (segid a and resid 10 and name hb*) (segid b and resid 6 and name hb*) 1.8 0 5.7
assign (segid b and resid 10 and name hb*) (segid a and resid 6 and name hb*) 1.8 0 5.7

assign (segid a and resid 10 and name hg) (segid b and resid 6 and name hb*) 1.8 0 4.7
assign (segid b and resid 10 and name hg) (segid a and resid 6 and name hb*) 1.8 0 4.7


!Met 7

!INTRA
assign (segid a and resid 7 and name ha) (segid a and resid 7 and name he*) 1.8 0 3.0
assign (segid b and resid 7 and name ha) (segid b and resid 7 and name he*) 1.8 0 3.0

assign (segid a and resid 7 and name hb1) (segid a and resid 7 and name hn) 1.8 0 1.1
assign (segid b and resid 7 and name hb1) (segid b and resid 7 and name hn) 1.8 0 1.1

assign (segid a and resid 7 and name hb2) (segid a and resid 7 and name hn) 1.8 0 1.7
assign (segid b and resid 7 and name hb2) (segid b and resid 7 and name hn) 1.8 0 1.7

!SEQ
assign (segid a and resid 6 and name hn) (segid a and resid 7 and name hn) 1.8 0 1.1
assign (segid b and resid 6 and name hn) (segid b and resid 7 and name hn) 1.8 0 1.1

assign (segid a and resid 6 and name ha) (segid a and resid 7 and name hn) 1.8 0 3.2
assign (segid b and resid 6 and name ha) (segid b and resid 7 and name hn) 1.8 0 3.2

assign (segid a and resid 8 and name hg1*) (segid a and resid 7 and name hn) 1.8 0 5.7
assign (segid b and resid 8 and name hg1*) (segid b and resid 7 and name hn) 1.8 0 5.7

!MED
assign (segid a and resid 3 and name ha) (segid a and resid 7 and name hn) 1.8 0 3.2
assign (segid b and resid 3 and name ha) (segid b and resid 7 and name hn) 1.8 0 3.2

assign (segid a and resid 4 and name ha) (segid a and resid 7 and name hn) 1.8 0 3.2
assign (segid b and resid 4 and name ha) (segid b and resid 7 and name hn) 1.8 0 3.2

assign (segid a and resid 5 and name hn) (segid a and resid 7 and name hn) 1.8 0 3.2
assign (segid b and resid 5 and name hn) (segid b and resid 7 and name hn) 1.8 0 3.2

assign (segid a and resid 5 and name ha) (segid a and resid 7 and name hn) 1.8 0 4.2
assign (segid b and resid 5 and name ha) (segid b and resid 7 and name hn) 1.8 0 4.2

!LONG

!INTER
assign (segid a and resid 10 and name hb*) (segid b and resid 7 and name he*) 1.8 0 5.7
assign (segid b and resid 10 and name hb*) (segid a and resid 7 and name he*) 1.8 0 5.7

assign (segid a and resid 10 and name hd1*) (segid b and resid 7 and name he*) 1.8 0 6.2
assign (segid b and resid 10 and name hd1*) (segid a and resid 7 and name he*) 1.8 0 6.2

assign (segid a and resid 10 and name hd2*) (segid b and resid 7 and name he*) 1.8 0 6.2
assign (segid b and resid 10 and name hd2*) (segid a and resid 7 and name he*) 1.8 0 6.2

assign (segid a and resid 43 and name hd*) (segid b and resid 7 and name he*) 1.8 0 8.1
assign (segid b and resid 43 and name hd*) (segid a and resid 7 and name he*) 1.8 0 8.1

assign (segid a and resid 77 and name hg2*) (segid b and resid 7 and name he*) 1.8 0 6.2
assign (segid b and resid 77 and name hg2*) (segid a and resid 7 and name he*) 1.8 0 6.2

assign (segid a and resid 78 and name ha) (segid b and resid 7 and name he*) 1.8 0 5.7
assign (segid b and resid 78 and name ha) (segid a and resid 7 and name he*) 1.8 0 5.7

assign (segid a and resid 81 and name hb*) (segid b and resid 7 and name he*) 1.8 0 5.7
assign (segid b and resid 81 and name hb*) (segid a and resid 7 and name he*) 1.8 0 5.7


!INTRA
assign (segid a and resid 8 and name hb) (segid a and resid 8 and name hn) 1.8 0 1.1
assign (segid b and resid 8 and name hb) (segid b and resid 8 and name hn) 1.8 0 1.1

assign (segid a and resid 8 and name hg1*) (segid a and resid 8 and name hn) 1.8 0 2.6
assign (segid b and resid 8 and name hg1*) (segid b and resid 8 and name hn) 1.8 0 2.6

!SEQ
assign (segid a and resid 7 and name hn) (segid a and resid 8 and name hn) 1.8 0 1.1
assign (segid b and resid 7 and name hn) (segid b and resid 8 and name hn) 1.8 0 1.1

assign (segid a and resid 7 and name hb1) (segid a and resid 8 and name hn) 1.8 0 4.2
assign (segid b and resid 7 and name hb1) (segid b and resid 8 and name hn) 1.8 0 4.2

!MED
assign (segid a and resid 5 and name ha) (segid a and resid 8 and name hn) 1.8 0 3.2
assign (segid b and resid 5 and name ha) (segid b and resid 8 and name hn) 1.8 0 3.2

assign (segid a and resid 11 and name hb) (segid a and resid 8 and name ha) 1.8 0 1.5
assign (segid b and resid 11 and name hb) (segid b and resid 8 and name ha) 1.8 0 1.5

!LONG

!INTER
assign (segid a and resid 43 and name hz) (segid b and resid 8 and name hg2*) 1.8 0 4.7
assign (segid b and resid 43 and name hz) (segid a and resid 8 and name hg2*) 1.8 0 4.7

assign (segid a and resid 43 and name he*) (segid b and resid 8 and name hg2*) 1.8 0 7.1
assign (segid b and resid 43 and name he*) (segid a and resid 8 and name hg2*) 1.8 0 7.1

assign (segid a and resid 43 and name hz) (segid b and resid 8 and name hn) 1.8 0 6.6
assign (segid b and resid 43 and name hz) (segid a and resid 8 and name hn) 1.8 0 6.6



!Ala 9

!INTRA
assign (segid a and resid 9 and name hb*) (segid a and resid 9 and name hn) 1.8 0 2.2
assign (segid b and resid 9 and name hb*) (segid b and resid 9 and name hn) 1.8 0 2.2

!SEQ
assign (segid a and resid 8 and name hn) (segid a and resid 9 and name hn) 1.8 0 1.1
assign (segid b and resid 8 and name hn) (segid b and resid 9 and name hn) 1.8 0 1.1

assign (segid a and resid 8 and name ha) (segid a and resid 9 and name hn) 1.8 0 3.2
assign (segid b and resid 8 and name ha) (segid b and resid 9 and name hn) 1.8 0 3.2

assign (segid a and resid 8 and name hb) (segid a and resid 9 and name hn) 1.8 0 1.1
assign (segid b and resid 8 and name hb) (segid b and resid 9 and name hn) 1.8 0 1.1

assign (segid a and resid 8 and name hg1*) (segid a and resid 9 and name hn) 1.8 0 4.7
assign (segid b and resid 8 and name hg1*) (segid b and resid 9 and name hn) 1.8 0 4.7

assign (segid a and resid 8 and name hg2*) (segid a and resid 9 and name hn) 1.8 0 3.2
assign (segid b and resid 8 and name hg2*) (segid b and resid 9 and name hn) 1.8 0 3.2

assign (segid a and resid 10 and name hb*) (segid a and resid 9 and name hn) 1.8 0 4.2
assign (segid b and resid 10 and name hb*) (segid b and resid 9 and name hn) 1.8 0 4.2

!MED
assign (segid a and resid 5 and name ha) (segid a and resid 9 and name hn) 1.8 0 4.2
assign (segid b and resid 5 and name ha) (segid b and resid 9 and name hn) 1.8 0 4.2

assign (segid a and resid 5 and name hb*) (segid a and resid 9 and name hn) 1.8 0 5.2
assign (segid b and resid 5 and name hb*) (segid b and resid 9 and name hn) 1.8 0 5.2

assign (segid a and resid 6 and name hn) (segid a and resid 9 and name hn) 1.8 0 4.2
assign (segid b and resid 6 and name hn) (segid b and resid 9 and name hn) 1.8 0 4.2

assign (segid a and resid 6 and name ha) (segid a and resid 9 and name hn) 1.8 0 1.7
assign (segid b and resid 6 and name ha) (segid b and resid 9 and name hn) 1.8 0 1.7

assign (segid a and resid 7 and name hn) (segid a and resid 9 and name hn) 1.8 0 3.2
assign (segid b and resid 7 and name hn) (segid b and resid 9 and name hn) 1.8 0 3.2

assign (segid a and resid 7 and name hb1) (segid a and resid 9 and name hn) 1.8 0 4.2
assign (segid b and resid 7 and name hb1) (segid b and resid 9 and name hn) 1.8 0 4.2

assign (segid a and resid 11 and name hn) (segid a and resid 9 and name hn) 1.8 0 3.2
assign (segid b and resid 11 and name hn) (segid b and resid 9 and name hn) 1.8 0 3.2

assign (segid a and resid 12 and name hb2) (segid a and resid 9 and name hn) 1.8 0 4.2
assign (segid b and resid 12 and name hb2) (segid b and resid 9 and name hn) 1.8 0 4.2

assign (segid a and resid 12 and name hb2) (segid a and resid 9 and name ha) 1.8 0 1.5
assign (segid b and resid 12 and name hb2) (segid b and resid 9 and name ha) 1.8 0 1.5

assign (segid a and resid 12 and name hb1) (segid a and resid 9 and name ha) 1.8 0 1.5
assign (segid b and resid 12 and name hb1) (segid b and resid 9 and name ha) 1.8 0 1.5

!LONG

!INTER
assign (segid a and resid 9 and name hb*) (segid b and resid 2 and name hg*) 1.8 0 5.7
assign (segid b and resid 9 and name hb*) (segid a and resid 2 and name hg*) 1.8 0 5.7

assign (segid a and resid 10 and name ha) (segid a and resid 10 and name hd2*) 1.8 0 2.5
assign (segid b and resid 10 and name ha) (segid b and resid 10 and name hd2*) 1.8 0 2.5

assign (segid a and resid 10 and name hb*) (segid a and resid 10 and name hn) 1.8 0 2.1
assign (segid b and resid 10 and name hb*) (segid b and resid 10 and name hn) 1.8 0 2.1

assign (segid a and resid 10 and name hd1*) (segid a and resid 10 and name hn) 1.8 0 4.7
assign (segid b and resid 10 and name hd1*) (segid b and resid 10 and name hn) 1.8 0 4.7

assign (segid a and resid 10 and name hd2*) (segid a and resid 10 and name hn) 1.8 0 4.7
assign (segid b and resid 10 and name hd2*) (segid b and resid 10 and name hn) 1.8 0 4.7

!SEQ
assign (segid a and resid 9 and name hn) (segid a and resid 10 and name hn) 1.8 0 1.1
assign (segid b and resid 9 and name hn) (segid b and resid 10 and name hn) 1.8 0 1.1

assign (segid a and resid 9 and name ha) (segid a and resid 10 and name hn) 1.8 0 4.2
assign (segid b and resid 9 and name ha) (segid b and resid 10 and name hn) 1.8 0 4.2

assign (segid a and resid 9 and name hb*) (segid a and resid 10 and name hn) 1.8 0 2.2
assign (segid b and resid 9 and name hb*) (segid b and resid 10 and name hn) 1.8 0 2.2

assign (segid a and resid 11 and name hn) (segid a and resid 10 and name hn) 1.8 0 1.1
assign (segid b and resid 11 and name hn) (segid b and resid 10 and name hn) 1.8 0 1.1

!MED
assign (segid a and resid 6 and name ha) (segid a and resid 10 and name hn) 1.8 0 4.2
assign (segid b and resid 6 and name ha) (segid b and resid 10 and name hn) 1.8 0 4.2

assign (segid a and resid 7 and name ha) (segid a and resid 10 and name hn) 1.8 0 4.2
assign (segid b and resid 7 and name ha) (segid b and resid 10 and name hn) 1.8 0 4.2

assign (segid a and resid 7 and name ha) (segid a and resid 10 and name hb*) 1.8 0 2.5
assign (segid b and resid 7 and name ha) (segid b and resid 10 and name hb*) 1.8 0 2.5

assign (segid a and resid 7 and name ha) (segid a and resid 10 and name hd1*) 1.8 0 3.0
assign (segid b and resid 7 and name ha) (segid b and resid 10 and name hd1*) 1.8 0 3.0

assign (segid a and resid 8 and name ha) (segid a and resid 10 and name hn) 1.8 0 4.2
assign (segid b and resid 8 and name ha) (segid b and resid 10 and name hn) 1.8 0 4.2

assign (segid a and resid 8 and name hn) (segid a and resid 10 and name hn) 1.8 0 3.2
assign (segid b and resid 8 and name hn) (segid b and resid 10 and name hn) 1.8 0 3.2

assign (segid a and resid 12 and name hn) (segid a and resid 10 and name hn) 1.8 0 3.2
assign (segid b and resid 12 and name hn) (segid b and resid 10 and name hn) 1.8 0 3.2

assign (segid a and resid 13 and name hb) (segid a and resid 10 and name ha) 1.8 0 1.5
assign (segid b and resid 13 and name hb) (segid b and resid 10 and name ha) 1.8 0 1.5

assign (segid a and resid 13 and name hb) (segid a and resid 10 and name hd2*) 1.8 0 4.7
assign (segid b and resid 13 and name hb) (segid b and resid 10 and name hd2*) 1.8 0 4.7

assign (segid a and resid 13 and name hg*) (segid a and resid 10 and name hn) 1.8 0 7.1
assign (segid b and resid 13 and name hg*) (segid b and resid 10 and name hn) 1.8 0 7.1

assign (segid a and resid 13 and name hg*) (segid a and resid 10 and name hd1*) 1.8 0 5.9
assign (segid b and resid 13 and name hg*) (segid b and resid 10 and name hd1*) 1.8 0 5.9

assign (segid a and resid 13 and name hg*) (segid a and resid 10 and name hd2*) 1.8 0 7.6
assign (segid b and resid 13 and name hg*) (segid b and resid 10 and name hd2*) 1.8 0 7.6

!LONG
assign (segid a and resid 73 and name he*) (segid a and resid 10 and name hd2*) 1.8 0 7.1
assign (segid b and resid 73 and name he*) (segid b and resid 10 and name hd2*) 1.8 0 7.1

assign (segid a and resid 73 and name hz) (segid a and resid 10 and name hd2*) 1.8 0 4.7
assign (segid b and resid 73 and name hz) (segid b and resid 10 and name hd2*) 1.8 0 4.7

assign (segid a and resid 74 and name hb2) (segid a and resid 10 and name hd2*) 1.8 0 5.7
assign (segid b and resid 74 and name hb2) (segid b and resid 10 and name hd2*) 1.8 0 5.7

assign (segid a and resid 77 and name hg1*) (segid a and resid 10 and name hd2*) 1.8 0 4.5
assign (segid b and resid 77 and name hg1*) (segid b and resid 10 and name hd2*) 1.8 0 4.5

assign (segid a and resid 77 and name hg2*) (segid a and resid 10 and name hd2*) 1.8 0 6.2
assign (segid b and resid 77 and name hg2*) (segid b and resid 10 and name hd2*) 1.8 0 6.2

!INTER
assign (segid a and resid 3 and name ha) (segid b and resid 10 and name hd2*) 1.8 0 4.7
assign (segid b and resid 3 and name ha) (segid a and resid 10 and name hd2*) 1.8 0 4.7

assign (segid a and resid 3 and name hd2*) (segid b and resid 10 and name hd2*) 1.8 0 6.2
assign (segid b and resid 3 and name hd2*) (segid a and resid 10 and name hd2*) 1.8 0 6.2

assign (segid a and resid 6 and name hb*) (segid b and resid 10 and name hd1*) 1.8 0 4.5
assign (segid b and resid 6 and name hb*) (segid a and resid 10 and name hd1*) 1.8 0 4.5

assign (segid a and resid 10 and name hg) (segid b and resid 10 and name hd1*) 1.8 0 4.7
assign (segid b and resid 10 and name hg) (segid a and resid 10 and name hd1*) 1.8 0 4.7


!Ile 11a

!INTRA
assign (segid a and resid 11 and name hb) (segid a and resid 11 and name hn) 1.8 0 1.7
assign (segid b and resid 11 and name hb) (segid b and resid 11 and name hn) 1.8 0 1.7

!SEQ
assign (segid a and resid 10 and name ha) (segid a and resid 11 and name hn)  1.8 0 3.2
assign (segid b and resid 10 and name ha) (segid b and resid 11 and name hn)  1.8 0 3.2

!MED
assign (segid a and resid 8 and name ha) (segid a and resid 11 and name hn) 1.8 0 4.2
assign (segid b and resid 8 and name ha) (segid b and resid 11 and name hn) 1.8 0 4.2

assign (segid a and resid 9 and name ha) (segid a and resid 11 and name hn) 1.8 0 4.2
assign (segid b and resid 9 and name ha) (segid b and resid 11 and name hn) 1.8 0 4.2

!LONG

!INTER



!Asp 12

!INTRA
assign (segid a and resid 12 and name hb1) (segid a and resid 12 and name hn) 1.8 0 1.1
assign (segid b and resid 12 and name hb1) (segid b and resid 12 and name hn) 1.8 0 1.1

assign (segid a and resid 12 and name hb2) (segid a and resid 12 and name hn) 1.8 0 1.7
assign (segid b and resid 12 and name hb2) (segid b and resid 12 and name hn) 1.8 0 1.7

!SEQ
assign (segid a and resid 11 and name hn) (segid a and resid 12 and name hn) 1.8 0 1.1
assign (segid b and resid 11 and name hn) (segid b and resid 12 and name hn) 1.8 0 1.1

assign (segid a and resid 11 and name ha) (segid a and resid 12 and name hn) 1.8 0 4.2
assign (segid b and resid 11 and name ha) (segid b and resid 12 and name hn) 1.8 0 4.2

assign (segid a and resid 11 and name hb) (segid a and resid 12 and name hn) 1.8 0 1.1
assign (segid b and resid 11 and name hb) (segid b and resid 12 and name hn) 1.8 0 1.1

assign (segid a and resid 11 and name hg2*) (segid a and resid 12 and name hn) 1.8 0 5.7
assign (segid b and resid 11 and name hg2*) (segid b and resid 12 and name hn) 1.8 0 5.7

assign (segid a and resid 13 and name hg*) (segid a and resid 12 and name hn) 1.8 0 7.1
assign (segid b and resid 13 and name hg*) (segid b and resid 12 and name hn) 1.8 0 7.1

!MED
assign (segid a and resid 8 and name ha) (segid a and resid 12 and name hn) 1.8 0 4.2
assign (segid b and resid 8 and name ha) (segid b and resid 12 and name hn) 1.8 0 4.2

assign (segid a and resid 9 and name ha) (segid a and resid 12 and name hn) 1.8 0 4.2
assign (segid b and resid 9 and name ha) (segid b and resid 12 and name hn) 1.8 0 4.2

assign (segid a and resid 10 and name ha) (segid a and resid 12 and name hn) 1.8 0 4.2
assign (segid b and resid 10 and name ha) (segid b and resid 12 and name hn) 1.8 0 4.2

!LONG

!INTER



!Val 13

!INTRA
assign (segid a and resid 13 and name hb) (segid a and resid 13 and name hn) 1.8 0 1.1
assign (segid b and resid 13 and name hb) (segid b and resid 13 and name hn) 1.8 0 1.1

assign (segid a and resid 13 and name hg*) (segid a and resid 13 and name hn) 1.8 0 3.8
assign (segid b and resid 13 and name hg*) (segid b and resid 13 and name hn) 1.8 0 3.8

!SEQ
assign (segid a and resid 12 and name hn) (segid a and resid 13 and name hn) 1.8 0 1.1
assign (segid b and resid 12 and name hn) (segid b and resid 13 and name hn) 1.8 0 1.1

assign (segid a and resid 12 and name ha) (segid a and resid 13 and name hn) 1.8 0 4.2
assign (segid b and resid 12 and name ha) (segid b and resid 13 and name hn) 1.8 0 4.2

assign (segid a and resid 12 and name hb1) (segid a and resid 13 and name hn) 1.8 0 1.7
assign (segid b and resid 12 and name hb1) (segid b and resid 13 and name hn) 1.8 0 1.7

assign (segid a and resid 12 and name hb2) (segid a and resid 13 and name hn) 1.8 0 1.7
assign (segid b and resid 12 and name hb2) (segid b and resid 13 and name hn) 1.8 0 1.7

assign (segid a and resid 12 and name hb*) (segid a and resid 13 and name hg1*) 1.8 0 5.7
assign (segid b and resid 12 and name hb*) (segid b and resid 13 and name hg1*) 1.8 0 5.7

assign (segid a and resid 14 and name hn) (segid a and resid 13 and name hn) 1.8 0 1.1
assign (segid b and resid 14 and name hn) (segid b and resid 13 and name hn) 1.8 0 1.1

assign (segid a and resid 14 and name ha) (segid a and resid 13 and name hg2*) 1.8 0 4.7
assign (segid b and resid 14 and name ha) (segid b and resid 13 and name hg2*) 1.8 0 4.7

!MED
assign (segid a and resid 9 and name ha) (segid a and resid 13 and name hn) 1.8 0 4.2
assign (segid b and resid 9 and name ha) (segid b and resid 13 and name hn) 1.8 0 4.2

assign (segid a and resid 10 and name ha) (segid a and resid 13 and name hn) 1.8 0 1.7
assign (segid b and resid 10 and name ha) (segid b and resid 13 and name hn) 1.8 0 1.7

assign (segid a and resid 11 and name hn) (segid a and resid 13 and name hn) 1.8 0 3.2
assign (segid b and resid 11 and name hn) (segid b and resid 13 and name hn) 1.8 0 3.2

assign (segid a and resid 11 and name ha) (segid a and resid 13 and name hn) 1.8 0 4.2
assign (segid b and resid 11 and name ha) (segid b and resid 13 and name hn) 1.8 0 4.2

assign (segid a and resid 16 and name hb1) (segid a and resid 13 and name ha) 1.8 0 1.5
assign (segid b and resid 16 and name hb1) (segid b and resid 13 and name ha) 1.8 0 1.5

assign (segid a and resid 16 and name hb2) (segid a and resid 13 and name ha) 1.8 0 3.2
assign (segid b and resid 16 and name hb2) (segid b and resid 13 and name ha) 1.8 0 3.2

assign (segid a and resid 16 and name hb1) (segid a and resid 13 and name hg1*) 1.8 0 5.7
assign (segid b and resid 16 and name hb1) (segid b and resid 13 and name hg1*) 1.8 0 5.7

assign (segid a and resid 16 and name hg2) (segid a and resid 13 and name hg2*) 1.8 0 4.7
assign (segid b and resid 16 and name hg2) (segid b and resid 13 and name hg2*) 1.8 0 4.7

assign (segid a and resid 17 and name hd*) (segid a and resid 13 and name hg2*) 1.8 0 5.4
assign (segid b and resid 17 and name hd*) (segid b and resid 13 and name hg2*) 1.8 0 5.4

assign (segid a and resid 17 and name hd*) (segid a and resid 13 and name hg1*) 1.8 0 7.1
assign (segid b and resid 17 and name hd*) (segid b and resid 13 and name hg1*) 1.8 0 7.1

!LONG
assign (segid a and resid 35 and name ha) (segid a and resid 13 and name hg2*) 1.8 0 5.7
assign (segid b and resid 35 and name ha) (segid b and resid 13 and name hg2*) 1.8 0 5.7

assign (segid a and resid 35 and name hd1*) (segid a and resid 13 and name hg2*) 1.8 0 4.5
assign (segid b and resid 35 and name hd1*) (segid b and resid 13 and name hg2*) 1.8 0 4.5

assign (segid a and resid 35 and name hd2*) (segid a and resid 13 and name hg2*) 1.8 0 6.2
assign (segid b and resid 35 and name hd2*) (segid b and resid 13 and name hg2*) 1.8 0 6.2

assign (segid a and resid 73 and name hz) (segid a and resid 13 and name hg2*) 1.8 0 4.7
assign (segid b and resid 73 and name hz) (segid b and resid 13 and name hg2*) 1.8 0 4.7

!INTER
assign (segid a and resid 2 and name hb*) (segid b and resid 13 and name hg1*) 1.8 0 3.0
assign (segid b and resid 2 and name hb*) (segid a and resid 13 and name hg1*) 1.8 0 3.0

assign (segid a and resid 2 and name hb*) (segid b and resid 13 and name hg2*) 1.8 0 4.7
assign (segid b and resid 2 and name hb*) (segid a and resid 13 and name hg2*) 1.8 0 4.7

assign (segid a and resid 2 and name hg*) (segid b and resid 13 and name hg1*) 1.8 0 4.0
assign (segid b and resid 2 and name hg*) (segid a and resid 13 and name hg1*) 1.8 0 4.0

assign (segid a and resid 3 and name ha) (segid b and resid 13 and name hg1*) 1.8 0 4.7
assign (segid b and resid 3 and name ha) (segid a and resid 13 and name hg1*) 1.8 0 4.7

assign (segid a and resid 3 and name hb*) (segid b and resid 13 and name hg1*) 1.8 0 4.7
assign (segid b and resid 3 and name hb*) (segid a and resid 13 and name hg1*) 1.8 0 4.7

assign (segid a and resid 3 and name hb*) (segid b and resid 13 and name hg2*) 1.8 0 4.7
assign (segid b and resid 3 and name hb*) (segid a and resid 13 and name hg2*) 1.8 0 4.7

assign (segid a and resid 3 and name hd1*) (segid b and resid 13 and name hg1*) 1.8 0 4.5
assign (segid b and resid 3 and name hd1*) (segid a and resid 13 and name hg1*) 1.8 0 4.5

assign (segid a and resid 3 and name hd1*) (segid b and resid 13 and name hg2*) 1.8 0 4.5
assign (segid b and resid 3 and name hd1*) (segid a and resid 13 and name hg2*) 1.8 0 4.5

assign (segid a and resid 3 and name hd2*) (segid b and resid 13 and name hg2*) 1.8 0 6.2
assign (segid b and resid 3 and name hd2*) (segid a and resid 13 and name hg2*) 1.8 0 6.2

assign (segid a and resid 6 and name hb*) (segid b and resid 13 and name hg1*) 1.8 0 6.2
assign (segid b and resid 6 and name hb*) (segid a and resid 13 and name hg1*) 1.8 0 6.2



!Phe 14

!INTRA
assign (segid a and resid 14 and name hb1) (segid a and resid 14 and name hn) 1.8 0 1.7
assign (segid b and resid 14 and name hb1) (segid b and resid 14 and name hn) 1.8 0 1.7

assign (segid a and resid 14 and name hb2) (segid a and resid 14 and name hn) 1.8 0 1.1
assign (segid b and resid 14 and name hb2) (segid b and resid 14 and name hn) 1.8 0 1.1

assign (segid a and resid 14 and name hd*) (segid a and resid 14 and name hn) 1.8 0 6.6
assign (segid b and resid 14 and name hd*) (segid b and resid 14 and name hn) 1.8 0 6.6

!SEQ
assign (segid a and resid 13 and name ha) (segid a and resid 14 and name hn) 1.8 0 3.2
assign (segid b and resid 13 and name ha) (segid b and resid 14 and name hn) 1.8 0 3.2

assign (segid a and resid 13 and name hb) (segid a and resid 14 and name hn) 1.8 0 1.1
assign (segid b and resid 13 and name hb) (segid b and resid 14 and name hn) 1.8 0 1.1

assign (segid a and resid 13 and name hg2*) (segid a and resid 14 and name hn) 1.8 0 3.0
assign (segid b and resid 13 and name hg2*) (segid b and resid 14 and name hn) 1.8 0 3.0

assign (segid a and resid 15 and name hn) (segid a and resid 14 and name hn) 1.8 0 3.2
assign (segid b and resid 15 and name hn) (segid b and resid 14 and name hn) 1.8 0 3.2

!MED
assign (segid a and resid 10 and name ha) (segid a and resid 14 and name hn) 1.8 0 3.2
assign (segid b and resid 10 and name ha) (segid b and resid 14 and name hn) 1.8 0 3.2

assign (segid a and resid 11 and name ha) (segid a and resid 14 and name hn) 1.8 0 3.2
assign (segid b and resid 11 and name ha) (segid b and resid 14 and name hn) 1.8 0 3.2

assign (segid a and resid 11 and name ha) (segid a and resid 14 and name hb1) 1.8 0 3.2
assign (segid b and resid 11 and name ha) (segid b and resid 14 and name hb1) 1.8 0 3.2

assign (segid a and resid 12 and name hn) (segid a and resid 14 and name hn) 1.8 0 4.2
assign (segid b and resid 12 and name hn) (segid b and resid 14 and name hn) 1.8 0 4.2

assign (segid a and resid 16 and name hn) (segid a and resid 14 and name hn) 1.8 0 3.2
assign (segid b and resid 16 and name hn) (segid b and resid 14 and name hn) 1.8 0 3.2

assign (segid a and resid 17 and name hb*) (segid a and resid 14 and name ha) 1.8 0 5.2
assign (segid b and resid 17 and name hb*) (segid b and resid 14 and name ha) 1.8 0 5.2

!LONG
assign (segid a and resid 35 and name hd1*) (segid a and resid 14 and name hd*) 1.8 0 7.1
assign (segid b and resid 35 and name hd1*) (segid b and resid 14 and name hd*) 1.8 0 7.1

assign (segid a and resid 35 and name hd2*) (segid a and resid 14 and name hn) 1.8 0 5.7
assign (segid b and resid 35 and name hd2*) (segid b and resid 14 and name hn) 1.8 0 5.7

assign (segid a and resid 35 and name hd2*) (segid a and resid 14 and name ha) 1.8 0 4.7
assign (segid b and resid 35 and name hd2*) (segid b and resid 14 and name ha) 1.8 0 4.7

assign (segid a and resid 70 and name hb*) (segid a and resid 14 and name hd*) 1.8 0 7.6
assign (segid b and resid 70 and name hb*) (segid b and resid 14 and name hd*) 1.8 0 7.6

assign (segid a and resid 70 and name hd*) (segid a and resid 14 and name hd*) 1.8 0 8.0
assign (segid b and resid 70 and name hd*) (segid b and resid 14 and name hd*) 1.8 0 8.0

assign (segid a and resid 73 and name hd*) (segid a and resid 14 and name hn) 1.8 0 6.6
assign (segid b and resid 73 and name hd*) (segid b and resid 14 and name hn) 1.8 0 6.6

assign (segid a and resid 73 and name hz) (segid a and resid 14 and name hn) 1.8 0 3.2
assign (segid b and resid 73 and name hz) (segid b and resid 14 and name hn) 1.8 0 3.2

!INTER
assign (segid a and resid 3 and name hd1*) (segid b and resid 14 and name hn) 1.8 0 5.7
assign (segid b and resid 3 and name hd1*) (segid a and resid 14 and name hn) 1.8 0 5.7

assign (segid a and resid 87 and name hz) (segid b and resid 14 and name hd*) 1.8 0 5.6
assign (segid b and resid 87 and name hz) (segid a and resid 14 and name hd*) 1.8 0 5.6
	


!His 15

!INTRA
assign (segid a and resid 15 and name hb1) (segid a and resid 15 and name hn) 1.8 0 1.7
assign (segid b and resid 15 and name hb1) (segid b and resid 15 and name hn) 1.8 0 1.7

assign (segid a and resid 15 and name hb2) (segid a and resid 15 and name hn) 1.8 0 1.7
assign (segid b and resid 15 and name hb2) (segid b and resid 15 and name hn) 1.8 0 1.7

!SEQ
assign (segid a and resid 14 and name ha) (segid a and resid 15 and name hn) 1.8 0 4.2
assign (segid b and resid 14 and name ha) (segid b and resid 15 and name hn) 1.8 0 4.2

assign (segid a and resid 14 and name hb2) (segid a and resid 15 and name hn) 1.8 0 4.2
assign (segid b and resid 14 and name hb2) (segid b and resid 15 and name hn) 1.8 0 4.2

assign (segid a and resid 14 and name hd*) (segid a and resid 15 and name hn) 1.8 0 6.6
assign (segid b and resid 14 and name hd*) (segid b and resid 15 and name hn) 1.8 0 6.6

!MED
assign (segid a and resid 11 and name ha) (segid a and resid 15 and name hn) 1.8 0 4.2
assign (segid b and resid 11 and name ha) (segid b and resid 15 and name hn) 1.8 0 4.2

assign (segid a and resid 13 and name ha) (segid a and resid 15 and name hn) 1.8 0 4.2
assign (segid b and resid 13 and name ha) (segid b and resid 15 and name hn) 1.8 0 4.2

!LONG

!INTER



!Gln 16

!INTRA
assign (segid a and resid 16 and name hb1) (segid a and resid 16 and name hn) 1.8 0 1.7
assign (segid b and resid 16 and name hb1) (segid b and resid 16 and name hn) 1.8 0 1.7

assign (segid a and resid 16 and name hb2) (segid a and resid 16 and name hn) 1.8 0 1.1
assign (segid b and resid 16 and name hb2) (segid b and resid 16 and name hn) 1.8 0 1.1

!SEQ
assign (segid a and resid 15 and name hn) (segid a and resid 16 and name hn) 1.8 0 1.7
assign (segid b and resid 15 and name hn) (segid b and resid 16 and name hn) 1.8 0 1.7

assign (segid a and resid 15 and name ha) (segid a and resid 16 and name hn) 1.8 0 3.2
assign (segid b and resid 15 and name ha) (segid b and resid 16 and name hn) 1.8 0 3.2

assign (segid a and resid 15 and name hb1) (segid a and resid 16 and name hn) 1.8 0 4.2
assign (segid b and resid 15 and name hb1) (segid b and resid 16 and name hn) 1.8 0 4.2

assign (segid a and resid 15 and name hb2) (segid a and resid 16 and name hn) 1.8 0 4.2
assign (segid b and resid 15 and name hb2) (segid b and resid 16 and name hn) 1.8 0 4.2

assign (segid a and resid 17 and name hb*) (segid a and resid 16 and name hn) 1.8 0 4.2
assign (segid b and resid 17 and name hb*) (segid b and resid 16 and name hn) 1.8 0 4.2

!MED
assign (segid a and resid 13 and name ha) (segid a and resid 16 and name hn) 1.8 0 3.2
assign (segid b and resid 13 and name ha) (segid b and resid 16 and name hn) 1.8 0 3.2

assign (segid a and resid 13 and name hg*) (segid a and resid 16 and name hn) 1.8 0 6.6
assign (segid b and resid 13 and name hg*) (segid b and resid 16 and name hn) 1.8 0 6.6

!LONG

!INTER



!Tyr 17

!INTRA
assign (segid a and resid 17 and name hb*) (segid a and resid 17 and name hn) 1.8 0 2.1
assign (segid b and resid 17 and name hb*) (segid b and resid 17 and name hn) 1.8 0 2.1

!SEQ
assign (segid a and resid 16 and name hn) (segid a and resid 17 and name hn) 1.8 0 1.1
assign (segid b and resid 16 and name hn) (segid b and resid 17 and name hn) 1.8 0 1.1

assign (segid a and resid 16 and name ha) (segid a and resid 17 and name hn) 1.8 0 3.2
assign (segid b and resid 16 and name ha) (segid b and resid 17 and name hn) 1.8 0 3.2

assign (segid a and resid 16 and name hb1) (segid a and resid 17 and name hn) 1.8 0 1.7
assign (segid b and resid 16 and name hb1) (segid b and resid 17 and name hn) 1.8 0 1.7

assign (segid a and resid 16 and name hb2) (segid a and resid 17 and name hn) 1.8 0 1.7
assign (segid b and resid 16 and name hb2) (segid b and resid 17 and name hn) 1.8 0 1.7

assign (segid a and resid 16 and name hb2) (segid a and resid 17 and name hd*) 1.8 0 5.6
assign (segid b and resid 16 and name hb2) (segid b and resid 17 and name hd*) 1.8 0 5.6

assign (segid a and resid 16 and name hg2) (segid a and resid 17 and name hn) 1.8 0 3.2
assign (segid b and resid 16 and name hg2) (segid b and resid 17 and name hn) 1.8 0 3.2

assign (segid a and resid 18 and name hn) (segid a and resid 17 and name hn) 1.8 0 1.7
assign (segid b and resid 18 and name hn) (segid b and resid 17 and name hn) 1.8 0 1.7

assign (segid a and resid 18 and name ha) (segid a and resid 17 and name hn) 1.8 0 4.2
assign (segid b and resid 18 and name ha) (segid b and resid 17 and name hn) 1.8 0 4.2

assign (segid a and resid 18 and name hb*) (segid a and resid 17 and name hn) 1.8 0 5.2
assign (segid b and resid 18 and name hb*) (segid b and resid 17 and name hn) 1.8 0 5.2

!MED
assign (segid a and resid 13 and name ha) (segid a and resid 17 and name hn) 1.8 0 3.2
assign (segid b and resid 13 and name ha) (segid b and resid 17 and name hn) 1.8 0 3.2

assign (segid a and resid 13 and name hg*) (segid a and resid 17 and name hn) 1.8 0 7.1
assign (segid b and resid 13 and name hg*) (segid b and resid 17 and name hn) 1.8 0 7.1

assign (segid a and resid 15 and name ha) (segid a and resid 17 and name hn) 1.8 0 4.2
assign (segid b and resid 15 and name ha) (segid b and resid 17 and name hn) 1.8 0 4.2

assign (segid a and resid 20 and name hn) (segid a and resid 17 and name hn) 1.8 0 4.2
assign (segid b and resid 20 and name hn) (segid b and resid 17 and name hn) 1.8 0 4.2

!LONG
assign (segid a and resid 27 and name hd*) (segid a and resid 17 and name hb*) 1.8 0 5.9
assign (segid b and resid 27 and name hd*) (segid b and resid 17 and name hb*) 1.8 0 5.9

assign (segid a and resid 35 and name hd2*) (segid a and resid 17 and name hn) 1.8 0 4.7
assign (segid b and resid 35 and name hd2*) (segid b and resid 17 and name hn) 1.8 0 4.7

assign (segid a and resid 35 and name hd2*) (segid a and resid 17 and name hb*) 1.8 0 5.7
assign (segid b and resid 35 and name hd2*) (segid b and resid 17 and name hb*) 1.8 0 5.7

!INTER




!Ser 18

!INTRA

!SEQ
assign (segid a and resid 17 and name ha) (segid a and resid 18 and name hn) 1.8 0 3.2
assign (segid b and resid 17 and name ha) (segid b and resid 18 and name hn) 1.8 0 3.2

assign (segid a and resid 17 and name hb*) (segid a and resid 18 and name hn) 1.8 0 4.2
assign (segid b and resid 17 and name hb*) (segid b and resid 18 and name hn) 1.8 0 4.2

!MED
assign (segid a and resid 15 and name ha) (segid a and resid 18 and name hn) 1.8 0 3.2
assign (segid b and resid 15 and name ha) (segid b and resid 18 and name hn) 1.8 0 3.2

!LONG
assign (segid a and resid 27 and name hd*) (segid a and resid 18 and name hn) 1.8 0 6.6
assign (segid b and resid 27 and name hd*) (segid b and resid 18 and name hn) 1.8 0 6.6

!INTER




!Gly 19

!INTRA
assign (segid a and resid 19 and name ha1) (segid a and resid 19 and name hn) 1.8 0 1.1
assign (segid b and resid 19 and name ha1) (segid b and resid 19 and name hn) 1.8 0 1.1

assign (segid a and resid 19 and name ha2) (segid a and resid 19 and name hn) 1.8 0 1.1
assign (segid b and resid 19 and name ha2) (segid b and resid 19 and name hn) 1.8 0 1.1

!SEQ
assign (segid a and resid 18 and name hn) (segid a and resid 19 and name hn) 1.8 0 3.2
assign (segid b and resid 18 and name hn) (segid b and resid 19 and name hn) 1.8 0 3.2

assign (segid a and resid 18 and name hb*) (segid a and resid 19 and name hn) 1.8 0 4.2
assign (segid b and resid 18 and name hb*) (segid b and resid 19 and name hn) 1.8 0 4.2

assign (segid a and resid 20 and name hb*) (segid a and resid 19 and name hn) 1.8 0 4.2
assign (segid b and resid 20 and name hb*) (segid b and resid 19 and name hn) 1.8 0 4.2

!MED
assign (segid a and resid 15 and name ha) (segid a and resid 19 and name hn) 1.8 0 3.2
assign (segid b and resid 15 and name ha) (segid b and resid 19 and name hn) 1.8 0 3.2

assign (segid a and resid 17 and name hn) (segid a and resid 19 and name hn) 1.8 0 3.2
assign (segid b and resid 17 and name hn) (segid b and resid 19 and name hn) 1.8 0 3.2

assign (segid a and resid 17 and name hb*) (segid a and resid 19 and name hn) 1.8 0 4.2
assign (segid b and resid 17 and name hb*) (segid b and resid 19 and name hn) 1.8 0 4.2

!LONG

!INTER




!Arg 20

!INTRA
assign (segid a and resid 20 and name hb*) (segid a and resid 20 and name hn) 1.8 0 2.1
assign (segid b and resid 20 and name hb*) (segid b and resid 20 and name hn) 1.8 0 2.1

assign (segid a and resid 20 and name hg1) (segid a and resid 20 and name hn) 1.8 0 1.7
assign (segid b and resid 20 and name hg1) (segid b and resid 20 and name hn) 1.8 0 1.7

!SEQ
assign (segid a and resid 19 and name hn) (segid a and resid 20 and name hn) 1.8 0 3.2
assign (segid b and resid 19 and name hn) (segid b and resid 20 and name hn) 1.8 0 3.2

assign (segid a and resid 19 and name ha2) (segid a and resid 20 and name hn) 1.8 0 3.2
assign (segid b and resid 19 and name ha2) (segid b and resid 20 and name hn) 1.8 0 3.2

!MED
assign (segid a and resid 17 and name ha) (segid a and resid 20 and name hn) 1.8 0 3.2
assign (segid b and resid 17 and name ha) (segid b and resid 20 and name hn) 1.8 0 3.2

assign (segid a and resid 17 and name ha) (segid a and resid 20 and name hb*) 1.8 0 4.2
assign (segid b and resid 17 and name ha) (segid b and resid 20 and name hb*) 1.8 0 4.2

assign (segid a and resid 17 and name ha) (segid a and resid 20 and name hd*) 1.8 0 4.2
assign (segid b and resid 17 and name ha) (segid b and resid 20 and name hd*) 1.8 0 4.2

!LONG

!INTER




!Glu 21

!INTRA
assign (segid a and resid 21 and name hb1) (segid a and resid 21 and name hn) 1.8 0 1.7
assign (segid b and resid 21 and name hb1) (segid b and resid 21 and name hn) 1.8 0 1.7

assign (segid a and resid 21 and name hg*) (segid a and resid 21 and name hn) 1.8 0 2.7
assign (segid b and resid 21 and name hg*) (segid b and resid 21 and name hn) 1.8 0 2.7

!SEQ
assign (segid a and resid 20 and name hn) (segid a and resid 21 and name hn) 1.8 0 3.2
assign (segid b and resid 20 and name hn) (segid b and resid 21 and name hn) 1.8 0 3.2

assign (segid a and resid 20 and name ha) (segid a and resid 21 and name hn) 1.8 0 1.7
assign (segid b and resid 20 and name ha) (segid b and resid 21 and name hn) 1.8 0 1.7

assign (segid a and resid 20 and name hb*) (segid a and resid 21 and name hn) 1.8 0 4.2
assign (segid b and resid 20 and name hb*) (segid b and resid 21 and name hn) 1.8 0 4.2

!MED

!LONG




!Gly 22

!INTRA
assign (segid a and resid 22 and name ha1) (segid a and resid 22 and name hn) 1.8 0 1.7
assign (segid b and resid 22 and name ha1) (segid b and resid 22 and name hn) 1.8 0 1.7

assign (segid a and resid 22 and name ha2) (segid a and resid 22 and name hn) 1.8 0 1.1
assign (segid b and resid 22 and name ha2) (segid b and resid 22 and name hn) 1.8 0 1.1

!SEQ
assign (segid a and resid 21 and name hn) (segid a and resid 22 and name hn) 1.8 0 4.2
assign (segid b and resid 21 and name hn) (segid b and resid 22 and name hn) 1.8 0 4.2

assign (segid a and resid 21 and name hb1) (segid a and resid 22 and name hn) 1.8 0 1.7
assign (segid b and resid 21 and name hb1) (segid b and resid 22 and name hn) 1.8 0 1.7

assign (segid a and resid 21 and name hb2) (segid a and resid 22 and name hn) 1.8 0 1.7
assign (segid b and resid 21 and name hb2) (segid b and resid 22 and name hn) 1.8 0 1.7

assign (segid a and resid 21 and name hg*) (segid a and resid 22 and name hn) 1.8 0 2.7
assign (segid b and resid 21 and name hg*) (segid b and resid 22 and name hn) 1.8 0 2.7

!MED

!LONG

!INTER




!Asp 23

!INTRA
assign (segid a and resid 23 and name hb1) (segid a and resid 23 and name hn) 1.8 0 1.7
assign (segid b and resid 23 and name hb1) (segid b and resid 23 and name hn) 1.8 0 1.7

assign (segid a and resid 23 and name hb2) (segid a and resid 23 and name hn) 1.8 0 1.7
assign (segid b and resid 23 and name hb2) (segid b and resid 23 and name hn) 1.8 0 1.7

!SEQ
assign (segid a and resid 22 and name hn) (segid a and resid 23 and name hn) 1.8 0 4.2
assign (segid b and resid 22 and name hn) (segid b and resid 23 and name hn) 1.8 0 4.2

assign (segid a and resid 22 and name ha1) (segid a and resid 23 and name hn) 1.8 0 1.1
assign (segid b and resid 22 and name ha1) (segid b and resid 23 and name hn) 1.8 0 1.1

assign (segid a and resid 22 and name ha2) (segid a and resid 23 and name hn) 1.8 0 1.7
assign (segid b and resid 22 and name ha2) (segid b and resid 23 and name hn) 1.8 0 1.7

!MED
assign (segid a and resid 26 and name hg1) (segid a and resid 23 and name hn) 1.8 0 4.2
assign (segid b and resid 26 and name hg1) (segid b and resid 23 and name hn) 1.8 0 4.2

assign (segid a and resid 26 and name hg2) (segid a and resid 23 and name hn) 1.8 0 4.2
assign (segid b and resid 26 and name hg2) (segid b and resid 23 and name hn) 1.8 0 4.2

!LONG

!INTER



!Lys 24

!INTRA
assign (segid a and resid 24 and name hb*) (segid a and resid 24 and name hn) 1.8 0 2.7
assign (segid b and resid 24 and name hb*) (segid b and resid 24 and name hn) 1.8 0 2.7

!SEQ
assign (segid a and resid 23 and name ha) (segid a and resid 24 and name hn) 1.8 0 3.2
assign (segid b and resid 23 and name ha) (segid b and resid 24 and name hn) 1.8 0 3.2

assign (segid a and resid 23 and name hb1) (segid a and resid 24 and name hn) 1.8 0 3.2
assign (segid b and resid 23 and name hb1) (segid b and resid 24 and name hn) 1.8 0 3.2

assign (segid a and resid 23 and name hb2) (segid a and resid 24 and name hn) 1.8 0 3.2
assign (segid b and resid 23 and name hb2) (segid b and resid 24 and name hn) 1.8 0 3.2

!MED
assign (segid a and resid 26 and name hn) (segid a and resid 24 and name hn) 1.8 0 4.2
assign (segid b and resid 26 and name hn) (segid b and resid 24 and name hn) 1.8 0 4.2

!LONG

!INTER




!His 25

!INTRA
assign (segid a and resid 25 and name hb2) (segid a and resid 25 and name hn) 1.8 0 1.5
assign (segid b and resid 25 and name hb2) (segid b and resid 25 and name hn) 1.8 0 1.5

!SEQ
assign (segid a and resid 24 and name hn) (segid a and resid 25 and name hn) 1.8 0 4.2
assign (segid b and resid 24 and name hn) (segid b and resid 25 and name hn) 1.8 0 4.2

assign (segid a and resid 24 and name ha) (segid a and resid 25 and name hn) 1.8 0 4.2
assign (segid b and resid 24 and name ha) (segid b and resid 25 and name hn) 1.8 0 4.2

assign (segid a and resid 24 and name hb*) (segid a and resid 25 and name hn) 1.8 0 4.2
assign (segid b and resid 24 and name hb*) (segid b and resid 25 and name hn) 1.8 0 4.2

assign (segid a and resid 26 and name hn) (segid a and resid 25 and name hn) 1.8 0 1.1
assign (segid b and resid 26 and name hn) (segid b and resid 25 and name hn) 1.8 0 1.1

assign (segid a and resid 26 and name hg2) (segid a and resid 25 and name hn) 1.8 0 4.2
assign (segid b and resid 26 and name hg2) (segid b and resid 25 and name hn) 1.8 0 4.2

!MED

!LONG
assign (segid a and resid 14 and name he*) (segid a and resid 25 and name hn) 1.8 0 6.6
assign (segid b and resid 14 and name he*) (segid b and resid 25 and name hn) 1.8 0 6.6
 
assign (segid a and resid 18 and name ha) (segid a and resid 25 and name hn) 1.8 0 4.2
assign (segid b and resid 18 and name ha) (segid b and resid 25 and name hn) 1.8 0 4.2

!INTER




!Lys 26

!INTRA
assign (segid a and resid 26 and name hb*) (segid a and resid 26 and name hn) 1.8 0 2.1
assign (segid b and resid 26 and name hb*) (segid b and resid 26 and name hn) 1.8 0 2.1

!SEQ
assign (segid a and resid 25 and name ha) (segid a and resid 26 and name hn) 1.8 0 4.2
assign (segid b and resid 25 and name ha) (segid b and resid 26 and name hn) 1.8 0 4.2

assign (segid a and resid 25 and name hb1) (segid a and resid 26 and name hn) 1.8 0 4.2
assign (segid b and resid 25 and name hb1) (segid b and resid 26 and name hn) 1.8 0 4.2

assign (segid a and resid 25 and name hb2) (segid a and resid 26 and name hn) 1.8 0 3.2
assign (segid b and resid 25 and name hb2) (segid b and resid 26 and name hn) 1.8 0 3.2

assign (segid a and resid 27 and name hd*) (segid a and resid 26 and name hn) 1.8 0 7.1
assign (segid b and resid 27 and name hd*) (segid b and resid 26 and name hn) 1.8 0 7.1

!MED
assign (segid a and resid 23 and name hb1) (segid a and resid 26 and name hn) 1.8 0 4.2
assign (segid b and resid 23 and name hb1) (segid b and resid 26 and name hn) 1.8 0 4.2

assign (segid a and resid 23 and name hb2) (segid a and resid 26 and name hb*) 1.8 0 4.2
assign (segid b and resid 23 and name hb2) (segid b and resid 26 and name hb*) 1.8 0 4.2
	
assign (segid a and resid 24 and name ha) (segid a and resid 26 and name hn) 1.8 0 4.2
assign (segid b and resid 24 and name ha) (segid b and resid 26 and name hn) 1.8 0 4.2

!LONG
assign (segid a and resid 18 and name ha) (segid a and resid 26 and name hn) 1.8 0 4.2
assign (segid b and resid 18 and name ha) (segid b and resid 26 and name hn) 1.8 0 4.2

assign (segid a and resid 18 and name hb*) (segid a and resid 26 and name hn) 1.8 0 4.2
assign (segid b and resid 18 and name hb*) (segid b and resid 26 and name hn) 1.8 0 4.2

assign (segid a and resid 69 and name ha) (segid a and resid 26 and name ha) 1.8 0 1.5
assign (segid b and resid 69 and name ha) (segid b and resid 26 and name ha) 1.8 0 1.5

assign (segid a and resid 14 and name hz) (segid a and resid 26 and name hn) 1.8 0 4.2
assign (segid b and resid 14 and name hz) (segid b and resid 26 and name hn) 1.8 0 4.2

assign (segid a and resid 14 and name he*) (segid a and resid 26 and name hn) 1.8 0 6.6
assign (segid b and resid 14 and name he*) (segid b and resid 26 and name hn) 1.8 0 6.6

!INTER




!Leu 27

!INTRA
assign (segid a and resid 27 and name hb2) (segid a and resid 27 and name hn) 1.8 0 1.7
assign (segid b and resid 27 and name hb2) (segid b and resid 27 and name hn) 1.8 0 1.7

assign (segid a and resid 27 and name hd*) (segid a and resid 27 and name hn) 1.8 0 4.9
assign (segid b and resid 27 and name hd*) (segid b and resid 27 and name hn) 1.8 0 4.9

!SEQ
assign (segid a and resid 26 and name hn) (segid a and resid 27 and name hn) 1.8 0 4.2
assign (segid b and resid 26 and name hn) (segid b and resid 27 and name hn) 1.8 0 4.2

assign (segid a and resid 26 and name ha) (segid a and resid 27 and name hn) 1.8 0 1.1
assign (segid b and resid 26 and name ha) (segid b and resid 27 and name hn) 1.8 0 1.1

assign (segid a and resid 26 and name hb*) (segid a and resid 27 and name hn) 1.8 0 2.1
assign (segid b and resid 26 and name hb*) (segid b and resid 27 and name hn) 1.8 0 2.1

!MED
assign (segid a and resid 31 and name ha) (segid a and resid 27 and name hd*) 1.8 0 7.1
assign (segid b and resid 31 and name ha) (segid b and resid 27 and name hd*) 1.8 0 7.1

assign (segid a and resid 31 and name hb1) (segid a and resid 27 and name hd*) 1.8 0 6.1
assign (segid b and resid 31 and name hb1) (segid b and resid 27 and name hd*) 1.8 0 6.1

assign (segid a and resid 31 and name hb2) (segid a and resid 27 and name hd*) 1.8 0 6.1
assign (segid b and resid 31 and name hb2) (segid b and resid 27 and name hd*) 1.8 0 6.1

assign (segid a and resid 31 and name hg*) (segid a and resid 27 and name hd*) 1.8 0 7.1
assign (segid b and resid 31 and name hg*) (segid b and resid 27 and name hd*) 1.8 0 7.1

assign (segid a and resid 32 and name ha) (segid a and resid 27 and name hd*) 1.8 0 4.4
assign (segid b and resid 32 and name ha) (segid b and resid 27 and name hd*) 1.8 0 4.4

assign (segid a and resid 32 and name hb2) (segid a and resid 27 and name hd*) 1.8 0 6.1
assign (segid b and resid 32 and name hb2) (segid b and resid 27 and name hd*) 1.8 0 6.1

!LONG
assign (segid a and resid 14 and name hz) (segid a and resid 27 and name hn) 1.8 0 3.2
assign (segid b and resid 14 and name hz) (segid b and resid 27 and name hn) 1.8 0 3.2

assign (segid a and resid 17 and name hd*) (segid a and resid 27 and name hd*) 1.8 0 8.5
assign (segid b and resid 17 and name hd*) (segid b and resid 27 and name hd*) 1.8 0 8.5

assign (segid a and resid 18 and name ha) (segid a and resid 27 and name hd*) 1.8 0 6.1
assign (segid b and resid 18 and name ha) (segid b and resid 27 and name hd*) 1.8 0 6.1

assign (segid a and resid 67 and name ha) (segid a and resid 27 and name hn) 1.8 0 4.2
assign (segid b and resid 67 and name ha) (segid b and resid 27 and name hn) 1.8 0 4.2

assign (segid a and resid 68 and name hn) (segid a and resid 27 and name hn) 1.8 0 1.7
assign (segid b and resid 68 and name hn) (segid b and resid 27 and name hn) 1.8 0 1.7

assign (segid a and resid 68 and name hn) (segid a and resid 27 and name ha) 1.8 0 3.2
assign (segid b and resid 68 and name hn) (segid b and resid 27 and name ha) 1.8 0 3.2

assign (segid a and resid 68 and name ha) (segid a and resid 27 and name hn) 1.8 0 4.2
assign (segid b and resid 68 and name ha) (segid b and resid 27 and name hn) 1.8 0 4.2

assign (segid a and resid 68 and name hb2) (segid a and resid 27 and name hd*) 1.8 0 7.1
assign (segid b and resid 68 and name hb2) (segid b and resid 27 and name hd*) 1.8 0 7.1

assign (segid a and resid 69 and name ha) (segid a and resid 27 and name hn) 1.8 0 3.2
assign (segid b and resid 69 and name ha) (segid b and resid 27 and name hn) 1.8 0 3.2

assign (segid a and resid 73 and name hd*) (segid a and resid 27 and name hd*) 1.8 0 9.5
assign (segid b and resid 73 and name hd*) (segid b and resid 27 and name hd*) 1.8 0 9.5

assign (segid a and resid 73 and name he*) (segid a and resid 27 and name hd*) 1.8 0 9.5
assign (segid b and resid 73 and name he*) (segid b and resid 27 and name hd*) 1.8 0 9.5

!INTER




!Lys 28

!INTRA
assign (segid a and resid 28 and name hb2) (segid a and resid 28 and name hn) 1.8 0 1.7
assign (segid b and resid 28 and name hb2) (segid b and resid 28 and name hn) 1.8 0 1.7

assign (segid a and resid 28 and name hg*) (segid a and resid 28 and name hn) 1.8 0 2.7
assign (segid b and resid 28 and name hg*) (segid b and resid 28 and name hn) 1.8 0 2.7

!SEQ
assign (segid a and resid 27 and name hn) (segid a and resid 28 and name hn) 1.8 0 4.2
assign (segid b and resid 27 and name hn) (segid b and resid 28 and name hn) 1.8 0 4.2

assign (segid a and resid 27 and name ha) (segid a and resid 28 and name hn) 1.8 0 1.1
assign (segid b and resid 27 and name ha) (segid b and resid 28 and name hn) 1.8 0 1.1

assign (segid a and resid 27 and name hb2) (segid a and resid 28 and name hn) 1.8 0 4.2
assign (segid b and resid 27 and name hb2) (segid b and resid 28 and name hn) 1.8 0 4.2

assign (segid a and resid 27 and name hd*) (segid a and resid 28 and name hn) 1.8 0 5.1
assign (segid b and resid 27 and name hd*) (segid b and resid 28 and name hn) 1.8 0 5.1

assign (segid a and resid 29 and name hn) (segid a and resid 28 and name hn) 1.8 0 4.2
assign (segid b and resid 29 and name hn) (segid b and resid 28 and name hn) 1.8 0 4.2

!MED
assign (segid a and resid 31 and name hb1) (segid a and resid 28 and name hn) 1.8 0 3.2
assign (segid b and resid 31 and name hb1) (segid b and resid 28 and name hn) 1.8 0 3.2

assign (segid a and resid 31 and name hb2) (segid a and resid 28 and name hn) 1.8 0 4.2
assign (segid b and resid 31 and name hb2) (segid b and resid 28 and name hn) 1.8 0 4.2

assign (segid a and resid 31 and name hg*) (segid a and resid 28 and name hn) 1.8 0 4.2
assign (segid b and resid 31 and name hg*) (segid b and resid 28 and name hn) 1.8 0 4.2

assign (segid a and resid 31 and name hn) (segid a and resid 28 and name hn) 1.8 0 4.2
assign (segid b and resid 31 and name hn) (segid b and resid 28 and name hn) 1.8 0 4.2

assign (segid a and resid 32 and name hn) (segid a and resid 28 and name hn) 1.8 0 4.2
assign (segid b and resid 32 and name hn) (segid b and resid 28 and name hn) 1.8 0 4.2

assign (segid a and resid 32 and name ha) (segid a and resid 28 and name hn) 1.8 0 4.2
assign (segid b and resid 32 and name ha) (segid b and resid 28 and name hn) 1.8 0 4.2

!LONG
assign (segid a and resid 67 and name ha) (segid a and resid 28 and name ha) 1.8 0 1.1
assign (segid b and resid 67 and name ha) (segid b and resid 28 and name ha) 1.8 0 1.1

!INTER




!Lys 29

!INTRA
assign (segid a and resid 29 and name hb*) (segid a and resid 29 and name hn) 1.8 0 2.1
assign (segid b and resid 29 and name hb*) (segid b and resid 29 and name hn) 1.8 0 2.1

assign (segid a and resid 29 and name hg*) (segid a and resid 29 and name hn) 1.8 0 2.7
assign (segid b and resid 29 and name hg*) (segid b and resid 29 and name hn) 1.8 0 2.7

assign (segid a and resid 29 and name hd2) (segid a and resid 29 and name hn) 1.8 0 2.5
assign (segid b and resid 29 and name hd2) (segid b and resid 29 and name hn) 1.8 0 2.5

!SEQ
assign (segid a and resid 28 and name ha) (segid a and resid 29 and name hn) 1.8 0 1.1
assign (segid b and resid 28 and name ha) (segid b and resid 29 and name hn) 1.8 0 1.1

!MED
assign (segid a and resid 31 and name hn) (segid a and resid 29 and name hn) 1.8 0 4.2
assign (segid b and resid 31 and name hn) (segid b and resid 29 and name hn) 1.8 0 4.2

assign (segid a and resid 31 and name hb1) (segid a and resid 29 and name hn) 1.8 0 4.2
assign (segid b and resid 31 and name hb1) (segid b and resid 29 and name hn) 1.8 0 4.2

assign (segid a and resid 32 and name hn) (segid a and resid 29 and name hn) 1.8 0 4.2
assign (segid b and resid 32 and name hn) (segid b and resid 29 and name hn) 1.8 0 4.2

assign (segid a and resid 32 and name hb1) (segid a and resid 29 and name hn) 1.8 0 3.2
assign (segid b and resid 32 and name hb1) (segid b and resid 29 and name hn) 1.8 0 3.2

assign (segid a and resid 32 and name hb1) (segid a and resid 29 and name ha) 1.8 0 1.5
assign (segid b and resid 32 and name hb1) (segid b and resid 29 and name ha) 1.8 0 1.5

assign (segid a and resid 32 and name hb2) (segid a and resid 29 and name ha) 1.8 0 3.2
assign (segid b and resid 32 and name hb2) (segid b and resid 29 and name ha) 1.8 0 3.2

assign (segid a and resid 32 and name hd2*) (segid a and resid 29 and name hn) 1.8 0 5.7
assign (segid b and resid 32 and name hd2*) (segid b and resid 29 and name hn) 1.8 0 5.7

!LONG
assign (segid a and resid 60 and name hd2*) (segid a and resid 29 and name hn) 1.8 0 5.7
assign (segid b and resid 60 and name hd2*) (segid b and resid 29 and name hn) 1.8 0 5.7

assign (segid a and resid 60 and name hd2*) (segid a and resid 29 and name ha) 1.8 0 4.7
assign (segid b and resid 60 and name hd2*) (segid b and resid 29 and name ha) 1.8 0 4.7

assign (segid a and resid 67 and name hn) (segid a and resid 29 and name hn) 1.8 0 4.2
assign (segid b and resid 67 and name hn) (segid b and resid 29 and name hn) 1.8 0 4.2

assign (segid a and resid 67 and name ha) (segid a and resid 29 and name hn) 1.8 0 3.2
assign (segid b and resid 67 and name ha) (segid b and resid 29 and name hn) 1.8 0 3.2




!Ser 30

!INTRA
assign (segid a and resid 30 and name hb*) (segid a and resid 30 and name hn) 1.8 0 2.1
assign (segid b and resid 30 and name hb*) (segid b and resid 30 and name hn) 1.8 0 2.1

!SEQ
assign (segid a and resid 29 and name hn) (segid a and resid 30 and name hn) 1.8 0 1.7
assign (segid b and resid 29 and name hn) (segid b and resid 30 and name hn) 1.8 0 1.7

assign (segid a and resid 29 and name hb*) (segid a and resid 30 and name hn) 1.8 0 2.7
assign (segid b and resid 29 and name hb*) (segid b and resid 30 and name hn) 1.8 0 2.7

assign (segid a and resid 29 and name hg*) (segid a and resid 30 and name hn) 1.8 0 2.7
assign (segid b and resid 29 and name hg*) (segid b and resid 30 and name hn) 1.8 0 2.7

assign (segid a and resid 29 and name hd1) (segid a and resid 30 and name hn) 1.8 0 3.2
assign (segid b and resid 29 and name hd1) (segid b and resid 30 and name hn) 1.8 0 3.2

assign (segid a and resid 31 and name hn) (segid a and resid 30 and name hn) 1.8 0 1.1
assign (segid b and resid 31 and name hn) (segid b and resid 30 and name hn) 1.8 0 1.1

assign (segid a and resid 31 and name hb1) (segid a and resid 30 and name hn) 1.8 0 4.2
assign (segid b and resid 31 and name hb1) (segid b and resid 30 and name hn) 1.8 0 4.2

!MED
assign (segid a and resid 28 and name hn) (segid a and resid 30 and name hn) 1.8 0 3.2
assign (segid b and resid 28 and name hn) (segid b and resid 30 and name hn) 1.8 0 3.2

assign (segid a and resid 28 and name ha) (segid a and resid 30 and name hn) 1.8 0 4.2
assign (segid b and resid 28 and name ha) (segid b and resid 30 and name hn) 1.8 0 4.2

assign (segid a and resid 28 and name hb1) (segid a and resid 30 and name hn) 1.8 0 1.7
assign (segid b and resid 28 and name hb1) (segid b and resid 30 and name hn) 1.8 0 1.7

assign (segid a and resid 28 and name he*) (segid a and resid 30 and name hn) 1.8 0 4.2
assign (segid b and resid 28 and name he*) (segid b and resid 30 and name hn) 1.8 0 4.2

assign (segid a and resid 33 and name hb1) (segid a and resid 30 and name hn) 1.8 0 4.2
assign (segid b and resid 33 and name hb1) (segid b and resid 30 and name hn) 1.8 0 4.2

!LONG
assign (segid a and resid 60 and name hd2*) (segid a and resid 30 and name hn) 1.8 0 5.7
assign (segid b and resid 60 and name hd2*) (segid b and resid 30 and name hn) 1.8 0 5.7

assign (segid a and resid 64 and name ha*) (segid a and resid 30 and name hn) 1.8 0 4.2
assign (segid b and resid 64 and name ha*) (segid b and resid 30 and name hn) 1.8 0 4.2

assign (segid a and resid 64 and name hn) (segid a and resid 30 and name hn) 1.8 0 4.2
assign (segid b and resid 64 and name hn) (segid b and resid 30 and name hn) 1.8 0 4.2

assign (segid a and resid 65 and name hn) (segid a and resid 30 and name hn) 1.8 0 4.2
assign (segid b and resid 65 and name hn) (segid b and resid 30 and name hn) 1.8 0 4.2

!INTER




!Glu 31

!INTRA
assign (segid a and resid 31 and name hb1) (segid a and resid 31 and name hn) 1.8 0 1.1
assign (segid b and resid 31 and name hb1) (segid b and resid 31 and name hn) 1.8 0 1.1

assign (segid a and resid 31 and name hb2) (segid a and resid 31 and name hn) 1.8 0 1.7
assign (segid b and resid 31 and name hb2) (segid b and resid 31 and name hn) 1.8 0 1.7

assign (segid a and resid 31 and name hg*) (segid a and resid 31 and name hn) 1.8 0 2.7
assign (segid b and resid 31 and name hg*) (segid b and resid 31 and name hn) 1.8 0 2.7

!SEQ
assign (segid a and resid 30 and name ha) (segid a and resid 31 and name hn) 1.8 0 3.2
assign (segid b and resid 30 and name ha) (segid b and resid 31 and name hn) 1.8 0 3.2

assign (segid a and resid 30 and name hb*) (segid a and resid 31 and name hn) 1.8 0 4.2
assign (segid b and resid 30 and name hb*) (segid b and resid 31 and name hn) 1.8 0 4.2

assign (segid a and resid 32 and name hb2) (segid a and resid 31 and name hn) 1.8 0 3.2
assign (segid b and resid 32 and name hb2) (segid b and resid 31 and name hn) 1.8 0 3.2

!MED
assign (segid a and resid 27 and name hd*) (segid a and resid 31 and name hn) 1.8 0 5.6
assign (segid b and resid 27 and name hd*) (segid b and resid 31 and name hn) 1.8 0 5.6

assign (segid a and resid 28 and name hn) (segid a and resid 31 and name hn) 1.8 0 4.2
assign (segid b and resid 28 and name hn) (segid b and resid 31 and name hn) 1.8 0 4.2

assign (segid a and resid 28 and name ha) (segid a and resid 31 and name hn) 1.8 0 4.2
assign (segid b and resid 28 and name ha) (segid b and resid 31 and name hn) 1.8 0 4.2

assign (segid a and resid 28 and name hb1) (segid a and resid 31 and name hn) 1.8 0 3.2
assign (segid b and resid 28 and name hb1) (segid b and resid 31 and name hn) 1.8 0 3.2

assign (segid a and resid 28 and name hb2) (segid a and resid 31 and name hn) 1.8 0 1.7
assign (segid b and resid 28 and name hb2) (segid b and resid 31 and name hn) 1.8 0 1.7

assign (segid a and resid 28 and name hd*) (segid a and resid 31 and name hn) 1.8 0 4.2
assign (segid b and resid 28 and name hd*) (segid b and resid 31 and name hn) 1.8 0 4.2

assign (segid a and resid 29 and name hn) (segid a and resid 31 and name hn) 1.8 0 4.2
assign (segid b and resid 29 and name hn) (segid b and resid 31 and name hn) 1.8 0 4.2

assign (segid a and resid 33 and name hb1) (segid a and resid 31 and name hn) 1.8 0 4.2
assign (segid b and resid 33 and name hb1) (segid b and resid 31 and name hn) 1.8 0 4.2

assign (segid a and resid 34 and name hn) (segid a and resid 31 and name hn) 1.8 0 4.2
assign (segid b and resid 34 and name hn) (segid b and resid 31 and name hn) 1.8 0 4.2

assign (segid a and resid 34 and name hb1) (segid a and resid 31 and name ha) 1.8 0 1.5
assign (segid b and resid 34 and name hb1) (segid b and resid 31 and name ha) 1.8 0 1.5

assign (segid a and resid 35 and name hb2) (segid a and resid 31 and name hn) 1.8 0 4.2
assign (segid b and resid 35 and name hb2) (segid b and resid 31 and name hn) 1.8 0 4.2

!LONG

!INTER




!Leu 32

!INTRA
assign (segid a and resid 32 and name ha) (segid a and resid 32 and name hd1*) 1.8 0 2.4
assign (segid b and resid 32 and name ha) (segid b and resid 32 and name hd1*) 1.8 0 2.4

assign (segid a and resid 32 and name hb2) (segid a and resid 32 and name hn) 1.8 0 1.1
assign (segid b and resid 32 and name hb2) (segid b and resid 32 and name hn) 1.8 0 1.1

assign (segid a and resid 32 and name hd2*) (segid a and resid 32 and name hn) 1.8 0 4.7
assign (segid b and resid 32 and name hd2*) (segid b and resid 32 and name hn) 1.8 0 4.7

!SEQ
assign (segid a and resid 31 and name hn) (segid a and resid 32 and name hn) 1.8 0 1.1
assign (segid b and resid 31 and name hn) (segid b and resid 32 and name hn) 1.8 0 1.1

assign (segid a and resid 31 and name hb1) (segid a and resid 32 and name hn) 1.8 0 1.7
assign (segid b and resid 31 and name hb1) (segid b and resid 32 and name hn) 1.8 0 1.7

assign (segid a and resid 31 and name hb2) (segid a and resid 32 and name hn) 1.8 0 3.2
assign (segid b and resid 31 and name hb2) (segid b and resid 32 and name hn) 1.8 0 3.2

assign (segid a and resid 31 and name hg*) (segid a and resid 32 and name hn) 1.8 0 4.2
assign (segid b and resid 31 and name hg*) (segid b and resid 32 and name hn) 1.8 0 4.2

assign (segid a and resid 33 and name hb2) (segid a and resid 32 and name hn) 1.8 0 3.2
assign (segid b and resid 33 and name hb2) (segid b and resid 32 and name hn) 1.8 0 3.2

!MED
assign (segid a and resid 27 and name hb1) (segid a and resid 32 and name hn) 1.8 0 3.2
assign (segid b and resid 27 and name hb1) (segid b and resid 32 and name hn) 1.8 0 3.2

assign (segid a and resid 27 and name hd*) (segid a and resid 32 and name hn) 1.8 0 5.1
assign (segid b and resid 27 and name hd*) (segid b and resid 32 and name hn) 1.8 0 5.1

assign (segid a and resid 27 and name hd*) (segid a and resid 32 and name hd1*) 1.8 0 6.4
assign (segid b and resid 27 and name hd*) (segid b and resid 32 and name hd1*) 1.8 0 6.4

assign (segid a and resid 29 and name ha) (segid a and resid 32 and name hn) 1.8 0 1.7
assign (segid b and resid 29 and name ha) (segid b and resid 32 and name hn) 1.8 0 1.7

assign (segid a and resid 29 and name ha) (segid a and resid 32 and name hd2*) 1.8 0 4.7
assign (segid b and resid 29 and name ha) (segid b and resid 32 and name hd2*) 1.8 0 4.7

assign (segid a and resid 30 and name hn) (segid a and resid 32 and name hn) 1.8 0 4.2
assign (segid b and resid 30 and name hn) (segid b and resid 32 and name hn) 1.8 0 4.2

assign (segid a and resid 30 and name ha) (segid a and resid 32 and name hn) 1.8 0 4.2
assign (segid b and resid 30 and name ha) (segid b and resid 32 and name hn) 1.8 0 4.2

assign (segid a and resid 35 and name hn) (segid a and resid 32 and name hn) 1.8 0 4.2
assign (segid b and resid 35 and name hn) (segid b and resid 32 and name hn) 1.8 0 4.2

assign (segid a and resid 35 and name hb2) (segid a and resid 32 and name hd1*) 1.8 0 4.7
assign (segid b and resid 35 and name hb2) (segid b and resid 32 and name hd1*) 1.8 0 4.7

assign (segid a and resid 36 and name hd*) (segid a and resid 32 and name hd1*) 1.8 0 4.5
assign (segid b and resid 36 and name hd*) (segid b and resid 32 and name hd1*) 1.8 0 4.5

assign (segid a and resid 36 and name hd*) (segid a and resid 32 and name hd2*) 1.8 0 4.2
assign (segid b and resid 36 and name hd*) (segid b and resid 32 and name hd2*) 1.8 0 4.2

!LONG
assign (segid a and resid 60 and name hd1*) (segid a and resid 32 and name hn) 1.8 0 5.7
assign (segid b and resid 60 and name hd1*) (segid b and resid 32 and name hn) 1.8 0 5.7

assign (segid a and resid 60 and name hd1*) (segid a and resid 32 and name hd2*) 1.8 0 6.2
assign (segid b and resid 60 and name hd1*) (segid b and resid 32 and name hd2*) 1.8 0 6.2

assign (segid a and resid 60 and name hd2*) (segid a and resid 32 and name hn) 1.8 0 5.7
assign (segid b and resid 60 and name hd2*) (segid b and resid 32 and name hn) 1.8 0 5.7

assign (segid a and resid 60 and name hd2*) (segid a and resid 32 and name hd2*) 1.8 0 4.5
assign (segid b and resid 60 and name hd2*) (segid b and resid 32 and name hd2*) 1.8 0 4.5

assign (segid a and resid 60 and name hg) (segid a and resid 32 and name hd2*) 1.8 0 4.7
assign (segid b and resid 60 and name hg) (segid b and resid 32 and name hd2*) 1.8 0 4.7

assign (segid a and resid 73 and name ha) (segid a and resid 32 and name hd1*) 1.8 0 4.7
assign (segid b and resid 73 and name ha) (segid b and resid 32 and name hd1*) 1.8 0 4.7

assign (segid a and resid 73 and name ha) (segid a and resid 32 and name hd2*) 1.8 0 4.7
assign (segid b and resid 73 and name ha) (segid b and resid 32 and name hd2*) 1.8 0 4.7

assign (segid a and resid 73 and name hd*) (segid a and resid 32 and name hd1*) 1.8 0 7.1
assign (segid b and resid 73 and name hd*) (segid b and resid 32 and name hd1*) 1.8 0 7.1

assign (segid a and resid 76 and name hb1) (segid a and resid 32 and name hd2*) 1.8 0 4.7
assign (segid b and resid 76 and name hb1) (segid b and resid 32 and name hd2*) 1.8 0 4.7

assign (segid a and resid 76 and name hb2) (segid a and resid 32 and name hd2*) 1.8 0 4.7
assign (segid b and resid 76 and name hb2) (segid b and resid 32 and name hd2*) 1.8 0 4.7

assign (segid a and resid 76 and name hd*) (segid a and resid 32 and name hd2*) 1.8 0 7.1
assign (segid b and resid 76 and name hd*) (segid b and resid 32 and name hd2*) 1.8 0 7.1

!INTER




!Lys 33

!INTRA
assign (segid a and resid 33 and name hb1) (segid a and resid 33 and name hn) 1.8 0 1.1
assign (segid b and resid 33 and name hb1) (segid b and resid 33 and name hn) 1.8 0 1.1

!SEQ
assign (segid a and resid 32 and name hn) (segid a and resid 33 and name hn) 1.8 0 1.1
assign (segid b and resid 32 and name hn) (segid b and resid 33 and name hn) 1.8 0 1.1

assign (segid a and resid 32 and name ha) (segid a and resid 33 and name hn) 1.8 0 3.2
assign (segid b and resid 32 and name ha) (segid b and resid 33 and name hn) 1.8 0 3.2

assign (segid a and resid 32 and name hb1) (segid a and resid 33 and name hn) 1.8 0 1.1
assign (segid b and resid 32 and name hb1) (segid b and resid 33 and name hn) 1.8 0 1.1

assign (segid a and resid 32 and name hg) (segid a and resid 33 and name hn) 1.8 0 1.7
assign (segid b and resid 32 and name hg) (segid b and resid 33 and name hn) 1.8 0 1.7

assign (segid a and resid 32 and name hd2*) (segid a and resid 33 and name hn) 1.8 0 4.7
assign (segid b and resid 32 and name hd2*) (segid b and resid 33 and name hn) 1.8 0 4.7

assign (segid a and resid 34 and name ha) (segid a and resid 33 and name hn) 1.8 0 4.2
assign (segid b and resid 34 and name ha) (segid b and resid 33 and name hn) 1.8 0 4.2

!MED
assign (segid a and resid 29 and name ha) (segid a and resid 33 and name hn) 1.8 0 3.2
assign (segid b and resid 29 and name ha) (segid b and resid 33 and name hn) 1.8 0 3.2

assign (segid a and resid 29 and name hb*) (segid a and resid 33 and name hn) 1.8 0 4.2
assign (segid b and resid 29 and name hb*) (segid b and resid 33 and name hn) 1.8 0 4.2

assign (segid a and resid 30 and name ha) (segid a and resid 33 and name hn) 1.8 0 1.7
assign (segid b and resid 30 and name ha) (segid b and resid 33 and name hn) 1.8 0 1.7

assign (segid a and resid 30 and name ha) (segid a and resid 33 and name hb1) 1.8 0 1.5
assign (segid b and resid 30 and name ha) (segid b and resid 33 and name hb1) 1.8 0 1.5

assign (segid a and resid 30 and name ha) (segid a and resid 33 and name hb2) 1.8 0 4.2
assign (segid b and resid 30 and name ha) (segid b and resid 33 and name hb2) 1.8 0 4.2

assign (segid a and resid 31 and name hn) (segid a and resid 33 and name hn) 1.8 0 3.2
assign (segid b and resid 31 and name hn) (segid b and resid 33 and name hn) 1.8 0 3.2

assign (segid a and resid 31 and name hb1) (segid a and resid 33 and name hn) 1.8 0 4.2
assign (segid b and resid 31 and name hb1) (segid b and resid 33 and name hn) 1.8 0 4.2

!LONG
assign (segid a and resid 27 and name hd*) (segid a and resid 33 and name hn) 1.8 0 6.6
assign (segid b and resid 27 and name hd*) (segid b and resid 33 and name hn) 1.8 0 6.6
	
assign (segid a and resid 60 and name ha) (segid a and resid 33 and name hn) 1.8 0 4.2
assign (segid b and resid 60 and name ha) (segid b and resid 33 and name hn) 1.8 0 4.2

assign (segid a and resid 60 and name hd1*) (segid a and resid 33 and name hn) 1.8 0 3.2
assign (segid b and resid 60 and name hd1*) (segid b and resid 33 and name hn) 1.8 0 3.2

assign (segid a and resid 60 and name hd2*) (segid a and resid 33 and name hn) 1.8 0 4.7
assign (segid b and resid 60 and name hd2*) (segid b and resid 33 and name hn) 1.8 0 4.7

assign (segid a and resid 60 and name hd1*) (segid a and resid 33 and name ha) 1.8 0 4.7
assign (segid b and resid 60 and name hd1*) (segid b and resid 33 and name ha) 1.8 0 4.7

!INTER



!Glu 34

!INTRA
assign (segid a and resid 34 and name hg1) (segid a and resid 34 and name hn) 1.8 0 1.7
assign (segid b and resid 34 and name hg1) (segid b and resid 34 and name hn) 1.8 0 1.7

assign (segid a and resid 34 and name hg2) (segid a and resid 34 and name hn) 1.8 0 1.7
assign (segid b and resid 34 and name hg2) (segid b and resid 34 and name hn) 1.8 0 1.7

!SEQ
assign (segid a and resid 33 and name hn) (segid a and resid 34 and name hn) 1.8 0 1.1
assign (segid b and resid 33 and name hn) (segid b and resid 34 and name hn) 1.8 0 1.1

assign (segid a and resid 33 and name ha) (segid a and resid 34 and name hn) 1.8 0 3.2
assign (segid b and resid 33 and name ha) (segid b and resid 34 and name hn) 1.8 0 3.2

assign (segid a and resid 33 and name hb1) (segid a and resid 34 and name hn) 1.8 0 1.7
assign (segid b and resid 33 and name hb1) (segid b and resid 34 and name hn) 1.8 0 1.7

assign (segid a and resid 33 and name hb2) (segid a and resid 34 and name hn) 1.8 0 1.7
assign (segid b and resid 33 and name hb2) (segid b and resid 34 and name hn) 1.8 0 1.7

assign (segid a and resid 33 and name hg2) (segid a and resid 34 and name hn) 1.8 0 3.2
assign (segid b and resid 33 and name hg2) (segid b and resid 34 and name hn) 1.8 0 3.2

assign (segid a and resid 35 and name hb2) (segid a and resid 34 and name hn) 1.8 0 4.2
assign (segid b and resid 35 and name hb2) (segid b and resid 34 and name hn) 1.8 0 4.2

!MED
assign (segid a and resid 30 and name ha) (segid a and resid 34 and name hn) 1.8 0 4.2
assign (segid b and resid 30 and name ha) (segid b and resid 34 and name hn) 1.8 0 4.2

assign (segid a and resid 31 and name ha) (segid a and resid 34 and name hn) 1.8 0 3.2
assign (segid b and resid 31 and name ha) (segid b and resid 34 and name hn) 1.8 0 3.2

assign (segid a and resid 31 and name ha) (segid a and resid 34 and name hb2) 1.8 0 3.2
assign (segid b and resid 31 and name ha) (segid b and resid 34 and name hb2) 1.8 0 3.2

assign (segid a and resid 32 and name hn) (segid a and resid 34 and name hn) 1.8 0 4.2
assign (segid b and resid 32 and name hn) (segid b and resid 34 and name hn) 1.8 0 4.2

assign (segid a and resid 32 and name ha) (segid a and resid 34 and name hn) 1.8 0 4.2
assign (segid b and resid 32 and name ha) (segid b and resid 34 and name hn) 1.8 0 4.2

assign (segid a and resid 36 and name hg12) (segid a and resid 34 and name hn) 1.8 0 4.2
assign (segid b and resid 36 and name hg12) (segid b and resid 34 and name hn) 1.8 0 4.2

assign (segid a and resid 36 and name hd*) (segid a and resid 34 and name hn) 1.8 0 5.7
assign (segid b and resid 36 and name hd*) (segid b and resid 34 and name hn) 1.8 0 5.7

assign (segid a and resid 37 and name hb1) (segid a and resid 34 and name hn) 1.8 0 4.2
assign (segid b and resid 37 and name hb1) (segid b and resid 34 and name hn) 1.8 0 4.2

!LONG
assign (segid a and resid 17 and name he*) (segid a and resid 34 and name hn) 1.8 0 6.6
assign (segid b and resid 17 and name he*) (segid b and resid 34 and name hn) 1.8 0 6.6

assign (segid a and resid 60 and name hd1*) (segid a and resid 34 and name hn) 1.8 0 5.7
assign (segid b and resid 60 and name hd1*) (segid b and resid 34 and name hn) 1.8 0 5.7

!INTER



!Leu 35

!INTRA
assign (segid a and resid 35 and name ha) (segid a and resid 35 and name hd1*) 1.8 0 5.7
assign (segid b and resid 35 and name ha) (segid b and resid 35 and name hd1*) 1.8 0 5.7

assign (segid a and resid 35 and name hb1) (segid a and resid 35 and name hn) 1.8 0 1.7
assign (segid b and resid 35 and name hb1) (segid b and resid 35 and name hn) 1.8 0 1.7

assign (segid a and resid 35 and name hb2) (segid a and resid 35 and name hn) 1.8 0 1.1
assign (segid b and resid 35 and name hb2) (segid b and resid 35 and name hn) 1.8 0 1.1

!SEQ
assign (segid a and resid 34 and name hn) (segid a and resid 35 and name hn) 1.8 0 1.1
assign (segid b and resid 34 and name hn) (segid b and resid 35 and name hn) 1.8 0 1.1

assign (segid a and resid 34 and name ha) (segid a and resid 35 and name hn) 1.8 0 1.7
assign (segid b and resid 34 and name ha) (segid b and resid 35 and name hn) 1.8 0 1.7

assign (segid a and resid 34 and name hb1) (segid a and resid 35 and name hn) 1.8 0 1.7
assign (segid b and resid 34 and name hb1) (segid b and resid 35 and name hn) 1.8 0 1.7

assign (segid a and resid 34 and name hg1) (segid a and resid 35 and name hn) 1.8 0 3.2
assign (segid b and resid 34 and name hg1) (segid b and resid 35 and name hn) 1.8 0 3.2

assign (segid a and resid 34 and name hg2) (segid a and resid 35 and name hn) 1.8 0 3.2
assign (segid b and resid 34 and name hg2) (segid b and resid 35 and name hn) 1.8 0 3.2

assign (segid a and resid 36 and name hn) (segid a and resid 35 and name hn) 1.8 0 1.1
assign (segid b and resid 36 and name hn) (segid b and resid 35 and name hn) 1.8 0 1.1

assign (segid a and resid 36 and name ha) (segid a and resid 35 and name hd1*) 1.8 0 3.0
assign (segid b and resid 36 and name ha) (segid b and resid 35 and name hd1*) 1.8 0 3.0

assign (segid a and resid 36 and name hg2*) (segid a and resid 35 and name hd1*) 1.8 0 6.2
assign (segid b and resid 36 and name hg2*) (segid b and resid 35 and name hd1*) 1.8 0 6.2

assign (segid a and resid 36 and name hd*) (segid a and resid 35 and name hd1*) 1.8 0 6.2
assign (segid b and resid 36 and name hd*) (segid b and resid 35 and name hd1*) 1.8 0 6.2

!MED
assign (segid a and resid 32 and name ha) (segid a and resid 35 and name hn) 1.8 0 1.7
assign (segid b and resid 32 and name ha) (segid b and resid 35 and name hn) 1.8 0 1.7

assign (segid a and resid 32 and name ha) (segid a and resid 35 and name hb1) 1.8 0 3.2
assign (segid b and resid 32 and name ha) (segid b and resid 35 and name hb1) 1.8 0 3.2

assign (segid a and resid 32 and name ha) (segid a and resid 35 and name hb2) 1.8 0 3.2
assign (segid b and resid 32 and name ha) (segid b and resid 35 and name hb2) 1.8 0 3.2

assign (segid a and resid 32 and name ha) (segid a and resid 35 and name hd2*) 1.8 0 4.7
assign (segid b and resid 32 and name ha) (segid b and resid 35 and name hd2*) 1.8 0 4.7

assign (segid a and resid 32 and name hd1*) (segid a and resid 35 and name hd1*) 1.8 0 4.5
assign (segid b and resid 32 and name hd1*) (segid b and resid 35 and name hd1*) 1.8 0 4.5

assign (segid a and resid 32 and name hd1*) (segid a and resid 35 and name hd2*) 1.8 0 4.5
assign (segid b and resid 32 and name hd1*) (segid b and resid 35 and name hd2*) 1.8 0 4.5

assign (segid a and resid 33 and name hn) (segid a and resid 35 and name hn) 1.8 0 3.2
assign (segid b and resid 33 and name hn) (segid b and resid 35 and name hn) 1.8 0 3.2

assign (segid a and resid 33 and name hb1) (segid a and resid 35 and name hn) 1.8 0 4.2
assign (segid b and resid 33 and name hb1) (segid b and resid 35 and name hn) 1.8 0 4.2

assign (segid a and resid 32 and name hd1*) (segid a and resid 35 and name hn) 1.8 0 5.7
assign (segid b and resid 32 and name hd1*) (segid b and resid 35 and name hn) 1.8 0 5.7

assign (segid a and resid 37 and name hn) (segid a and resid 35 and name hn) 1.8 0 4.2
assign (segid b and resid 37 and name hn) (segid b and resid 35 and name hn) 1.8 0 4.2

assign (segid a and resid 38 and name hb2) (segid a and resid 35 and name ha) 1.8 0 4.2
assign (segid b and resid 38 and name hb2) (segid b and resid 35 and name ha) 1.8 0 4.2

assign (segid a and resid 39 and name hb*) (segid a and resid 35 and name hd1*) 1.8 0 5.7
assign (segid b and resid 39 and name hb*) (segid b and resid 35 and name hd1*) 1.8 0 5.7

assign (segid a and resid 39 and name hg2) (segid a and resid 35 and name hd1*) 1.8 0 4.7
assign (segid b and resid 39 and name hg2) (segid b and resid 35 and name hd1*) 1.8 0 4.7

!LONG
assign (segid a and resid 17 and name hd*) (segid a and resid 35 and name hn) 1.8 0 6.6
assign (segid b and resid 17 and name hd*) (segid b and resid 35 and name hn) 1.8 0 6.6

assign (segid a and resid 17 and name hd*) (segid a and resid 35 and name hd1*) 1.8 0 8.1
assign (segid b and resid 17 and name hd*) (segid b and resid 35 and name hd1*) 1.8 0 8.1

assign (segid a and resid 17 and name hd*) (segid a and resid 35 and name hd2*) 1.8 0 8.1
assign (segid b and resid 17 and name hd*) (segid b and resid 35 and name hd2*) 1.8 0 8.1

assign (segid a and resid 17 and name he*) (segid a and resid 35 and name hn) 1.8 0 5.6
assign (segid b and resid 17 and name he*) (segid b and resid 35 and name hn) 1.8 0 5.6

assign (segid a and resid 17 and name he*) (segid a and resid 35 and name hd1*) 1.8 0 8.1
assign (segid b and resid 17 and name he*) (segid b and resid 35 and name hd1*) 1.8 0 8.1

assign (segid a and resid 27 and name hd*) (segid a and resid 35 and name hd2*) 1.8 0 5.4
assign (segid b and resid 27 and name hd*) (segid b and resid 35 and name hd2*) 1.8 0 5.4

assign (segid a and resid 73 and name he*) (segid a and resid 35 and name hd1*) 1.8 0 7.1
assign (segid b and resid 73 and name he*) (segid b and resid 35 and name hd1*) 1.8 0 7.1

assign (segid a and resid 73 and name he*) (segid a and resid 35 and name hd2*) 1.8 0 7.1
assign (segid b and resid 73 and name he*) (segid b and resid 35 and name hd2*) 1.8 0 7.1

assign (segid a and resid 73 and name hz) (segid a and resid 35 and name hd1*) 1.8 0 4.7
assign (segid b and resid 73 and name hz) (segid b and resid 35 and name hd1*) 1.8 0 4.7

assign (segid a and resid 73 and name hz) (segid a and resid 35 and name hd2*) 1.8 0 5.7
assign (segid b and resid 73 and name hz) (segid b and resid 35 and name hd2*) 1.8 0 5.7

assign (segid a and resid 3 and name hd1*) (segid b and resid 35 and name hd1*) 1.8 0 6.2
assign (segid b and resid 3 and name hd1*) (segid a and resid 35 and name hd1*) 1.8 0 6.2

assign (segid a and resid 3 and name hd2*) (segid b and resid 35 and name hd1*) 1.8 0 4.5
assign (segid b and resid 3 and name hd2*) (segid a and resid 35 and name hd1*) 1.8 0 4.5




!Ile 36

!INTRA
assign (segid a and resid 36 and name ha) (segid a and resid 36 and name hg2*) 1.8 0 3.0
assign (segid b and resid 36 and name ha) (segid b and resid 36 and name hg2*) 1.8 0 3.0

assign (segid a and resid 36 and name ha) (segid a and resid 36 and name hd*) 1.8 0 4.7
assign (segid b and resid 36 and name ha) (segid b and resid 36 and name hd*) 1.8 0 4.7

assign (segid a and resid 36 and name hb) (segid a and resid 36 and name hn) 1.8 0 1.1
assign (segid b and resid 36 and name hb) (segid b and resid 36 and name hn) 1.8 0 1.1

assign (segid a and resid 36 and name hg2*) (segid a and resid 36 and name hn) 1.8 0 4.7
assign (segid b and resid 36 and name hg2*) (segid b and resid 36 and name hn) 1.8 0 4.7

assign (segid a and resid 36 and name hd*) (segid a and resid 36 and name hn) 1.8 0 4.7
assign (segid b and resid 36 and name hd*) (segid b and resid 36 and name hn) 1.8 0 4.7

!SEQ
assign (segid a and resid 35 and name ha) (segid a and resid 36 and name hn) 1.8 0 3.2
assign (segid b and resid 35 and name ha) (segid b and resid 36 and name hn) 1.8 0 3.2

assign (segid a and resid 35 and name hb2) (segid a and resid 36 and name hn) 1.8 0 1.7
assign (segid b and resid 35 and name hb2) (segid b and resid 36 and name hn) 1.8 0 1.7


assign (segid a and resid 35 and name hd1*) (segid a and resid 36 and name hn) 1.8 0 4.7
assign (segid b and resid 35 and name hd1*) (segid b and resid 36 and name hn) 1.8 0 4.7

assign (segid a and resid 35 and name hd2*) (segid a and resid 36 and name hn) 1.8 0 4.7
assign (segid b and resid 35 and name hd2*) (segid b and resid 36 and name hn) 1.8 0 4.7

assign (segid a and resid 37 and name ha) (segid a and resid 36 and name hg2*) 1.8 0 4.7
assign (segid b and resid 37 and name ha) (segid b and resid 36 and name hg2*) 1.8 0 4.7

!MED
assign (segid a and resid 32 and name ha) (segid a and resid 36 and name hn) 1.8 0 3.2
assign (segid b and resid 32 and name ha) (segid b and resid 36 and name hn) 1.8 0 3.2

assign (segid a and resid 32 and name hg) (segid a and resid 36 and name hn) 1.8 0 4.2
assign (segid b and resid 32 and name hg) (segid b and resid 36 and name hn) 1.8 0 4.2

assign (segid a and resid 32 and name hg) (segid a and resid 36 and name hd*) 1.8 0 4.7
assign (segid b and resid 32 and name hg) (segid b and resid 36 and name hd*) 1.8 0 4.7

assign (segid a and resid 32 and name hd1*) (segid a and resid 36 and name hn) 1.8 0 3.2
assign (segid b and resid 32 and name hd1*) (segid b and resid 36 and name hn) 1.8 0 3.2

assign (segid a and resid 32 and name hd1*) (segid a and resid 36 and name hd*) 1.8 0 4.5
assign (segid b and resid 32 and name hd1*) (segid b and resid 36 and name hd*) 1.8 0 4.5

assign (segid a and resid 33 and name ha) (segid a and resid 36 and name hn) 1.8 0 3.2
assign (segid b and resid 33 and name ha) (segid b and resid 36 and name hn) 1.8 0 3.2

assign (segid a and resid 33 and name ha) (segid a and resid 36 and name hb) 1.8 0 3.2
assign (segid b and resid 33 and name ha) (segid b and resid 36 and name hb) 1.8 0 3.2

assign (segid a and resid 34 and name hn) (segid a and resid 36 and name hn) 1.8 0 4.2
assign (segid b and resid 34 and name hn) (segid b and resid 36 and name hn) 1.8 0 4.2

assign (segid a and resid 38 and name hn) (segid a and resid 36 and name hn) 1.8 0 3.2
assign (segid b and resid 38 and name hn) (segid b and resid 36 and name hn) 1.8 0 3.2

assign (segid a and resid 40 and name hg) (segid a and resid 36 and name hg2*) 1.8 0 6.7
assign (segid b and resid 40 and name hg) (segid b and resid 36 and name hg2*) 1.8 0 6.7

!LONG
assign (segid a and resid 56 and name hg2*) (segid a and resid 36 and name hd*) 1.8 0 4.5
assign (segid b and resid 56 and name hg2*) (segid b and resid 36 and name hd*) 1.8 0 4.5

assign (segid a and resid 56 and name hg2*) (segid a and resid 36 and name hg2*) 1.8 0 6.2
assign (segid b and resid 56 and name hg2*) (segid b and resid 36 and name hg2*) 1.8 0 6.2

assign (segid a and resid 60 and name hd2*) (segid a and resid 36 and name hd*) 1.8 0 6.2
assign (segid b and resid 60 and name hd2*) (segid b and resid 36 and name hd*) 1.8 0 6.2

assign (segid a and resid 76 and name hb1) (segid a and resid 36 and name hd*) 1.8 0 5.7
assign (segid b and resid 76 and name hb1) (segid b and resid 36 and name hd*) 1.8 0 5.7

assign (segid a and resid 76 and name hb2) (segid a and resid 36 and name hd*) 1.8 0 4.7
assign (segid b and resid 76 and name hb2) (segid b and resid 36 and name hd*) 1.8 0 4.7

assign (segid a and resid 77 and name ha) (segid a and resid 36 and name hd*) 1.8 0 4.7
assign (segid b and resid 77 and name ha) (segid b and resid 36 and name hd*) 1.8 0 4.7

assign (segid a and resid 80 and name hg2*) (segid a and resid 36 and name hg2*) 1.8 0 4.5
assign (segid b and resid 80 and name hg2*) (segid b and resid 36 and name hg2*) 1.8 0 4.5

!INTER
assign (segid a and resid 3 and name hd2*) (segid b and resid 36 and name hg2*) 1.8 0 6.2
assign (segid b and resid 3 and name hd2*) (segid a and resid 36 and name hg2*) 1.8 0 6.2



!Asn 37

!INTRA
assign (segid a and resid 37 and name hb1) (segid a and resid 37 and name hn) 1.8 0 1.1
assign (segid b and resid 37 and name hb1) (segid b and resid 37 and name hn) 1.8 0 1.1

assign (segid a and resid 37 and name hb2) (segid a and resid 37 and name hn) 1.8 0 1.7
assign (segid b and resid 37 and name hb2) (segid b and resid 37 and name hn) 1.8 0 1.7

assign (segid a and resid 37 and name hd22) (segid a and resid 37 and name hn) 1.8 0 4.2
assign (segid b and resid 37 and name hd22) (segid b and resid 37 and name hn) 1.8 0 4.2

!SEQ
assign (segid a and resid 36 and name hn) (segid a and resid 37 and name hn) 1.8 0 1.1
assign (segid b and resid 36 and name hn) (segid b and resid 37 and name hn) 1.8 0 1.1

assign (segid a and resid 36 and name ha) (segid a and resid 37 and name hn) 1.8 0 3.2
assign (segid b and resid 36 and name ha) (segid b and resid 37 and name hn) 1.8 0 3.2

assign (segid a and resid 36 and name hb) (segid a and resid 37 and name hn) 1.8 0 1.7
assign (segid b and resid 36 and name hb) (segid b and resid 37 and name hn) 1.8 0 1.7

assign (segid a and resid 36 and name hg11) (segid a and resid 37 and name hn) 1.8 0 1.7
assign (segid b and resid 36 and name hg11) (segid b and resid 37 and name hn) 1.8 0 1.7

assign (segid a and resid 36 and name hg12) (segid a and resid 37 and name hn) 1.8 0 3.2
assign (segid b and resid 36 and name hg12) (segid b and resid 37 and name hn) 1.8 0 3.2

assign (segid a and resid 36 and name hg2*) (segid a and resid 37 and name hn) 1.8 0 3.2
assign (segid b and resid 36 and name hg2*) (segid b and resid 37 and name hn) 1.8 0 3.2

assign (segid a and resid 36 and name hd*) (segid a and resid 37 and name hn) 1.8 0 4.7
assign (segid b and resid 36 and name hd*) (segid b and resid 37 and name hn) 1.8 0 4.7

assign (segid a and resid 38 and name hn) (segid a and resid 37 and name hn) 1.8 0 1.1
assign (segid b and resid 38 and name hn) (segid b and resid 37 and name hn) 1.8 0 1.1

assign (segid a and resid 38 and name hb1) (segid a and resid 37 and name hn) 1.8 0 4.2
assign (segid b and resid 38 and name hb1) (segid b and resid 37 and name hn) 1.8 0 4.2

!MED
assign (segid a and resid 33 and name ha) (segid a and resid 37 and name hn) 1.8 0 4.2
assign (segid b and resid 33 and name ha) (segid b and resid 37 and name hn) 1.8 0 4.2

assign (segid a and resid 33 and name hg2) (segid a and resid 37 and name hn) 1.8 0 4.2
assign (segid b and resid 33 and name hg2) (segid b and resid 37 and name hn) 1.8 0 4.2

assign (segid a and resid 34 and name hn) (segid a and resid 37 and name hn) 1.8 0 4.2
assign (segid b and resid 34 and name hn) (segid b and resid 37 and name hn) 1.8 0 4.2

assign (segid a and resid 34 and name ha) (segid a and resid 37 and name hn) 1.8 0 1.7
assign (segid b and resid 34 and name ha) (segid b and resid 37 and name hn) 1.8 0 1.7

assign (segid a and resid 34 and name ha) (segid a and resid 37 and name hb1) 1.8 0 3.2
assign (segid b and resid 34 and name ha) (segid b and resid 37 and name hb1) 1.8 0 3.2

assign (segid a and resid 34 and name ha) (segid a and resid 37 and name hb2) 1.8 0 4.2
assign (segid b and resid 34 and name ha) (segid b and resid 37 and name hb2) 1.8 0 4.2

assign (segid a and resid 35 and name hn) (segid a and resid 37 and name hn) 1.8 0 4.2
assign (segid b and resid 35 and name hn) (segid b and resid 37 and name hn) 1.8 0 4.2

assign (segid a and resid 39 and name hn) (segid a and resid 37 and name hn) 1.8 0 4.2
assign (segid b and resid 39 and name hn) (segid b and resid 37 and name hn) 1.8 0 4.2

assign (segid a and resid 40 and name hd1*) (segid a and resid 37 and name hn) 1.8 0 5.7
assign (segid b and resid 40 and name hd1*) (segid b and resid 37 and name hn) 1.8 0 5.7

!LONG
assign (segid a and resid 60 and name hd1*) (segid a and resid 37 and name hn) 1.8 0 5.7
assign (segid b and resid 60 and name hd1*) (segid b and resid 37 and name hn) 1.8 0 5.7

assign (segid a and resid 80 and name hg1*) (segid a and resid 37 and name hn) 1.8 0 5.7
assign (segid b and resid 80 and name hg1*) (segid b and resid 37 and name hn) 1.8 0 5.7

!INTER
assign (segid a and resid 3 and name hd2*) (segid b and resid 37 and name ha) 1.8 0 5.7
assign (segid b and resid 3 and name hd2*) (segid a and resid 37 and name ha) 1.8 0 5.7




!Asn 38

!INTRA
assign (segid a and resid 38 and name hb1) (segid a and resid 38 and name hn) 1.8 0 1.1
assign (segid b and resid 38 and name hb1) (segid b and resid 38 and name hn) 1.8 0 1.1

assign (segid a and resid 38 and name hb2) (segid a and resid 38 and name hn) 1.8 0 1.1
assign (segid b and resid 38 and name hb2) (segid b and resid 38 and name hn) 1.8 0 1.1

!SEQ
assign (segid a and resid 37 and name ha) (segid a and resid 38 and name hn) 1.8 0 3.2
assign (segid b and resid 37 and name ha) (segid b and resid 38 and name hn) 1.8 0 3.2

assign (segid a and resid 37 and name hb1) (segid a and resid 38 and name hn) 1.8 0 1.7
assign (segid b and resid 37 and name hb1) (segid b and resid 38 and name hn) 1.8 0 1.7


!MED
assign (segid a and resid 34 and name ha) (segid a and resid 38 and name hn) 1.8 0 3.2
assign (segid b and resid 34 and name ha) (segid b and resid 38 and name hn) 1.8 0 3.2

assign (segid a and resid 35 and name ha) (segid a and resid 38 and name hn) 1.8 0 3.2
assign (segid b and resid 35 and name ha) (segid b and resid 38 and name hn) 1.8 0 3.2

assign (segid a and resid 36 and name hn) (segid a and resid 38 and name hn) 1.8 0 3.2
assign (segid b and resid 36 and name hn) (segid b and resid 38 and name hn) 1.8 0 3.2

!LONG

!INTER



!Glu 39

!INTRA
assign (segid a and resid 39 and name hb*) (segid a and resid 39 and name hn) 1.8 0 2.7
assign (segid b and resid 39 and name hb*) (segid b and resid 39 and name hn) 1.8 0 2.7

!SEQ
assign (segid a and resid 38 and name hn) (segid a and resid 39 and name hn) 1.8 0 1.7
assign (segid b and resid 38 and name hn) (segid b and resid 39 and name hn) 1.8 0 1.7

assign (segid a and resid 38 and name hb1) (segid a and resid 39 and name hn) 1.8 0 1.7
assign (segid b and resid 38 and name hb1) (segid b and resid 39 and name hn) 1.8 0 1.7

assign (segid a and resid 38 and name hd22) (segid a and resid 39 and name hn) 1.8 0 3.2
assign (segid b and resid 38 and name hd22) (segid b and resid 39 and name hn) 1.8 0 3.2

assign (segid a and resid 40 and name hg) (segid a and resid 38 and name hn) 1.8 0 5.2
assign (segid b and resid 40 and name hg) (segid b and resid 38 and name hn) 1.8 0 5.2

!MED
assign (segid a and resid 35 and name ha) (segid a and resid 39 and name hn) 1.8 0 3.2
assign (segid b and resid 35 and name ha) (segid b and resid 39 and name hn) 1.8 0 3.2

assign (segid a and resid 35 and name hd1*) (segid a and resid 39 and name hn) 1.8 0 4.7
assign (segid b and resid 35 and name hd1*) (segid b and resid 39 and name hn) 1.8 0 4.7

assign (segid a and resid 36 and name ha) (segid a and resid 39 and name hn) 1.8 0 3.2
assign (segid b and resid 36 and name ha) (segid b and resid 39 and name hn) 1.8 0 3.2

assign (segid a and resid 36 and name hn) (segid a and resid 39 and name hn) 1.8 0 4.2
assign (segid b and resid 36 and name hn) (segid b and resid 39 and name hn) 1.8 0 4.2

!LONG

!INTER
assign (segid a and resid 3 and name hd2*) (segid b and resid 39 and name hn) 1.8 0 4.7
assign (segid b and resid 3 and name hd2*) (segid a and resid 39 and name hn) 1.8 0 4.7





!Leu 40

!INTRA
assign (segid a and resid 40 and name ha) (segid a and resid 40 and name hd2*) 1.8 0 3.0
assign (segid b and resid 40 and name ha) (segid b and resid 40 and name hd2*) 1.8 0 3.0

assign (segid a and resid 40 and name hb1) (segid a and resid 40 and name hn) 1.8 0 1.7
assign (segid b and resid 40 and name hb1) (segid b and resid 40 and name hn) 1.8 0 1.7

assign (segid a and resid 40 and name hd1*) (segid a and resid 40 and name hn) 1.8 0 4.7
assign (segid b and resid 40 and name hd1*) (segid b and resid 40 and name hn) 1.8 0 4.7

!SEQ
assign (segid a and resid 39 and name hn) (segid a and resid 40 and name hn) 1.8 0 1.7
assign (segid b and resid 39 and name hn) (segid b and resid 40 and name hn) 1.8 0 1.7

assign (segid a and resid 39 and name ha) (segid a and resid 40 and name hn) 1.8 0 4.2
assign (segid b and resid 39 and name ha) (segid b and resid 40 and name hn) 1.8 0 4.2

assign (segid a and resid 39 and name hb*) (segid a and resid 40 and name hn) 1.8 0 2.7
assign (segid b and resid 39 and name hb*) (segid b and resid 40 and name hn) 1.8 0 2.7

assign (segid a and resid 41 and name hb*) (segid a and resid 40 and name hn) 1.8 0 5.2
assign (segid b and resid 41 and name hb*) (segid b and resid 40 and name hn) 1.8 0 5.2

!MED
assign (segid a and resid 35 and name hd1*) (segid a and resid 40 and name hn) 1.8 0 4.7
assign (segid b and resid 35 and name hd1*) (segid b and resid 40 and name hn) 1.8 0 4.7

assign (segid a and resid 35 and name hd1*) (segid a and resid 40 and name hd1*) 1.8 0 6.2
assign (segid b and resid 35 and name hd1*) (segid b and resid 40 and name hd1*) 1.8 0 6.2

assign (segid a and resid 36 and name ha) (segid a and resid 40 and name hn) 1.8 0 3.2
assign (segid b and resid 36 and name ha) (segid b and resid 40 and name hn) 1.8 0 3.2

assign (segid a and resid 36 and name ha) (segid a and resid 40 and name hd1*) 1.8 0 3.0
assign (segid b and resid 36 and name ha) (segid b and resid 40 and name hd1*) 1.8 0 3.0

assign (segid a and resid 36 and name hg2*) (segid a and resid 40 and name hd1*) 1.8 0 4.5
assign (segid b and resid 36 and name hg2*) (segid b and resid 40 and name hd1*) 1.8 0 4.5

assign (segid a and resid 37 and name ha) (segid a and resid 40 and name hn) 1.8 0 4.2
assign (segid b and resid 37 and name ha) (segid b and resid 40 and name hn) 1.8 0 4.2

assign (segid a and resid 43 and name he*) (segid a and resid 40 and name hd2*) 1.8 0 7.1
assign (segid b and resid 43 and name he*) (segid b and resid 40 and name hd2*) 1.8 0 7.1

!LONG
assign (segid a and resid 77 and name ha) (segid a and resid 40 and name hd1*) 1.8 0 3.0
assign (segid b and resid 77 and name ha) (segid b and resid 40 and name hd1*) 1.8 0 3.0

assign (segid a and resid 77 and name hb) (segid a and resid 40 and name hd1*) 1.8 0 4.7
assign (segid b and resid 77 and name hb) (segid b and resid 40 and name hd1*) 1.8 0 4.7

assign (segid a and resid 77 and name hg1*) (segid a and resid 40 and name hd1*) 1.8 0 4.5
assign (segid b and resid 77 and name hg1*) (segid b and resid 40 and name hd1*) 1.8 0 4.5

assign (segid a and resid 77 and name hg2*) (segid a and resid 40 and name hd1*) 1.8 0 6.2
assign (segid b and resid 77 and name hg2*) (segid b and resid 40 and name hd1*) 1.8 0 6.2

assign (segid a and resid 80 and name hg2*) (segid a and resid 40 and name hd1*) 1.8 0 6.2
assign (segid b and resid 80 and name hg2*) (segid b and resid 40 and name hd1*) 1.8 0 6.2

assign (segid a and resid 80 and name hg2*) (segid a and resid 40 and name hd2*) 1.8 0 6.2
assign (segid b and resid 80 and name hg2*) (segid b and resid 40 and name hd2*) 1.8 0 6.2

assign (segid a and resid 80 and name hb) (segid a and resid 40 and name hd1*) 1.8 0 4.7
assign (segid b and resid 80 and name hb) (segid b and resid 40 and name hd1*) 1.8 0 4.7

!INTER
assign (segid a and resid 8 and name hg1*) (segid b and resid 40 and name hd1*) 1.8 0 6.2
assign (segid b and resid 8 and name hg1*) (segid a and resid 40 and name hd1*) 1.8 0 6.2





!Ser 41

!INTRA
assign (segid a and resid 41 and name hb*) (segid a and resid 41 and name hn) 1.8 0 2.1
assign (segid b and resid 41 and name hb*) (segid b and resid 41 and name hn) 1.8 0 2.1

!SEQ
assign (segid a and resid 40 and name hn) (segid a and resid 41 and name hn) 1.8 0 1.7
assign (segid b and resid 40 and name hn) (segid b and resid 41 and name hn) 1.8 0 1.7

assign (segid a and resid 40 and name ha) (segid a and resid 41 and name hn) 1.8 0 3.2
assign (segid b and resid 40 and name ha) (segid b and resid 41 and name hn) 1.8 0 3.2

assign (segid a and resid 40 and name hg) (segid a and resid 41 and name hn) 1.8 0 4.2
assign (segid b and resid 40 and name hg) (segid b and resid 41 and name hn) 1.8 0 4.2

assign (segid a and resid 40 and name hd2*) (segid a and resid 41 and name hn) 1.8 0 5.7
assign (segid b and resid 40 and name hd2*) (segid b and resid 41 and name hn) 1.8 0 5.7

!MED
assign (segid a and resid 37 and name ha) (segid a and resid 41 and name hn) 1.8 0 4.2
assign (segid b and resid 37 and name ha) (segid b and resid 41 and name hn) 1.8 0 4.2

assign (segid a and resid 39 and name hn) (segid a and resid 41 and name hn) 1.8 0 4.2
assign (segid b and resid 39 and name hn) (segid b and resid 41 and name hn) 1.8 0 4.2

!LONG
assign (segid a and resid 80 and name hg2*) (segid a and resid 41 and name hn) 1.8 0 5.7
assign (segid b and resid 80 and name hg2*) (segid b and resid 41 and name hn) 1.8 0 5.7

!INTER
assign (segid a and resid 3 and name hd2*) (segid b and resid 41 and name hn) 1.8 0 4.7
assign (segid b and resid 3 and name hd2*) (segid a and resid 41 and name hn) 1.8 0 4.7





!His 42

!INTRA

!SEQ
assign (segid a and resid 41 and name ha) (segid a and resid 42 and name hn) 1.8 0 4.2
assign (segid b and resid 41 and name ha) (segid b and resid 42 and name hn) 1.8 0 4.2

assign (segid a and resid 41 and name hb*) (segid a and resid 42 and name hn) 1.8 0 4.2
assign (segid b and resid 41 and name hb*) (segid b and resid 42 and name hn) 1.8 0 4.2

assign (segid a and resid 43 and name hn) (segid a and resid 42 and name hn) 1.8 0 1.7
assign (segid b and resid 43 and name hn) (segid b and resid 42 and name hn) 1.8 0 1.7

!MED
assign (segid a and resid 40 and name ha) (segid a and resid 42 and name hn) 1.8 0 4.2
assign (segid b and resid 40 and name ha) (segid b and resid 42 and name hn) 1.8 0 4.2

!LONG

!INTER




!Phe 43

!INTRA
assign (segid a and resid 43 and name hb*) (segid a and resid 43 and name hn) 1.8 0 2.7
assign (segid b and resid 43 and name hb*) (segid b and resid 43 and name hn) 1.8 0 2.7

assign (segid a and resid 43 and name hd*) (segid a and resid 43 and name hn) 1.8 0 5.6
assign (segid b and resid 43 and name hd*) (segid b and resid 43 and name hn) 1.8 0 5.6

!SEQ

!MED
assign (segid a and resid 40 and name ha) (segid a and resid 43 and name hn) 1.8 0 4.2
assign (segid b and resid 40 and name ha) (segid b and resid 43 and name hn) 1.8 0 4.2

assign (segid a and resid 40 and name hd2*) (segid a and resid 43 and name hd*) 1.8 0 7.1
assign (segid b and resid 40 and name hd2*) (segid b and resid 43 and name hd*) 1.8 0 7.1

!LONG

!INTER
assign (segid a and resid 8 and name hg2*) (segid b and resid 43 and name hd*) 1.8 0 8.1
assign (segid b and resid 8 and name hg2*) (segid a and resid 43 and name hd*) 1.8 0 8.1





!Leu 44

!INTRA
assign (segid a and resid 44 and name hb2) (segid a and resid 44 and name hn) 1.8 0 1.7
assign (segid b and resid 44 and name hb2) (segid b and resid 44 and name hn) 1.8 0 1.7

!SEQ

!MED
assign (segid a and resid 47 and name hd*) (segid a and resid 44 and name hd*) 1.8 0 6.4
assign (segid b and resid 47 and name hd*) (segid b and resid 44 and name hd*) 1.8 0 6.4

assign (segid a and resid 47 and name hg12) (segid a and resid 44 and name hd*) 1.8 0 6.6
assign (segid b and resid 47 and name hg12) (segid b and resid 44 and name hd*) 1.8 0 6.6

assign (segid a and resid 47 and name hg11) (segid a and resid 44 and name hd*) 1.8 0 6.6
assign (segid b and resid 47 and name hg11) (segid b and resid 44 and name hd*) 1.8 0 6.6

!LONG
assign (segid a and resid 53 and name hg1*) (segid a and resid 44 and name hd*) 1.8 0 7.6
assign (segid b and resid 53 and name hg1*) (segid b and resid 44 and name hd*) 1.8 0 7.6

assign (segid a and resid 57 and name he*) (segid a and resid 44 and name hd*) 1.8 0 8.1
assign (segid b and resid 57 and name he*) (segid b and resid 44 and name hd*) 1.8 0 8.1

!INTER



	
!Glu 45

!INTRA
assign (segid a and resid 45 and name hb*) (segid a and resid 45 and name hn) 1.8 0 2.1
assign (segid b and resid 45 and name hb*) (segid b and resid 45 and name hn) 1.8 0 2.1

assign (segid a and resid 45 and name hg1) (segid a and resid 45 and name hn) 1.8 0 1.7
assign (segid b and resid 45 and name hg1) (segid b and resid 45 and name hn) 1.8 0 1.7

assign (segid a and resid 45 and name hg2) (segid a and resid 45 and name hn) 1.8 0 1.7
assign (segid b and resid 45 and name hg2) (segid b and resid 45 and name hn) 1.8 0 1.7

!SEQ
assign (segid a and resid 44 and name ha) (segid a and resid 45 and name hn) 1.8 0 3.2
assign (segid b and resid 44 and name ha) (segid b and resid 45 and name hn) 1.8 0 3.2

assign (segid a and resid 44 and name hb1) (segid a and resid 45 and name hn) 1.8 0 4.2
assign (segid b and resid 44 and name hb1) (segid b and resid 45 and name hn) 1.8 0 4.2

assign (segid a and resid 44 and name hb2) (segid a and resid 45 and name hn) 1.8 0 4.2
assign (segid b and resid 44 and name hb2) (segid b and resid 45 and name hn) 1.8 0 4.2

assign (segid a and resid 44 and name hd*) (segid a and resid 45 and name hn) 1.8 0 7.1
assign (segid b and resid 44 and name hd*) (segid b and resid 45 and name hn) 1.8 0 7.1

!MED
assign (segid a and resid 47 and name hb) (segid a and resid 45 and name hn) 1.8 0 4.2
assign (segid b and resid 47 and name hb) (segid b and resid 45 and name hn) 1.8 0 4.2

!LONG

!INTER




!Glu 46

!INTRA
assign (segid a and resid 46 and name hb*) (segid a and resid 46 and name hn) 1.8 0 2.7
assign (segid b and resid 46 and name hb*) (segid b and resid 46 and name hn) 1.8 0 2.7

assign (segid a and resid 46 and name hg*) (segid a and resid 46 and name hn) 1.8 0 2.1
assign (segid b and resid 46 and name hg*) (segid b and resid 46 and name hn) 1.8 0 2.1

!SEQ
assign (segid a and resid 45 and name hn) (segid a and resid 46 and name hn) 1.8 0 1.1
assign (segid b and resid 45 and name hn) (segid b and resid 46 and name hn) 1.8 0 1.1

assign (segid a and resid 45 and name ha) (segid a and resid 46 and name hn) 1.8 0 1.7
assign (segid b and resid 45 and name ha) (segid b and resid 46 and name hn) 1.8 0 1.7

assign (segid a and resid 45 and name hb*) (segid a and resid 46 and name hn) 1.8 0 4.2
assign (segid b and resid 45 and name hb*) (segid b and resid 46 and name hn) 1.8 0 4.2


assign (segid a and resid 47 and name hn) (segid a and resid 46 and name hn) 1.8 0 1.7
assign (segid b and resid 47 and name hn) (segid b and resid 46 and name hn) 1.8 0 1.7

!MED
assign (segid a and resid 44 and name ha) (segid a and resid 46 and name hn) 1.8 0 3.2
assign (segid b and resid 44 and name ha) (segid b and resid 46 and name hn) 1.8 0 3.2

assign (segid a and resid 44 and name hd*) (segid a and resid 46 and name hn) 1.8 0 6.6
assign (segid b and resid 44 and name hd*) (segid b and resid 46 and name hn) 1.8 0 6.6

!LONG

!INTER




!Ile 47

!INTRA
assign (segid a and resid 47 and name ha) (segid a and resid 47 and name hg2*) 1.8 0 3.0
assign (segid b and resid 47 and name ha) (segid b and resid 47 and name hg2*) 1.8 0 3.0

!SEQ

!MED
assign (segid a and resid 44 and name ha) (segid a and resid 47 and name hd*) 1.8 0 4.7
assign (segid b and resid 44 and name ha) (segid b and resid 47 and name hd*) 1.8 0 4.7

assign (segid a and resid 44 and name hd*) (segid a and resid 47 and name hg2*) 1.8 0 7.6
assign (segid b and resid 44 and name hd*) (segid b and resid 47 and name hg2*) 1.8 0 7.6

assign (segid a and resid 50 and name ha) (segid a and resid 47 and name hg2*) 1.8 0 3.0
assign (segid b and resid 50 and name ha) (segid b and resid 47 and name hg2*) 1.8 0 3.0

assign (segid a and resid 50 and name hb1) (segid a and resid 47 and name hg2*) 1.8 0 4.7
assign (segid b and resid 50 and name hb1) (segid b and resid 47 and name hg2*) 1.8 0 4.7

assign (segid a and resid 50 and name hb2) (segid a and resid 47 and name hg2*) 1.8 0 4.7
assign (segid b and resid 50 and name hb2) (segid b and resid 47 and name hg2*) 1.8 0 4.7

assign (segid a and resid 50 and name hg*) (segid a and resid 47 and name hg2*) 1.8 0 5.7
assign (segid b and resid 50 and name hg*) (segid b and resid 47 and name hg2*) 1.8 0 5.7

!LONG
assign (segid a and resid 53 and name hb) (segid a and resid 47 and name hg2*) 1.8 0 4.7
assign (segid b and resid 53 and name hb) (segid b and resid 47 and name hg2*) 1.8 0 4.7

assign (segid a and resid 53 and name hb) (segid a and resid 47 and name hd*) 1.8 0 4.7
assign (segid b and resid 53 and name hb) (segid b and resid 47 and name hd*) 1.8 0 4.7

assign (segid a and resid 53 and name hg1*) (segid a and resid 47 and name hg2*) 1.8 0 4.5
assign (segid b and resid 53 and name hg1*) (segid b and resid 47 and name hg2*) 1.8 0 4.5

assign (segid a and resid 53 and name hg2*) (segid a and resid 47 and name hg2*) 1.8 0 3.9
assign (segid b and resid 53 and name hg2*) (segid b and resid 47 and name hg2*) 1.8 0 3.9

assign (segid a and resid 53 and name hg1*) (segid a and resid 47 and name hd*) 1.8 0 4.5
assign (segid b and resid 53 and name hg1*) (segid b and resid 47 and name hd*) 1.8 0 4.5

assign (segid a and resid 53 and name hg2*) (segid a and resid 47 and name hd*) 1.8 0 4.5
assign (segid b and resid 53 and name hg2*) (segid b and resid 47 and name hd*) 1.8 0 4.5

assign (segid a and resid 83 and name hb*) (segid a and resid 47 and name hg2*) 1.8 0 4.5
assign (segid b and resid 83 and name hb*) (segid b and resid 47 and name hg2*) 1.8 0 4.5

!INTER




!Lys 48 

!INTRA

!SEQ

!MED

!LONG

!INTER




!Glu 49

!INTRA
assign (segid a and resid 49 and name hb1) (segid a and resid 49 and name hn) 1.8 0 1.7
assign (segid b and resid 49 and name hb1) (segid b and resid 49 and name hn) 1.8 0 1.7

assign (segid a and resid 49 and name hb2) (segid a and resid 49 and name hn) 1.8 0 1.7
assign (segid b and resid 49 and name hb2) (segid b and resid 49 and name hn) 1.8 0 1.7

!SEQ
assign (segid a and resid 48 and name hn) (segid a and resid 49 and name hn) 1.8 0 1.1
assign (segid b and resid 48 and name hn) (segid b and resid 49 and name hn) 1.8 0 1.1

assign (segid a and resid 48 and name ha) (segid a and resid 49 and name hn) 1.8 0 3.2
assign (segid b and resid 48 and name ha) (segid b and resid 49 and name hn) 1.8 0 3.2

assign (segid a and resid 48 and name hb*) (segid a and resid 49 and name hn) 1.8 0 2.7
assign (segid b and resid 48 and name hb*) (segid b and resid 49 and name hn) 1.8 0 2.7

assign (segid a and resid 48 and name hg*) (segid a and resid 49 and name hn) 1.8 0 4.2
assign (segid b and resid 48 and name hg*) (segid b and resid 49 and name hn) 1.8 0 4.2

!MED
assign (segid a and resid 47 and name ha) (segid a and resid 49 and name hn) 1.8 0 3.2
assign (segid b and resid 47 and name ha) (segid b and resid 49 and name hn) 1.8 0 3.2

assign (segid a and resid 47 and name hg2*) (segid a and resid 49 and name hn) 1.8 0 2.6
assign (segid b and resid 47 and name hg2*) (segid b and resid 49 and name hn) 1.8 0 2.6

assign (segid a and resid 52 and name hn) (segid a and resid 49 and name hn) 1.8 0 4.2
assign (segid b and resid 52 and name hn) (segid b and resid 49 and name hn) 1.8 0 4.2

assign (segid a and resid 53 and name hg2*) (segid a and resid 49 and name hn) 1.8 0 4.7
assign (segid b and resid 53 and name hg2*) (segid b and resid 49 and name hn) 1.8 0 4.7

!LONG
assign (segid a and resid 83 and name hb*) (segid a and resid 49 and name hn) 1.8 0 3.2
assign (segid b and resid 83 and name hb*) (segid b and resid 49 and name hn) 1.8 0 3.2

!INTER




!Gln 50

!INTRA
assign (segid a and resid 50 and name hb1) (segid a and resid 50 and name hn) 1.8 0 1.1
assign (segid b and resid 50 and name hb1) (segid b and resid 50 and name hn) 1.8 0 1.1

assign (segid a and resid 50 and name hb2) (segid a and resid 50 and name hn) 1.8 0 1.1
assign (segid b and resid 50 and name hb2) (segid b and resid 50 and name hn) 1.8 0 1.1

!SEQ
assign (segid a and resid 49 and name hn) (segid a and resid 50 and name hn) 1.8 0 4.2
assign (segid b and resid 49 and name hn) (segid b and resid 50 and name hn) 1.8 0 4.2

assign (segid a and resid 49 and name ha) (segid a and resid 50 and name hn) 1.8 0 4.2
assign (segid b and resid 49 and name ha) (segid b and resid 50 and name hn) 1.8 0 4.2

assign (segid a and resid 51 and name hn) (segid a and resid 50 and name hn) 1.8 0 1.1
assign (segid b and resid 51 and name hn) (segid b and resid 50 and name hn) 1.8 0 1.1

!MED
assign (segid a and resid 47 and name hg2*) (segid a and resid 50 and name hn) 1.8 0 5.7
assign (segid b and resid 47 and name hg2*) (segid b and resid 50 and name hn) 1.8 0 5.7

assign (segid a and resid 52 and name hn) (segid a and resid 50 and name hn) 1.8 0 4.2
assign (segid b and resid 52 and name hn) (segid b and resid 50 and name hn) 1.8 0 4.2

assign (segid a and resid 53 and name hb) (segid a and resid 50 and name ha) 1.8 0 1.5
assign (segid b and resid 53 and name hb) (segid b and resid 50 and name ha) 1.8 0 1.5

!LONG

!INTER



!Glu 51

!INTRA
assign (segid a and resid 51 and name hb*) (segid a and resid 51 and name hn) 1.8 0 2.1
assign (segid b and resid 51 and name hb*) (segid b and resid 51 and name hn) 1.8 0 2.1

assign (segid a and resid 51 and name hg*) (segid a and resid 51 and name hn) 1.8 0 2.7
assign (segid b and resid 51 and name hg*) (segid b and resid 51 and name hn) 1.8 0 2.7

!SEQ
assign (segid a and resid 50 and name ha) (segid a and resid 51 and name hn) 1.8 0 1.7
assign (segid b and resid 50 and name ha) (segid b and resid 51 and name hn) 1.8 0 1.7

assign (segid a and resid 52 and name hn) (segid a and resid 51 and name hn) 1.8 0 1.1
assign (segid b and resid 52 and name hn) (segid b and resid 51 and name hn) 1.8 0 1.1

assign (segid a and resid 52 and name hg1*) (segid a and resid 51 and name hn) 1.8 0 5.7
assign (segid b and resid 52 and name hg1*) (segid b and resid 51 and name hn) 1.8 0 5.7

!MED
assign (segid a and resid 47 and name hg2*) (segid a and resid 51 and name hn) 1.8 0 5.7
assign (segid b and resid 47 and name hg2*) (segid b and resid 51 and name hn) 1.8 0 5.7

assign (segid a and resid 53 and name hn) (segid a and resid 51 and name hn) 1.8 0 4.2
assign (segid b and resid 53 and name hn) (segid b and resid 51 and name hn) 1.8 0 4.2

assign (segid a and resid 54 and name hn) (segid a and resid 51 and name hn) 1.8 0 4.2
assign (segid b and resid 54 and name hn) (segid b and resid 51 and name hn) 1.8 0 4.2

assign (segid a and resid 54 and name hb*) (segid a and resid 51 and name ha) 1.8 0 1.9
assign (segid b and resid 54 and name hb*) (segid b and resid 51 and name ha) 1.8 0 1.9

!LONG

!INTER



!Val 52

!INTRA
assign (segid a and resid 52 and name hb) (segid a and resid 52 and name hn) 1.8 0 1.1
assign (segid b and resid 52 and name hb) (segid b and resid 52 and name hn) 1.8 0 1.1

assign (segid a and resid 52 and name hg1*) (segid a and resid 52 and name hn) 1.8 0 2.6
assign (segid b and resid 52 and name hg1*) (segid b and resid 52 and name hn) 1.8 0 2.6

assign (segid a and resid 52 and name hg2*) (segid a and resid 52 and name hn) 1.8 0 3.2
assign (segid b and resid 52 and name hg2*) (segid b and resid 52 and name hn) 1.8 0 3.2

!SEQ
assign (segid a and resid 51 and name ha) (segid a and resid 52 and name hn) 1.8 0 3.2
assign (segid b and resid 51 and name ha) (segid b and resid 52 and name hn) 1.8 0 3.2

assign (segid a and resid 51 and name hb*) (segid a and resid 52 and name hn) 1.8 0 2.7
assign (segid b and resid 51 and name hb*) (segid b and resid 52 and name hn) 1.8 0 2.7

assign (segid a and resid 51 and name hb*) (segid a and resid 52 and name hg1*) 1.8 0 5.7
assign (segid b and resid 51 and name hb*) (segid b and resid 52 and name hg1*) 1.8 0 5.7

assign (segid a and resid 51 and name hg*) (segid a and resid 52 and name hn) 1.8 0 4.2
assign (segid b and resid 51 and name hg*) (segid b and resid 52 and name hn) 1.8 0 4.2

assign (segid a and resid 53 and name hg2*) (segid a and resid 52 and name hn) 1.8 0 4.7
assign (segid b and resid 53 and name hg2*) (segid b and resid 52 and name hn) 1.8 0 4.7

!MED
assign (segid a and resid 49 and name hb1) (segid a and resid 52 and name hg1*) 1.8 0 3.0
assign (segid b and resid 49 and name hb1) (segid b and resid 52 and name hg1*) 1.8 0 3.0

assign (segid a and resid 49 and name hb2) (segid a and resid 52 and name hg1*) 1.8 0 3.0
assign (segid b and resid 49 and name hb2) (segid b and resid 52 and name hg1*) 1.8 0 3.0

assign (segid a and resid 49 and name hg*) (segid a and resid 52 and name hg1*) 1.8 0 4.0
assign (segid b and resid 49 and name hg*) (segid b and resid 52 and name hg1*) 1.8 0 4.0

assign (segid a and resid 50 and name hn) (segid a and resid 52 and name hn) 1.8 0 4.2
assign (segid b and resid 50 and name hn) (segid b and resid 52 and name hn) 1.8 0 4.2

assign (segid a and resid 50 and name hb1) (segid a and resid 52 and name hn) 1.8 0 4.2
assign (segid b and resid 50 and name hb1) (segid b and resid 52 and name hn) 1.8 0 4.2

assign (segid a and resid 54 and name hb*) (segid a and resid 52 and name hn) 1.8 0 5.2
assign (segid b and resid 54 and name hb*) (segid b and resid 52 and name hn) 1.8 0 5.2

assign (segid a and resid 55 and name hn) (segid a and resid 52 and name hn) 1.8 0 4.2
assign (segid b and resid 55 and name hn) (segid b and resid 52 and name hn) 1.8 0 4.2

assign (segid a and resid 55 and name hb*) (segid a and resid 52 and name ha) 1.8 0 2.5
assign (segid b and resid 55 and name hb*) (segid b and resid 52 and name ha) 1.8 0 2.5

!LONG
assign (segid a and resid 79 and name ha) (segid a and resid 52 and name hg1*) 1.8 0 4.7
assign (segid b and resid 79 and name ha) (segid b and resid 52 and name hg1*) 1.8 0 4.7

assign (segid a and resid 80 and name ha) (segid a and resid 52 and name hg1*) 1.8 0 4.7
assign (segid b and resid 80 and name ha) (segid b and resid 52 and name hg1*) 1.8 0 4.7

assign (segid a and resid 83 and name hb*) (segid a and resid 52 and name hn) 1.8 0 4.7
assign (segid b and resid 83 and name hb*) (segid b and resid 52 and name hn) 1.8 0 4.7

assign (segid a and resid 83 and name hb*) (segid a and resid 52 and name hg1*) 1.8 0 6.2
assign (segid b and resid 83 and name hb*) (segid b and resid 52 and name hg1*) 1.8 0 6.2

!INTER
assign (segid a and resid 75 and name hb*) (segid b and resid 52 and name hg1*) 1.8 0 7.2
assign (segid b and resid 75 and name hb*) (segid a and resid 52 and name hg1*) 1.8 0 7.2



!Val 53

!INTRA
assign (segid a and resid 53 and name hb) (segid a and resid 53 and name hn) 1.8 0 1.1
assign (segid b and resid 53 and name hb) (segid b and resid 53 and name hn) 1.8 0 1.1

assign (segid a and resid 53 and name hg2*) (segid a and resid 53 and name hn) 1.8 0 2.6
assign (segid b and resid 53 and name hg2*) (segid b and resid 53 and name hn) 1.8 0 2.6

!SEQ
assign (segid a and resid 52 and name hn) (segid a and resid 53 and name hn) 1.8 0 1.1
assign (segid b and resid 52 and name hn) (segid b and resid 53 and name hn) 1.8 0 1.1

assign (segid a and resid 52 and name ha) (segid a and resid 53 and name hn) 1.8 0 3.2
assign (segid b and resid 52 and name ha) (segid b and resid 53 and name hn) 1.8 0 3.2

assign (segid a and resid 52 and name hb) (segid a and resid 53 and name hn) 1.8 0 1.1
assign (segid b and resid 52 and name hb) (segid b and resid 53 and name hn) 1.8 0 1.1

assign (segid a and resid 52 and name hg2*) (segid a and resid 53 and name hn) 1.8 0 3.2
assign (segid b and resid 52 and name hg2*) (segid b and resid 53 and name hn) 1.8 0 3.2

assign (segid a and resid 54 and name ha) (segid a and resid 53 and name hg1*) 1.8 0 4.7
assign (segid b and resid 54 and name ha) (segid b and resid 53 and name hg1*) 1.8 0 4.7

!MED
assign (segid a and resid 50 and name ha) (segid a and resid 53 and name hn) 1.8 0 3.2
assign (segid b and resid 50 and name ha) (segid b and resid 53 and name hn) 1.8 0 3.2

assign (segid a and resid 50 and name ha) (segid a and resid 53 and name hg2*) 1.8 0 4.7
assign (segid b and resid 50 and name ha) (segid b and resid 53 and name hg2*) 1.8 0 4.7

assign (segid a and resid 51 and name hn) (segid a and resid 53 and name hn) 1.8 0 4.2
assign (segid b and resid 51 and name hn) (segid b and resid 53 and name hn) 1.8 0 4.2

assign (segid a and resid 51 and name ha) (segid a and resid 53 and name hn) 1.8 0 4.2
assign (segid b and resid 51 and name ha) (segid b and resid 53 and name hn) 1.8 0 4.2

assign (segid a and resid 56 and name hb) (segid a and resid 53 and name ha) 1.8 0 3.2
assign (segid b and resid 56 and name hb) (segid b and resid 53 and name ha) 1.8 0 3.2

assign (segid a and resid 56 and name hg1*) (segid a and resid 53 and name hn) 1.8 0 5.7
assign (segid b and resid 56 and name hg1*) (segid b and resid 53 and name hn) 1.8 0 5.7

assign (segid a and resid 57 and name hg*) (segid a and resid 53 and name hg1*) 1.8 0 4.0
assign (segid b and resid 57 and name hg*) (segid b and resid 53 and name hg1*) 1.8 0 4.0

!LONG
assign (segid a and resid 44 and name hg) (segid a and resid 53 and name hg2*) 1.8 0 4.7
assign (segid b and resid 44 and name hg) (segid b and resid 53 and name hg2*) 1.8 0 4.7

assign (segid a and resid 47 and name hg11) (segid a and resid 53 and name hg2*) 1.8 0 5.7
assign (segid b and resid 47 and name hg11) (segid b and resid 53 and name hg2*) 1.8 0 5.7

assign (segid a and resid 47 and name hd*) (segid a and resid 53 and name hg2*) 1.8 0 6.2
assign (segid b and resid 47 and name hd*) (segid b and resid 53 and name hg2*) 1.8 0 6.2

assign (segid a and resid 83 and name hb*) (segid a and resid 53 and name hn) 1.8 0 4.7
assign (segid b and resid 83 and name hb*) (segid b and resid 53 and name hn) 1.8 0 4.7

assign (segid a and resid 83 and name hb*) (segid a and resid 53 and name hg2*) 1.8 0 4.0
assign (segid b and resid 83 and name hb*) (segid b and resid 53 and name hg2*) 1.8 0 4.0



!Asp 54

!INTRA
assign (segid a and resid 54 and name hb*) (segid a and resid 54 and name hn) 1.8 0 2.1
assign (segid b and resid 54 and name hb*) (segid b and resid 54 and name hn) 1.8 0 2.1

!SEQ
assign (segid a and resid 53 and name hn) (segid a and resid 54 and name hn) 1.8 0 1.1
assign (segid b and resid 53 and name hn) (segid b and resid 54 and name hn) 1.8 0 1.1

assign (segid a and resid 53 and name ha) (segid a and resid 54 and name hn) 1.8 0 1.7
assign (segid b and resid 53 and name ha) (segid b and resid 54 and name hn) 1.8 0 1.7

assign (segid a and resid 53 and name hb) (segid a and resid 54 and name hn) 1.8 0 1.1
assign (segid b and resid 53 and name hb) (segid b and resid 54 and name hn) 1.8 0 1.1

!MED
assign (segid a and resid 50 and name ha) (segid a and resid 54 and name hn) 1.8 0 3.2
assign (segid b and resid 50 and name ha) (segid b and resid 54 and name hn) 1.8 0 3.2

assign (segid a and resid 51 and name hn) (segid a and resid 54 and name hn) 1.8 0 4.2
assign (segid b and resid 51 and name hn) (segid b and resid 54 and name hn) 1.8 0 4.2

assign (segid a and resid 51 and name ha) (segid a and resid 54 and name hn) 1.8 0 1.7
assign (segid b and resid 51 and name ha) (segid b and resid 54 and name hn) 1.8 0 1.7

assign (segid a and resid 52 and name hn) (segid a and resid 54 and name hn) 1.8 0 3.2
assign (segid b and resid 52 and name hn) (segid b and resid 54 and name hn) 1.8 0 3.2

assign (segid a and resid 52 and name ha) (segid a and resid 54 and name hn) 1.8 0 3.2
assign (segid b and resid 52 and name ha) (segid b and resid 54 and name hn) 1.8 0 3.2

assign (segid a and resid 57 and name hn) (segid a and resid 54 and name hn) 1.8 0 4.2
assign (segid b and resid 57 and name hn) (segid b and resid 54 and name hn) 1.8 0 4.2

assign (segid a and resid 57 and name hb1) (segid a and resid 54 and name hn) 1.8 0 3.2
assign (segid b and resid 57 and name hb1) (segid b and resid 54 and name hn) 1.8 0 3.2

assign (segid a and resid 57 and name hb1) (segid a and resid 54 and name ha) 1.8 0 1.5
assign (segid b and resid 57 and name hb1) (segid b and resid 54 and name ha) 1.8 0 1.5

assign (segid a and resid 57 and name hb2) (segid a and resid 54 and name ha) 1.8 0 3.2
assign (segid b and resid 57 and name hb2) (segid b and resid 54 and name ha) 1.8 0 3.2

assign (segid a and resid 57 and name hg*) (segid a and resid 54 and name hn) 1.8 0 5.2
assign (segid b and resid 57 and name hg*) (segid b and resid 54 and name hn) 1.8 0 5.2

!LONG

!INTER



!Lys 55

!INTRA
assign (segid a and resid 55 and name hb*) (segid a and resid 55 and name hn) 1.8 0 2.1
assign (segid b and resid 55 and name hb*) (segid b and resid 55 and name hn) 1.8 0 2.1

assign (segid a and resid 55 and name hg*) (segid a and resid 55 and name hn) 1.8 0 2.7
assign (segid b and resid 55 and name hg*) (segid b and resid 55 and name hn) 1.8 0 2.7

assign (segid a and resid 55 and name hd*) (segid a and resid 55 and name hn) 1.8 0 2.7
assign (segid b and resid 55 and name hd*) (segid b and resid 55 and name hn) 1.8 0 2.7

assign (segid a and resid 54 and name hn) (segid a and resid 55 and name hn) 1.8 0 1.1
assign (segid b and resid 54 and name hn) (segid b and resid 55 and name hn) 1.8 0 1.1

assign (segid a and resid 54 and name ha) (segid a and resid 55 and name hn) 1.8 0 3.2
assign (segid b and resid 54 and name ha) (segid b and resid 55 and name hn) 1.8 0 3.2

assign (segid a and resid 54 and name hb*) (segid a and resid 55 and name hn) 1.8 0 2.1
assign (segid b and resid 54 and name hb*) (segid b and resid 55 and name hn) 1.8 0 2.1

assign (segid a and resid 56 and name hg1*) (segid a and resid 55 and name hn) 1.8 0 4.7
assign (segid b and resid 56 and name hg1*) (segid b and resid 55 and name hn) 1.8 0 4.7

!MED
assign (segid a and resid 51 and name ha) (segid a and resid 55 and name hn) 1.8 0 3.2
assign (segid b and resid 51 and name ha) (segid b and resid 55 and name hn) 1.8 0 3.2

assign (segid a and resid 52 and name ha) (segid a and resid 55 and name hn) 1.8 0 1.7
assign (segid b and resid 52 and name ha) (segid b and resid 55 and name hn) 1.8 0 1.7

assign (segid a and resid 52 and name hn) (segid a and resid 55 and name hn) 1.8 0 4.2
assign (segid b and resid 52 and name hn) (segid b and resid 55 and name hn) 1.8 0 4.2

assign (segid a and resid 53 and name hn) (segid a and resid 55 and name hn) 1.8 0 4.2
assign (segid b and resid 53 and name hn) (segid b and resid 55 and name hn) 1.8 0 4.2

assign (segid a and resid 53 and name ha) (segid a and resid 55 and name hn) 1.8 0 4.2
assign (segid b and resid 53 and name ha) (segid b and resid 55 and name hn) 1.8 0 4.2

assign (segid a and resid 57 and name hn) (segid a and resid 55 and name hn) 1.8 0 4.2
assign (segid b and resid 57 and name hn) (segid b and resid 55 and name hn) 1.8 0 4.2

assign (segid a and resid 58 and name hb*) (segid a and resid 55 and name ha) 1.8 0 1.9
assign (segid b and resid 58 and name hb*) (segid b and resid 55 and name ha) 1.8 0 1.9

!LONG

!INTER




!Val 56

!INTRA
assign (segid a and resid 56 and name hb) (segid a and resid 56 and name hn) 1.8 0 1.7
assign (segid b and resid 56 and name hb) (segid b and resid 56 and name hn) 1.8 0 1.7

assign (segid a and resid 56 and name hg1*) (segid a and resid 56 and name hn) 1.8 0 2.6
assign (segid b and resid 56 and name hg1*) (segid b and resid 56 and name hn) 1.8 0 2.6

assign (segid a and resid 56 and name hg2*) (segid a and resid 56 and name hn) 1.8 0 3.2
assign (segid b and resid 56 and name hg2*) (segid b and resid 56 and name hn) 1.8 0 3.2

!SEQ
assign (segid a and resid 55 and name hn) (segid a and resid 56 and name hn) 1.8 0 1.1
assign (segid b and resid 55 and name hn) (segid b and resid 56 and name hn) 1.8 0 1.1

assign (segid a and resid 55 and name ha) (segid a and resid 56 and name hn) 1.8 0 3.2
assign (segid b and resid 55 and name ha) (segid b and resid 56 and name hn) 1.8 0 3.2

assign (segid a and resid 55 and name hb*) (segid a and resid 56 and name hn) 1.8 0 2.1
assign (segid b and resid 55 and name hb*) (segid b and resid 56 and name hn) 1.8 0 2.1

assign (segid a and resid 55 and name hb*) (segid a and resid 56 and name hg1*) 1.8 0 5.7
assign (segid b and resid 55 and name hb*) (segid b and resid 56 and name hg1*) 1.8 0 5.7

assign (segid a and resid 55 and name hg*) (segid a and resid 56 and name hn) 1.8 0 4.2
assign (segid b and resid 55 and name hg*) (segid b and resid 56 and name hn) 1.8 0 4.2

assign (segid a and resid 55 and name he*) (segid a and resid 56 and name hg1*) 1.8 0 5.7
assign (segid b and resid 55 and name he*) (segid b and resid 56 and name hg1*) 1.8 0 5.7

assign (segid a and resid 57 and name hg*) (segid a and resid 56 and name hn) 1.8 0 5.2
assign (segid b and resid 57 and name hg*) (segid b and resid 56 and name hn) 1.8 0 5.2

!MED
assign (segid a and resid 52 and name ha) (segid a and resid 56 and name hn) 1.8 0 3.2
assign (segid b and resid 52 and name ha) (segid b and resid 56 and name hn) 1.8 0 3.2

assign (segid a and resid 53 and name hn) (segid a and resid 56 and name hn) 1.8 0 4.2
assign (segid b and resid 53 and name hn) (segid b and resid 56 and name hn) 1.8 0 4.2

assign (segid a and resid 53 and name ha) (segid a and resid 56 and name hn) 1.8 0 1.7
assign (segid b and resid 53 and name ha) (segid b and resid 56 and name hn) 1.8 0 1.7

assign (segid a and resid 53 and name ha) (segid a and resid 56 and name hg1*) 1.8 0 4.7
assign (segid b and resid 53 and name ha) (segid b and resid 56 and name hg1*) 1.8 0 4.7

assign (segid a and resid 54 and name hn) (segid a and resid 56 and name hn) 1.8 0 4.2
assign (segid b and resid 54 and name hn) (segid b and resid 56 and name hn) 1.8 0 4.2

assign (segid a and resid 54 and name hb*) (segid a and resid 56 and name hn) 1.8 0 5.2
assign (segid b and resid 54 and name hb*) (segid b and resid 56 and name hn) 1.8 0 5.2

assign (segid a and resid 59 and name hb) (segid a and resid 56 and name ha) 1.8 0 3.2
assign (segid b and resid 59 and name hb) (segid b and resid 56 and name ha) 1.8 0 3.2

!LONG
assign (segid a and resid 36 and name hd*) (segid a and resid 56 and name hg1*) 1.8 0 6.2
assign (segid b and resid 36 and name hd*) (segid b and resid 56 and name hg1*) 1.8 0 6.2

assign (segid a and resid 76 and name ha) (segid a and resid 56 and name hg1*) 1.8 0 4.7
assign (segid b and resid 76 and name ha) (segid b and resid 56 and name hg1*) 1.8 0 4.7

assign (segid a and resid 76 and name he*) (segid a and resid 56 and name hg1*) 1.8 0 7.1
assign (segid b and resid 76 and name he*) (segid b and resid 56 and name hg1*) 1.8 0 7.1

assign (segid a and resid 79 and name ha) (segid a and resid 56 and name hg1*) 1.8 0 4.7
assign (segid b and resid 79 and name ha) (segid b and resid 56 and name hg1*) 1.8 0 4.7

assign (segid a and resid 79 and name hb1) (segid a and resid 56 and name hg1*) 1.8 0 4.7
assign (segid b and resid 79 and name hb1) (segid b and resid 56 and name hg1*) 1.8 0 4.7

assign (segid a and resid 79 and name hb2) (segid a and resid 56 and name hg1*) 1.8 0 4.7
assign (segid b and resid 79 and name hb2) (segid b and resid 56 and name hg1*) 1.8 0 4.7

assign (segid a and resid 79 and name hg1) (segid a and resid 56 and name hg1*) 1.8 0 4.7
assign (segid b and resid 79 and name hg1) (segid b and resid 56 and name hg1*) 1.8 0 4.7

assign (segid a and resid 80 and name ha) (segid a and resid 56 and name hg1*) 1.8 0 4.7
assign (segid b and resid 80 and name ha) (segid b and resid 56 and name hg1*) 1.8 0 4.7

assign (segid a and resid 80 and name hg1*) (segid a and resid 56 and name hn) 1.8 0 5.7
assign (segid b and resid 80 and name hg1*) (segid b and resid 56 and name hn) 1.8 0 5.7

!INTER



!Met 57

!INTRA
assign (segid a and resid 57 and name hb1) (segid a and resid 57 and name hn) 1.8 0 1.1
assign (segid b and resid 57 and name hb1) (segid b and resid 57 and name hn) 1.8 0 1.1

assign (segid a and resid 57 and name hb2) (segid a and resid 57 and name hn) 1.8 0 1.7
assign (segid b and resid 57 and name hb2) (segid b and resid 57 and name hn) 1.8 0 1.7

assign (segid a and resid 57 and name hg*) (segid a and resid 57 and name hn) 1.8 0 2.7
assign (segid b and resid 57 and name hg*) (segid b and resid 57 and name hn) 1.8 0 2.7

!SEQ
assign (segid a and resid 56 and name hn) (segid a and resid 57 and name hn) 1.8 0 1.1
assign (segid b and resid 56 and name hn) (segid b and resid 57 and name hn) 1.8 0 1.1

assign (segid a and resid 56 and name ha) (segid a and resid 57 and name hn) 1.8 0 3.2
assign (segid b and resid 56 and name ha) (segid b and resid 57 and name hn) 1.8 0 3.2

assign (segid a and resid 56 and name hb) (segid a and resid 57 and name hn) 1.8 0 1.7
assign (segid b and resid 56 and name hb) (segid b and resid 57 and name hn) 1.8 0 1.7

assign (segid a and resid 56 and name hg1*) (segid a and resid 57 and name hn) 1.8 0 3.2
assign (segid b and resid 56 and name hg1*) (segid b and resid 57 and name hn) 1.8 0 3.2

assign (segid a and resid 56 and name hg2*) (segid a and resid 57 and name hn) 1.8 0 3.2
assign (segid b and resid 56 and name hg2*) (segid b and resid 57 and name hn) 1.8 0 3.2

assign (segid a and resid 56 and name hg2*) (segid a and resid 57 and name he*) 1.8 0 4.5
assign (segid b and resid 56 and name hg2*) (segid b and resid 57 and name he*) 1.8 0 4.5

assign (segid a and resid 58 and name hb*) (segid a and resid 57 and name hn) 1.8 0 5.2
assign (segid b and resid 58 and name hb*) (segid b and resid 57 and name hn) 1.8 0 5.2

!MED
assign (segid a and resid 53 and name ha) (segid a and resid 57 and name hn) 1.8 0 3.2
assign (segid b and resid 53 and name ha) (segid b and resid 57 and name hn) 1.8 0 3.2

assign (segid a and resid 53 and name hg1*) (segid a and resid 57 and name hn) 1.8 0 4.7
assign (segid b and resid 53 and name hg1*) (segid b and resid 57 and name hn) 1.8 0 4.7

assign (segid a and resid 53 and name hg1*) (segid a and resid 57 and name he*) 1.8 0 4.5
assign (segid b and resid 53 and name hg1*) (segid b and resid 57 and name he*) 1.8 0 4.5

assign (segid a and resid 54 and name ha) (segid a and resid 57 and name hn) 1.8 0 3.2
assign (segid b and resid 54 and name ha) (segid b and resid 57 and name hn) 1.8 0 3.2

assign (segid a and resid 60 and name hb1) (segid a and resid 57 and name ha) 1.8 0 1.5
assign (segid b and resid 60 and name hb1) (segid b and resid 57 and name ha) 1.8 0 1.5

assign (segid a and resid 60 and name hb2) (segid a and resid 57 and name ha) 1.8 0 4.2
assign (segid b and resid 60 and name hb2) (segid b and resid 57 and name ha) 1.8 0 4.2

assign (segid a and resid 60 and name hd1*) (segid a and resid 57 and name hn) 1.8 0 5.7
assign (segid b and resid 60 and name hd1*) (segid b and resid 57 and name hn) 1.8 0 5.7

assign (segid a and resid 60 and name hd1*) (segid a and resid 57 and name he*) 1.8 0 7.2
assign (segid b and resid 60 and name hd1*) (segid b and resid 57 and name he*) 1.8 0 7.2

!LONG
assign (segid a and resid 33 and name ha) (segid a and resid 57 and name he*) 1.8 0 4.7
assign (segid b and resid 33 and name ha) (segid b and resid 57 and name he*) 1.8 0 4.7

assign (segid a and resid 33 and name hg1) (segid a and resid 57 and name he*) 1.8 0 4.7
assign (segid b and resid 33 and name hg1) (segid b and resid 57 and name he*) 1.8 0 4.7

assign (segid a and resid 33 and name hg2) (segid a and resid 57 and name he*) 1.8 0 4.7
assign (segid b and resid 33 and name hg2) (segid b and resid 57 and name he*) 1.8 0 4.7

assign (segid a and resid 36 and name hb) (segid a and resid 57 and name he*) 1.8 0 4.7
assign (segid b and resid 36 and name hb) (segid b and resid 57 and name he*) 1.8 0 4.7

assign (segid a and resid 36 and name hd*) (segid a and resid 57 and name he*) 1.8 0 4.5
assign (segid b and resid 36 and name hd*) (segid b and resid 57 and name he*) 1.8 0 4.5

assign (segid a and resid 36 and name hg2*) (segid a and resid 57 and name he*) 1.8 0 4.5
assign (segid b and resid 36 and name hg2*) (segid b and resid 57 and name he*) 1.8 0 4.5

assign (segid a and resid 37 and name ha) (segid a and resid 57 and name he*) 1.8 0 4.7
assign (segid b and resid 37 and name ha) (segid b and resid 57 and name he*) 1.8 0 4.7

assign (segid a and resid 80 and name hg1*) (segid a and resid 57 and name hn) 1.8 0 5.7
assign (segid b and resid 80 and name hg1*) (segid b and resid 57 and name hn) 1.8 0 5.7

assign (segid a and resid 80 and name hg1*) (segid a and resid 57 and name he*) 1.8 0 6.2
assign (segid b and resid 80 and name hg1*) (segid b and resid 57 and name he*) 1.8 0 6.2

!INTER



!Glu 58

!INTRA
assign (segid a and resid 58 and name hb*) (segid a and resid 58 and name hn) 1.8 0 2.1
assign (segid b and resid 58 and name hb*) (segid b and resid 58 and name hn) 1.8 0 2.1

assign (segid a and resid 58 and name hg1) (segid a and resid 58 and name hn) 1.8 0 1.7
assign (segid b and resid 58 and name hg1) (segid b and resid 58 and name hn) 1.8 0 1.7

!SEQ
assign (segid a and resid 57 and name hn) (segid a and resid 58 and name hn) 1.8 0 1.1
assign (segid b and resid 57 and name hn) (segid b and resid 58 and name hn) 1.8 0 1.1

assign (segid a and resid 57 and name hb1) (segid a and resid 58 and name hn) 1.8 0 1.1
assign (segid b and resid 57 and name hb1) (segid b and resid 58 and name hn) 1.8 0 1.1

assign (segid a and resid 57 and name hg*) (segid a and resid 58 and name hn) 1.8 0 4.2
assign (segid b and resid 57 and name hg*) (segid b and resid 58 and name hn) 1.8 0 4.2

!MED
assign (segid a and resid 54 and name ha) (segid a and resid 58 and name hn) 1.8 0 4.2
assign (segid b and resid 54 and name ha) (segid b and resid 58 and name hn) 1.8 0 4.2

assign (segid a and resid 54 and name hb*) (segid a and resid 58 and name hn) 1.8 0 4.2
assign (segid b and resid 54 and name hb*) (segid b and resid 58 and name hn) 1.8 0 4.2

assign (segid a and resid 55 and name ha) (segid a and resid 58 and name hn) 1.8 0 1.7
assign (segid b and resid 55 and name ha) (segid b and resid 58 and name hn) 1.8 0 1.7

assign (segid a and resid 56 and name ha) (segid a and resid 58 and name hn) 1.8 0 4.2
assign (segid b and resid 56 and name ha) (segid b and resid 58 and name hn) 1.8 0 4.2

assign (segid a and resid 61 and name hb*) (segid a and resid 58 and name ha) 1.8 0 1.9
assign (segid b and resid 61 and name hb*) (segid b and resid 58 and name ha) 1.8 0 1.9

!LONG
assign (segid a and resid 80 and name hg1*) (segid a and resid 58 and name hn) 1.8 0 5.7
assign (segid b and resid 80 and name hg1*) (segid b and resid 58 and name hn) 1.8 0 5.7

!INTER




!Thr 59

!INTRA
assign (segid a and resid 59 and name ha) (segid a and resid 59 and name hn) 1.8 0 1.1
assign (segid b and resid 59 and name ha) (segid b and resid 59 and name hn) 1.8 0 1.1

assign (segid a and resid 59 and name hg*) (segid a and resid 59 and name hn) 1.8 0 2.6
assign (segid b and resid 59 and name hg*) (segid b and resid 59 and name hn) 1.8 0 2.6

!SEQ
assign (segid a and resid 58 and name hn) (segid a and resid 59 and name hn) 1.8 0 1.1
assign (segid b and resid 58 and name hn) (segid b and resid 59 and name hn) 1.8 0 1.1

assign (segid a and resid 58 and name ha) (segid a and resid 59 and name hn) 1.8 0 3.2
assign (segid b and resid 58 and name ha) (segid b and resid 59 and name hn) 1.8 0 3.2

assign (segid a and resid 58 and name hb*) (segid a and resid 59 and name hn) 1.8 0 2.1
assign (segid b and resid 58 and name hb*) (segid b and resid 59 and name hn) 1.8 0 2.1

assign (segid a and resid 60 and name hn) (segid a and resid 59 and name hn) 1.8 0 1.1
assign (segid b and resid 60 and name hn) (segid b and resid 59 and name hn) 1.8 0 1.1

assign (segid a and resid 60 and name hb1) (segid a and resid 59 and name hn) 1.8 0 4.2
assign (segid b and resid 60 and name hb1) (segid b and resid 59 and name hn) 1.8 0 4.2

assign (segid a and resid 60 and name hg) (segid a and resid 59 and name hn) 1.8 0 3.2
assign (segid b and resid 60 and name hg) (segid b and resid 59 and name hn) 1.8 0 3.2

assign (segid a and resid 60 and name hd1*) (segid a and resid 59 and name hn) 1.8 0 5.7
assign (segid b and resid 60 and name hd1*) (segid b and resid 59 and name hn) 1.8 0 5.7

assign (segid a and resid 60 and name hd2*) (segid a and resid 59 and name hn) 1.8 0 5.7
assign (segid b and resid 60 and name hd2*) (segid b and resid 59 and name hn) 1.8 0 5.7

!MED
assign (segid a and resid 55 and name ha) (segid a and resid 59 and name hn) 1.8 0 3.2
assign (segid b and resid 55 and name ha) (segid b and resid 59 and name hn) 1.8 0 3.2

assign (segid a and resid 55 and name hg*) (segid a and resid 59 and name hn) 1.8 0 4.2
assign (segid b and resid 55 and name hg*) (segid b and resid 59 and name hn) 1.8 0 4.2

assign (segid a and resid 56 and name ha) (segid a and resid 59 and name hn) 1.8 0 1.7
assign (segid b and resid 56 and name ha) (segid b and resid 59 and name hn) 1.8 0 1.7

assign (segid a and resid 56 and name hg2*) (segid a and resid 59 and name hn) 1.8 0 5.7
assign (segid b and resid 56 and name hg2*) (segid b and resid 59 and name hn) 1.8 0 5.7

assign (segid a and resid 56 and name ha) (segid a and resid 59 and name hg2*) 1.8 0 4.7
assign (segid b and resid 56 and name ha) (segid b and resid 59 and name hg2*) 1.8 0 4.7

assign (segid a and resid 61 and name hb*) (segid a and resid 59 and name hn) 1.8 0 5.2
assign (segid b and resid 61 and name hb*) (segid b and resid 59 and name hn) 1.8 0 5.2

assign (segid a and resid 62 and name hb*) (segid a and resid 59 and name ha) 1.8 0 2.5
assign (segid b and resid 62 and name hb*) (segid b and resid 59 and name ha) 1.8 0 2.5

assign (segid a and resid 62 and name hb*) (segid a and resid 59 and name hg2*) 1.8 0 5.7
assign (segid b and resid 62 and name hb*) (segid b and resid 59 and name hg2*) 1.8 0 5.7

!LONG
assign (segid a and resid 29 and name hb*) (segid a and resid 59 and name hg2*) 1.8 0 5.7
assign (segid b and resid 29 and name hb*) (segid b and resid 59 and name hg2*) 1.8 0 5.7

assign (segid a and resid 76 and name hz) (segid a and resid 59 and name hn) 1.8 0 4.2
assign (segid b and resid 76 and name hz) (segid b and resid 59 and name hn) 1.8 0 4.2

assign (segid a and resid 76 and name hz) (segid a and resid 59 and name hg2*) 1.8 0 4.7
assign (segid b and resid 76 and name hz) (segid b and resid 59 and name hg2*) 1.8 0 4.7

!INTER




!Leu 60

!INTRA
assign (segid a and resid 60 and name ha) (segid a and resid 60 and name hd2*) 1.8 0 2.5
assign (segid b and resid 60 and name ha) (segid b and resid 60 and name hd2*) 1.8 0 2.5

assign (segid a and resid 60 and name hb2) (segid a and resid 60 and name hn) 1.8 0 1.7
assign (segid b and resid 60 and name hb2) (segid b and resid 60 and name hn) 1.8 0 1.7

assign (segid a and resid 60 and name hg) (segid a and resid 60 and name hn) 1.8 0 1.1
assign (segid b and resid 60 and name hg) (segid b and resid 60 and name hn) 1.8 0 1.1

assign (segid a and resid 60 and name hd1*) (segid a and resid 60 and name hn) 1.8 0 3.2
assign (segid b and resid 60 and name hd1*) (segid b and resid 60 and name hn) 1.8 0 3.2

assign (segid a and resid 60 and name hd2*) (segid a and resid 60 and name hn) 1.8 0 3.2
assign (segid b and resid 60 and name hd2*) (segid b and resid 60 and name hn) 1.8 0 3.2

assign (segid a and resid 59 and name ha) (segid a and resid 60 and name hn) 1.8 0 3.2
assign (segid b and resid 59 and name ha) (segid b and resid 60 and name hn) 1.8 0 3.2

assign (segid a and resid 59 and name hb) (segid a and resid 60 and name hn) 1.8 0 1.7
assign (segid b and resid 59 and name hb) (segid b and resid 60 and name hn) 1.8 0 1.7

assign (segid a and resid 59 and name hg2*) (segid a and resid 60 and name hn) 1.8 0 3.2
assign (segid b and resid 59 and name hg2*) (segid b and resid 60 and name hn) 1.8 0 3.2

assign (segid a and resid 61 and name hb*) (segid a and resid 60 and name hn) 1.8 0 5.2
assign (segid b and resid 61 and name hb*) (segid b and resid 60 and name hn) 1.8 0 5.2

!MED
assign (segid a and resid 56 and name ha) (segid a and resid 60 and name hn) 1.8 0 4.2
assign (segid b and resid 56 and name ha) (segid b and resid 60 and name hn) 1.8 0 4.2

assign (segid a and resid 56 and name hg2*) (segid a and resid 60 and name hn) 1.8 0 5.7
assign (segid b and resid 56 and name hg2*) (segid b and resid 60 and name hn) 1.8 0 5.7

assign (segid a and resid 56 and name hg2*) (segid a and resid 60 and name hd1*) 1.8 0 4.5
assign (segid b and resid 56 and name hg2*) (segid b and resid 60 and name hd1*) 1.8 0 4.5

assign (segid a and resid 56 and name hg2*) (segid a and resid 60 and name hd2*) 1.8 0 6.2
assign (segid b and resid 56 and name hg2*) (segid b and resid 60 and name hd2*) 1.8 0 6.2

assign (segid a and resid 57 and name ha) (segid a and resid 60 and name hn) 1.8 0 3.2
assign (segid b and resid 57 and name ha) (segid b and resid 60 and name hn) 1.8 0 3.2

assign (segid a and resid 57 and name ha) (segid a and resid 60 and name hd1*) 1.8 0 4.7
assign (segid b and resid 57 and name ha) (segid b and resid 60 and name hd1*) 1.8 0 4.7

assign (segid a and resid 58 and name ha) (segid a and resid 60 and name hn) 1.8 0 3.2
assign (segid b and resid 58 and name ha) (segid b and resid 60 and name hn) 1.8 0 3.2

!LONG
assign (segid a and resid 33 and name hb1) (segid a and resid 60 and name hd1*) 1.8 0 4.7
assign (segid b and resid 33 and name hb1) (segid b and resid 60 and name hd1*) 1.8 0 4.7

assign (segid a and resid 33 and name hb2) (segid a and resid 60 and name hd1*) 1.8 0 4.7
assign (segid b and resid 33 and name hb2) (segid b and resid 60 and name hd1*) 1.8 0 4.7

assign (segid a and resid 36 and name hd*) (segid a and resid 60 and name hd1*) 1.8 0 4.5
assign (segid b and resid 36 and name hd*) (segid b and resid 60 and name hd1*) 1.8 0 4.5

assign (segid a and resid 76 and name hz) (segid a and resid 60 and name hn) 1.8 0 4.2
assign (segid b and resid 76 and name hz) (segid b and resid 60 and name hn) 1.8 0 4.2

!INTER




!Asp 61

!INTRA
assign (segid a and resid 61 and name hb*) (segid a and resid 61 and name hn) 1.8 0 2.1
assign (segid b and resid 61 and name hb*) (segid b and resid 61 and name hn) 1.8 0 2.1

!SEQ
assign (segid a and resid 60 and name hn) (segid a and resid 61 and name hn) 1.8 0 1.1
assign (segid b and resid 60 and name hn) (segid b and resid 61 and name hn) 1.8 0 1.1

assign (segid a and resid 60 and name ha) (segid a and resid 61 and name hn) 1.8 0 3.2
assign (segid b and resid 60 and name ha) (segid b and resid 61 and name hn) 1.8 0 3.2

assign (segid a and resid 60 and name hb1) (segid a and resid 61 and name hn) 1.8 0 1.1
assign (segid b and resid 60 and name hb1) (segid b and resid 61 and name hn) 1.8 0 1.1

assign (segid a and resid 60 and name hb2) (segid a and resid 61 and name hn) 1.8 0 1.7
assign (segid b and resid 60 and name hb2) (segid b and resid 61 and name hn) 1.8 0 1.7

assign (segid a and resid 60 and name hg) (segid a and resid 61 and name hn) 1.8 0 3.2
assign (segid b and resid 60 and name hg) (segid b and resid 61 and name hn) 1.8 0 3.2

assign (segid a and resid 60 and name hd1*) (segid a and resid 61 and name hn) 1.8 0 4.7
assign (segid b and resid 60 and name hd1*) (segid b and resid 61 and name hn) 1.8 0 4.7

assign (segid a and resid 60 and name hd2*) (segid a and resid 61 and name hn) 1.8 0 5.7
assign (segid b and resid 60 and name hd2*) (segid b and resid 61 and name hn) 1.8 0 5.7

!MED
assign (segid a and resid 57 and name ha) (segid a and resid 61 and name hn) 1.8 0 3.2
assign (segid b and resid 57 and name ha) (segid b and resid 61 and name hn) 1.8 0 3.2

assign (segid a and resid 57 and name hg*) (segid a and resid 61 and name hn) 1.8 0 5.2
assign (segid b and resid 57 and name hg*) (segid b and resid 61 and name hn) 1.8 0 5.2

assign (segid a and resid 58 and name hn) (segid a and resid 61 and name hn) 1.8 0 4.2
assign (segid b and resid 58 and name hn) (segid b and resid 61 and name hn) 1.8 0 4.2

assign (segid a and resid 58 and name ha) (segid a and resid 61 and name hn) 1.8 0 1.7
assign (segid b and resid 58 and name ha) (segid b and resid 61 and name hn) 1.8 0 1.7

assign (segid a and resid 58 and name hg2) (segid a and resid 61 and name hn) 1.8 0 4.2
assign (segid b and resid 58 and name hg2) (segid b and resid 61 and name hn) 1.8 0 4.2

assign (segid a and resid 59 and name hn) (segid a and resid 61 and name hn) 1.8 0 4.2
assign (segid b and resid 59 and name hn) (segid b and resid 61 and name hn) 1.8 0 4.2

assign (segid a and resid 62 and name hb*) (segid a and resid 61 and name hn) 1.8 0 3.2
assign (segid b and resid 62 and name hb*) (segid b and resid 61 and name hn) 1.8 0 3.2

!LONG

!INTER




!Glu 62

!INTRA
assign (segid a and resid 62 and name hb*) (segid a and resid 62 and name hn) 1.8 0 2.1
assign (segid b and resid 62 and name hb*) (segid b and resid 62 and name hn) 1.8 0 2.1

assign (segid a and resid 62 and name hg*) (segid a and resid 62 and name hn) 1.8 0 2.7
assign (segid b and resid 62 and name hg*) (segid b and resid 62 and name hn) 1.8 0 2.7

!SEQ
assign (segid a and resid 61 and name hn) (segid a and resid 62 and name hn) 1.8 0 1.1
assign (segid b and resid 61 and name hn) (segid b and resid 62 and name hn) 1.8 0 1.1

assign (segid a and resid 61 and name ha) (segid a and resid 62 and name hn) 1.8 0 3.2
assign (segid b and resid 61 and name ha) (segid b and resid 62 and name hn) 1.8 0 3.2

assign (segid a and resid 61 and name hb*) (segid a and resid 62 and name hn) 1.8 0 2.7
assign (segid b and resid 61 and name hb*) (segid b and resid 62 and name hn) 1.8 0 2.7

assign (segid a and resid 63 and name hn) (segid a and resid 62 and name hn) 1.8 0 1.1
assign (segid b and resid 63 and name hn) (segid b and resid 62 and name hn) 1.8 0 1.1

!MED
assign (segid a and resid 58 and name ha) (segid a and resid 62 and name hn) 1.8 0 3.2
assign (segid b and resid 58 and name ha) (segid b and resid 62 and name hn) 1.8 0 3.2

assign (segid a and resid 59 and name ha) (segid a and resid 62 and name hn) 1.8 0 1.7
assign (segid b and resid 59 and name ha) (segid b and resid 62 and name hn) 1.8 0 1.7

assign (segid a and resid 59 and name hg2*) (segid a and resid 62 and name hn) 1.8 0 5.7
assign (segid b and resid 59 and name hg2*) (segid b and resid 62 and name hn) 1.8 0 5.7

assign (segid a and resid 60 and name hn) (segid a and resid 62 and name hn) 1.8 0 3.2
assign (segid b and resid 60 and name hn) (segid b and resid 62 and name hn) 1.8 0 3.2

assign (segid a and resid 60 and name ha) (segid a and resid 62 and name hn) 1.8 0 4.2
assign (segid b and resid 60 and name ha) (segid b and resid 62 and name hn) 1.8 0 4.2

!LONG

!INTER




!Asp 63

!INTRA
assign (segid a and resid 63 and name hb*) (segid a and resid 63 and name hn) 1.8 0 2.1
assign (segid b and resid 63 and name hb*) (segid b and resid 63 and name hn) 1.8 0 2.1

assign (segid a and resid 62 and name ha) (segid a and resid 63 and name hn) 1.8 0 1.7
assign (segid b and resid 62 and name ha) (segid b and resid 63 and name hn) 1.8 0 1.7

assign (segid a and resid 62 and name hb*) (segid a and resid 63 and name hn) 1.8 0 2.7
assign (segid b and resid 62 and name hb*) (segid b and resid 63 and name hn) 1.8 0 2.7

assign (segid a and resid 62 and name hg*) (segid a and resid 63 and name hn) 1.8 0 4.2
assign (segid b and resid 62 and name hg*) (segid b and resid 63 and name hn) 1.8 0 4.2

!MED
assign (segid a and resid 60 and name ha) (segid a and resid 63 and name hn) 1.8 0 3.2
assign (segid b and resid 60 and name ha) (segid b and resid 63 and name hn) 1.8 0 3.2

assign (segid a and resid 60 and name hd2*) (segid a and resid 63 and name hn) 1.8 0 5.7
assign (segid b and resid 60 and name hd2*) (segid b and resid 63 and name hn) 1.8 0 5.7

!LONG

!INTER



!Gly 64

!INTRA
assign (segid a and resid 63 and name hn) (segid a and resid 64 and name hn) 1.8 0 1.7
assign (segid b and resid 63 and name hn) (segid b and resid 64 and name hn) 1.8 0 1.7

assign (segid a and resid 63 and name ha) (segid a and resid 64 and name hn) 1.8 0 1.7
assign (segid b and resid 63 and name ha) (segid b and resid 64 and name hn) 1.8 0 1.7

assign (segid a and resid 63 and name hb*) (segid a and resid 64 and name hn) 1.8 0 4.2
assign (segid b and resid 63 and name hb*) (segid b and resid 64 and name hn) 1.8 0 4.2

!MED
assign (segid a and resid 61 and name ha) (segid a and resid 64 and name hn) 1.8 0 4.2
assign (segid b and resid 61 and name ha) (segid b and resid 64 and name hn) 1.8 0 4.2

assign (segid a and resid 62 and name hn) (segid a and resid 64 and name hn) 1.8 0 3.2
assign (segid b and resid 62 and name hn) (segid b and resid 64 and name hn) 1.8 0 3.2

assign (segid a and resid 62 and name ha) (segid a and resid 64 and name hn) 1.8 0 4.2
assign (segid b and resid 62 and name ha) (segid b and resid 64 and name hn) 1.8 0 4.2

assign (segid a and resid 62 and name hb*) (segid a and resid 64 and name hn) 1.8 0 5.2
assign (segid b and resid 62 and name hb*) (segid b and resid 64 and name hn) 1.8 0 5.2

!LONG
assign (segid a and resid 29 and name hb*) (segid a and resid 64 and name hn) 1.8 0 5.2
assign (segid b and resid 29 and name hb*) (segid b and resid 64 and name hn) 1.8 0 5.2

assign (segid a and resid 30 and name hn) (segid a and resid 64 and name hn) 1.8 0 4.2
assign (segid b and resid 30 and name hn) (segid b and resid 64 and name hn) 1.8 0 4.2

!INTER



!Asp 65

!INTRA
assign (segid a and resid 65 and name hb1) (segid a and resid 65 and name hn) 1.8 0 1.1
assign (segid b and resid 65 and name hb1) (segid b and resid 65 and name hn) 1.8 0 1.1

assign (segid a and resid 65 and name hb2) (segid a and resid 65 and name hn) 1.8 0 1.1
assign (segid b and resid 65 and name hb2) (segid b and resid 65 and name hn) 1.8 0 1.1

!SEQ
assign (segid a and resid 64 and name hn) (segid a and resid 65 and name hn) 1.8 0 1.7
assign (segid b and resid 64 and name hn) (segid b and resid 65 and name hn) 1.8 0 1.7

assign (segid a and resid 64 and name ha*) (segid a and resid 65 and name hn) 1.8 0 2.7
assign (segid b and resid 64 and name ha*) (segid b and resid 65 and name hn) 1.8 0 2.7

!MED
assign (segid a and resid 63 and name hn) (segid a and resid 65 and name hn) 1.8 0 4.2
assign (segid b and resid 63 and name hn) (segid b and resid 65 and name hn) 1.8 0 4.2

assign (segid a and resid 63 and name ha) (segid a and resid 65 and name hn) 1.8 0 3.2
assign (segid b and resid 63 and name ha) (segid b and resid 65 and name hn) 1.8 0 3.2

!LONG

!INTER



!Gly 66

!INTRA
assign (segid a and resid 66 and name ha1) (segid a and resid 66 and name hn) 1.8 0 1.1
assign (segid b and resid 66 and name ha1) (segid b and resid 66 and name hn) 1.8 0 1.1

assign (segid a and resid 66 and name ha2) (segid a and resid 66 and name hn) 1.8 0 1.1
assign (segid b and resid 66 and name ha2) (segid b and resid 66 and name hn) 1.8 0 1.1

!SEQ
assign (segid a and resid 65 and name ha) (segid a and resid 66 and name hn) 1.8 0 3.2
assign (segid b and resid 65 and name ha) (segid b and resid 66 and name hn) 1.8 0 3.2

assign (segid a and resid 65 and name hb1) (segid a and resid 66 and name hn) 1.8 0 3.2
assign (segid b and resid 65 and name hb1) (segid b and resid 66 and name hn) 1.8 0 3.2

assign (segid a and resid 65 and name hb2) (segid a and resid 66 and name hn) 1.8 0 3.2
assign (segid b and resid 65 and name hb2) (segid b and resid 66 and name hn) 1.8 0 3.2

!MED
assign (segid a and resid 64 and name hn) (segid a and resid 66 and name hn) 1.8 0 3.2
assign (segid b and resid 64 and name hn) (segid b and resid 66 and name hn) 1.8 0 3.2
 
!LONG
assign (segid a and resid 29 and name hb*) (segid a and resid 66 and name hn) 1.8 0 4.2
assign (segid b and resid 29 and name hb*) (segid b and resid 66 and name hn) 1.8 0 4.2

assign (segid a and resid 29 and name hg*) (segid a and resid 66 and name hn) 1.8 0 5.2
assign (segid b and resid 29 and name hg*) (segid b and resid 66 and name hn) 1.8 0 5.2

!INTER



!Glu 67

!INTRA
assign (segid a and resid 67 and name hb*) (segid a and resid 67 and name hn) 1.8 0 2.1
assign (segid b and resid 67 and name hb*) (segid b and resid 67 and name hn) 1.8 0 2.1

assign (segid a and resid 67 and name hg1) (segid a and resid 67 and name hn) 1.8 0 1.7
assign (segid b and resid 67 and name hg1) (segid b and resid 67 and name hn) 1.8 0 1.7

!SEQ
assign (segid a and resid 66 and name hn) (segid a and resid 67 and name hn) 1.8 0 3.2
assign (segid b and resid 66 and name hn) (segid b and resid 67 and name hn) 1.8 0 3.2

assign (segid a and resid 66 and name ha1) (segid a and resid 67 and name hn) 1.8 0 1.1
assign (segid b and resid 66 and name ha1) (segid b and resid 67 and name hn) 1.8 0 1.1

assign (segid a and resid 66 and name ha2) (segid a and resid 67 and name hn) 1.8 0 1.1
assign (segid b and resid 66 and name ha2) (segid b and resid 67 and name hn) 1.8 0 1.1

assign (segid a and resid 68 and name hn) (segid a and resid 67 and name hn) 1.8 0 4.2
assign (segid b and resid 68 and name hn) (segid b and resid 67 and name hn) 1.8 0 4.2

assign (segid a and resid 68 and name ha) (segid a and resid 67 and name hn) 1.8 0 4.2
assign (segid b and resid 68 and name ha) (segid b and resid 67 and name hn) 1.8 0 4.2

!MED

!LONG
assign (segid a and resid 28 and name ha) (segid a and resid 67 and name hn) 1.8 0 4.2
assign (segid b and resid 28 and name ha) (segid b and resid 67 and name hn) 1.8 0 4.2

assign (segid a and resid 29 and name hn) (segid a and resid 67 and name hn) 1.8 0 4.2
assign (segid b and resid 29 and name hn) (segid b and resid 67 and name hn) 1.8 0 4.2

assign (segid a and resid 29 and name he*) (segid a and resid 67 and name hn) 1.8 0 5.2 
assign (segid b and resid 29 and name he*) (segid b and resid 67 and name hn) 1.8 0 5.2 

!INTER

!AMB



!Cys 68

!INTRA
assign (segid a and resid 68 and name hb2) (segid a and resid 68 and name hn) 1.8 0 1.1
assign (segid b and resid 68 and name hb2) (segid b and resid 68 and name hn) 1.8 0 1.1

!SEQ
assign (segid a and resid 67 and name ha) (segid a and resid 68 and name hn) 1.8 0 1.1
assign (segid b and resid 67 and name ha) (segid b and resid 68 and name hn) 1.8 0 1.1

assign (segid a and resid 67 and name hb*) (segid a and resid 68 and name hn) 1.8 0 2.7
assign (segid b and resid 67 and name hb*) (segid b and resid 68 and name hn) 1.8 0 2.7

assign (segid a and resid 67 and name hg1) (segid a and resid 68 and name hn) 1.8 0 3.2
assign (segid b and resid 67 and name hg1) (segid b and resid 68 and name hn) 1.8 0 3.2

assign (segid a and resid 67 and name hg2) (segid a and resid 68 and name hn) 1.8 0 4.2
assign (segid b and resid 67 and name hg2) (segid b and resid 68 and name hn) 1.8 0 4.2

!MED

!LONG
assign (segid a and resid 26 and name ha) (segid a and resid 68 and name hn) 1.8 0 3.2
assign (segid b and resid 26 and name ha) (segid b and resid 68 and name hn) 1.8 0 3.2

assign (segid a and resid 26 and name hb*) (segid a and resid 68 and name hn) 1.8 0 5.2
assign (segid b and resid 26 and name hb*) (segid b and resid 68 and name hn) 1.8 0 5.2

assign (segid a and resid 27 and name hb1) (segid a and resid 68 and name hn) 1.8 0 3.2
assign (segid b and resid 27 and name hb1) (segid b and resid 68 and name hn) 1.8 0 3.2

assign (segid a and resid 27 and name hb2) (segid a and resid 68 and name hn) 1.8 0 4.2
assign (segid b and resid 27 and name hb2) (segid b and resid 68 and name hn) 1.8 0 4.2

assign (segid a and resid 27 and name hd*) (segid a and resid 68 and name hn) 1.8 0 7.6
assign (segid b and resid 27 and name hd*) (segid b and resid 68 and name hn) 1.8 0 7.6

assign (segid a and resid 28 and name hn) (segid a and resid 68 and name hn) 1.8 0 4.2
assign (segid b and resid 28 and name hn) (segid b and resid 68 and name hn) 1.8 0 4.2

assign (segid a and resid 28 and name ha) (segid a and resid 68 and name hn) 1.8 0 3.2
assign (segid b and resid 28 and name ha) (segid b and resid 68 and name hn) 1.8 0 3.2

assign (segid a and resid 28 and name hb1) (segid a and resid 68 and name hn) 1.8 0 4.2
assign (segid b and resid 28 and name hb1) (segid b and resid 68 and name hn) 1.8 0 4.2

assign (segid a and resid 28 and name hb2) (segid a and resid 68 and name hn) 1.8 0 3.2
assign (segid b and resid 28 and name hb2) (segid b and resid 68 and name hn) 1.8 0 3.2

assign (segid a and resid 29 and name hn) (segid a and resid 68 and name hn) 1.8 0 4.2
assign (segid b and resid 29 and name hn) (segid b and resid 68 and name hn) 1.8 0 4.2

!INTER




!Asp 69

!INTRA
assign (segid a and resid 69 and name hb2) (segid a and resid 69 and name hn) 1.8 0 1.7
assign (segid b and resid 69 and name hb2) (segid b and resid 69 and name hn) 1.8 0 1.7

!SEQ
assign (segid a and resid 68 and name hn) (segid a and resid 69 and name hn) 1.8 0 4.2
assign (segid b and resid 68 and name hn) (segid b and resid 69 and name hn) 1.8 0 4.2

assign (segid a and resid 68 and name ha) (segid a and resid 69 and name hn) 1.8 0 1.1
assign (segid b and resid 68 and name ha) (segid b and resid 69 and name hn) 1.8 0 1.1

assign (segid a and resid 68 and name hb1) (segid a and resid 69 and name hn) 1.8 0 1.7
assign (segid b and resid 68 and name hb1) (segid b and resid 69 and name hn) 1.8 0 1.7

!MED
assign (segid a and resid 71 and name hn) (segid a and resid 69 and name hn) 1.8 0 4.2
assign (segid b and resid 71 and name hn) (segid b and resid 69 and name hn) 1.8 0 4.2

assign (segid a and resid 72 and name hn) (segid a and resid 69 and name hn) 1.8 0 3.2
assign (segid b and resid 72 and name hn) (segid b and resid 69 and name hn) 1.8 0 3.2

assign (segid a and resid 72 and name ha) (segid a and resid 69 and name hn) 1.8 0 4.2
assign (segid b and resid 72 and name ha) (segid b and resid 69 and name hn) 1.8 0 4.2

assign (segid a and resid 72 and name hb1) (segid a and resid 69 and name hn) 1.8 0 1.1
assign (segid b and resid 72 and name hb1) (segid b and resid 69 and name hn) 1.8 0 1.1

assign (segid a and resid 72 and name hb2) (segid a and resid 69 and name hn) 1.8 0 3.2
assign (segid b and resid 72 and name hb2) (segid b and resid 69 and name hn) 1.8 0 3.2

assign (segid a and resid 72 and name hg1) (segid a and resid 69 and name hn) 1.8 0 3.2
assign (segid b and resid 72 and name hg1) (segid b and resid 69 and name hn) 1.8 0 3.2

assign (segid a and resid 72 and name hg2) (segid a and resid 69 and name hn) 1.8 0 3.2
assign (segid b and resid 72 and name hg2) (segid b and resid 69 and name hn) 1.8 0 3.2

assign (segid a and resid 26 and name hb*) (segid a and resid 69 and name hn) 1.8 0 5.2
assign (segid b and resid 26 and name hb*) (segid b and resid 69 and name hn) 1.8 0 5.2

!INTER



!Phe 70  

!INTRA
assign (segid a and resid 70 and name hb*) (segid a and resid 70 and name hn) 1.8 0 2.7
assign (segid b and resid 70 and name hb*) (segid b and resid 70 and name hn) 1.8 0 2.7

assign (segid a and resid 70 and name hd*) (segid a and resid 70 and name hn) 1.8 0 5.6
assign (segid b and resid 70 and name hd*) (segid b and resid 70 and name hn) 1.8 0 5.6

!SEQ
assign (segid a and resid 69 and name hn) (segid a and resid 70 and name hn) 1.8 0 4.2
assign (segid b and resid 69 and name hn) (segid b and resid 70 and name hn) 1.8 0 4.2

assign (segid a and resid 69 and name ha) (segid a and resid 70 and name hn) 1.8 0 1.7
assign (segid b and resid 69 and name ha) (segid b and resid 70 and name hn) 1.8 0 1.7

assign (segid a and resid 69 and name hb1) (segid a and resid 70 and name hn) 1.8 0 1.7
assign (segid b and resid 69 and name hb1) (segid b and resid 70 and name hn) 1.8 0 1.7

assign (segid a and resid 69 and name hb2) (segid a and resid 70 and name hn) 1.8 0 1.7
assign (segid b and resid 69 and name hb2) (segid b and resid 70 and name hn) 1.8 0 1.7

!MED
assign (segid a and resid 73 and name hb1) (segid a and resid 70 and name ha) 1.8 0 3.2
assign (segid b and resid 73 and name hb1) (segid b and resid 70 and name ha) 1.8 0 3.2

assign (segid a and resid 73 and name hb2) (segid a and resid 70 and name ha) 1.8 0 3.2
assign (segid b and resid 73 and name hb2) (segid b and resid 70 and name ha) 1.8 0 3.2

!LONG
assign (segid a and resid 14 and name hz) (segid a and resid 70 and name hn) 1.8 0 4.2
assign (segid b and resid 14 and name hz) (segid b and resid 70 and name hn) 1.8 0 4.2

!INTER



!Gln 71

!INTRA
assign (segid a and resid 71 and name hb*) (segid a and resid 71 and name hn) 1.8 0 2.1
assign (segid b and resid 71 and name hb*) (segid b and resid 71 and name hn) 1.8 0 2.1

assign (segid a and resid 71 and name hg1) (segid a and resid 71 and name hn) 1.8 0 1.7
assign (segid b and resid 71 and name hg1) (segid b and resid 71 and name hn) 1.8 0 1.7

assign (segid a and resid 71 and name hg2) (segid a and resid 71 and name hn) 1.8 0 1.7
assign (segid b and resid 71 and name hg2) (segid b and resid 71 and name hn) 1.8 0 1.7

!SEQ
assign (segid a and resid 70 and name hn) (segid a and resid 71 and name hn) 1.8 0 1.7
assign (segid b and resid 70 and name hn) (segid b and resid 71 and name hn) 1.8 0 1.7

assign (segid a and resid 70 and name ha) (segid a and resid 71 and name hn) 1.8 0 3.2
assign (segid b and resid 70 and name ha) (segid b and resid 71 and name hn) 1.8 0 3.2

assign (segid a and resid 70 and name hb*) (segid a and resid 71 and name hn) 1.8 0 2.1
assign (segid b and resid 70 and name hb*) (segid b and resid 71 and name hn) 1.8 0 2.1

assign (segid a and resid 70 and name hd*) (segid a and resid 71 and name hn) 1.8 0 5.6
assign (segid b and resid 70 and name hd*) (segid b and resid 71 and name hn) 1.8 0 5.6

!MED
assign (segid a and resid 69 and name ha) (segid a and resid 71 and name hn) 1.8 0 4.2
assign (segid b and resid 69 and name ha) (segid b and resid 71 and name hn) 1.8 0 4.2

assign (segid a and resid 74 and name hb1) (segid a and resid 71 and name ha) 1.8 0 1.5
assign (segid b and resid 74 and name hb1) (segid b and resid 71 and name ha) 1.8 0 1.5

assign (segid a and resid 74 and name hb2) (segid a and resid 71 and name ha) 1.8 0 3.2
assign (segid b and resid 74 and name hb2) (segid b and resid 71 and name ha) 1.8 0 3.2

!LONG

!INTER
assign (segid a and resid 82 and name hg2*) (segid b and resid 71 and name hn) 1.8 0 4.7
assign (segid b and resid 82 and name hg2*) (segid a and resid 71 and name hn) 1.8 0 4.7

assign (segid a and resid 88 and name he*) (segid b and resid 71 and name hn) 1.8 0 6.6
assign (segid b and resid 88 and name he*) (segid a and resid 71 and name hn) 1.8 0 6.6



!Glu 72

!INTRA
assign (segid a and resid 72 and name hb1) (segid a and resid 72 and name hn) 1.8 0 1.7
assign (segid b and resid 72 and name hb1) (segid b and resid 72 and name hn) 1.8 0 1.7

assign (segid a and resid 72 and name hb2) (segid a and resid 72 and name hn) 1.8 0 1.7
assign (segid b and resid 72 and name hb2) (segid b and resid 72 and name hn) 1.8 0 1.7

assign (segid a and resid 72 and name hg1) (segid a and resid 72 and name hn) 1.8 0 1.7
assign (segid b and resid 72 and name hg1) (segid b and resid 72 and name hn) 1.8 0 1.7

assign (segid a and resid 72 and name hg2) (segid a and resid 72 and name hn) 1.8 0 1.7
assign (segid b and resid 72 and name hg2) (segid b and resid 72 and name hn) 1.8 0 1.7

!SEQ
assign (segid a and resid 71 and name hn) (segid a and resid 72 and name hn) 1.8 0 1.1
assign (segid b and resid 71 and name hn) (segid b and resid 72 and name hn) 1.8 0 1.1

assign (segid a and resid 71 and name ha) (segid a and resid 72 and name hn) 1.8 0 3.2
assign (segid b and resid 71 and name ha) (segid b and resid 72 and name hn) 1.8 0 3.2

assign (segid a and resid 71 and name hb*) (segid a and resid 72 and name hn) 1.8 0 2.1
assign (segid b and resid 71 and name hb*) (segid b and resid 72 and name hn) 1.8 0 2.1

assign (segid a and resid 73 and name hb1) (segid a and resid 72 and name hn) 1.8 0 4.2
assign (segid b and resid 73 and name hb1) (segid b and resid 72 and name hn) 1.8 0 4.2

!MED
assign (segid a and resid 68 and name ha) (segid a and resid 72 and name hn) 1.8 0 4.2
assign (segid b and resid 68 and name ha) (segid b and resid 72 and name hn) 1.8 0 4.2

assign (segid a and resid 69 and name hb2) (segid a and resid 72 and name hn) 1.8 0 4.2
assign (segid b and resid 69 and name hb2) (segid b and resid 72 and name hn) 1.8 0 4.2

assign (segid a and resid 70 and name ha) (segid a and resid 72 and name hn) 1.8 0 4.2
assign (segid b and resid 70 and name ha) (segid b and resid 72 and name hn) 1.8 0 4.2

!LONG

!INTER



!Phe 73

!INTRA
assign (segid a and resid 73 and name hb1) (segid a and resid 73 and name hn) 1.8 0 1.1
assign (segid b and resid 73 and name hb1) (segid b and resid 73 and name hn) 1.8 0 1.1

assign (segid a and resid 73 and name hb2) (segid a and resid 73 and name hn) 1.8 0 1.7
assign (segid b and resid 73 and name hb2) (segid b and resid 73 and name hn) 1.8 0 1.7

assign (segid a and resid 73 and name hd*) (segid a and resid 73 and name hn) 1.8 0 4.1
assign (segid b and resid 73 and name hd*) (segid b and resid 73 and name hn) 1.8 0 4.1

!SEQ
assign (segid a and resid 72 and name hn) (segid a and resid 73 and name hn) 1.8 0 1.1
assign (segid b and resid 72 and name hn) (segid b and resid 73 and name hn) 1.8 0 1.1

assign (segid a and resid 72 and name ha) (segid a and resid 73 and name hn) 1.8 0 3.2
assign (segid b and resid 72 and name ha) (segid b and resid 73 and name hn) 1.8 0 3.2

assign (segid a and resid 72 and name hb1) (segid a and resid 73 and name hn) 1.8 0 1.7
assign (segid b and resid 72 and name hb1) (segid b and resid 73 and name hn) 1.8 0 1.7

assign (segid a and resid 72 and name hb2) (segid a and resid 73 and name hn) 1.8 0 3.2
assign (segid b and resid 72 and name hb2) (segid b and resid 73 and name hn) 1.8 0 3.2

assign (segid a and resid 72 and name hg1) (segid a and resid 73 and name hn) 1.8 0 4.2
assign (segid b and resid 72 and name hg1) (segid b and resid 73 and name hn) 1.8 0 4.2

!MED
assign (segid a and resid 68 and name hb2) (segid a and resid 73 and name hn) 1.8 0 3.2
assign (segid b and resid 68 and name hb2) (segid b and resid 73 and name hn) 1.8 0 3.2

assign (segid a and resid 70 and name ha) (segid a and resid 73 and name hn) 1.8 0 3.2
assign (segid b and resid 70 and name ha) (segid b and resid 73 and name hn) 1.8 0 3.2

assign (segid a and resid 71 and name hn) (segid a and resid 73 and name hn) 1.8 0 3.2
assign (segid b and resid 71 and name hn) (segid b and resid 73 and name hn) 1.8 0 3.2

assign (segid a and resid 71 and name ha) (segid a and resid 73 and name hn) 1.8 0 4.2
assign (segid b and resid 71 and name ha) (segid b and resid 73 and name hn) 1.8 0 4.2

assign (segid a and resid 71 and name hb*) (segid a and resid 73 and name hn) 1.8 0 5.2
assign (segid b and resid 71 and name hb*) (segid b and resid 73 and name hn) 1.8 0 5.2

assign (segid a and resid 76 and name hb1) (segid a and resid 73 and name ha) 1.8 0 1.5
assign (segid b and resid 76 and name hb1) (segid b and resid 73 and name ha) 1.8 0 1.5

assign (segid a and resid 76 and name hb2) (segid a and resid 73 and name ha) 1.8 0 3.2
assign (segid b and resid 76 and name hb2) (segid b and resid 73 and name ha) 1.8 0 3.2

!LONG
assign (segid a and resid 14 and name he*) (segid a and resid 73 and name hn) 1.8 0 5.6
assign (segid b and resid 14 and name he*) (segid b and resid 73 and name hn) 1.8 0 5.6

assign (segid a and resid 14 and name hz) (segid a and resid 73 and name hn) 1.8 0 4.2
assign (segid b and resid 14 and name hz) (segid b and resid 73 and name hn) 1.8 0 4.2

assign (segid a and resid 27 and name hd*) (segid a and resid 73 and name hn) 1.8 0 7.6
assign (segid b and resid 27 and name hd*) (segid b and resid 73 and name hn) 1.8 0 7.6

assign (segid a and resid 27 and name hb1) (segid a and resid 73 and name hn) 1.8 0 4.2
assign (segid b and resid 27 and name hb1) (segid b and resid 73 and name hn) 1.8 0 4.2

assign (segid a and resid 27 and name hb2) (segid a and resid 73 and name hn) 1.8 0 4.2
assign (segid b and resid 27 and name hb2) (segid b and resid 73 and name hn) 1.8 0 4.2

assign (segid a and resid 32 and name hd1*) (segid a and resid 73 and name hn) 1.8 0 5.7
assign (segid b and resid 32 and name hd1*) (segid b and resid 73 and name hn) 1.8 0 5.7

!INTER



!Met 74

!INTRA
assign (segid a and resid 74 and name ha) (segid a and resid 74 and name he*) 1.8 0 3.0
assign (segid b and resid 74 and name ha) (segid b and resid 74 and name he*) 1.8 0 3.0

assign (segid a and resid 74 and name hb1) (segid a and resid 74 and name hn) 1.8 0 1.7
assign (segid b and resid 74 and name hb1) (segid b and resid 74 and name hn) 1.8 0 1.7

assign (segid a and resid 74 and name hb2) (segid a and resid 74 and name hn) 1.8 0 1.1
assign (segid b and resid 74 and name hb2) (segid b and resid 74 and name hn) 1.8 0 1.1

assign (segid a and resid 74 and name hg*) (segid a and resid 74 and name hn) 1.8 0 2.7
assign (segid b and resid 74 and name hg*) (segid b and resid 74 and name hn) 1.8 0 2.7

assign (segid a and resid 74 and name he*) (segid a and resid 74 and name hn) 1.8 0 4.7
assign (segid b and resid 74 and name he*) (segid b and resid 74 and name hn) 1.8 0 4.7

!SEQ
assign (segid a and resid 73 and name hn) (segid a and resid 74 and name hn) 1.8 0 1.1
assign (segid b and resid 73 and name hn) (segid b and resid 74 and name hn) 1.8 0 1.1

assign (segid a and resid 73 and name ha) (segid a and resid 74 and name hn) 1.8 0 4.2
assign (segid b and resid 73 and name ha) (segid b and resid 74 and name hn) 1.8 0 4.2

assign (segid a and resid 73 and name hb1) (segid a and resid 74 and name hn) 1.8 0 1.7
assign (segid b and resid 73 and name hb1) (segid b and resid 74 and name hn) 1.8 0 1.7

assign (segid a and resid 73 and name hb2) (segid a and resid 74 and name hn) 1.8 0 3.2
assign (segid b and resid 73 and name hb2) (segid b and resid 74 and name hn) 1.8 0 3.2

assign (segid a and resid 73 and name hd*) (segid a and resid 74 and name hn) 1.8 0 4.1
assign (segid b and resid 73 and name hd*) (segid b and resid 74 and name hn) 1.8 0 4.1

assign (segid a and resid 75 and name hn) (segid a and resid 74 and name hn) 1.8 0 1.1
assign (segid b and resid 75 and name hn) (segid b and resid 74 and name hn) 1.8 0 1.1

assign (segid a and resid 75 and name ha) (segid a and resid 74 and name he*) 1.8 0 4.7
assign (segid b and resid 75 and name ha) (segid b and resid 74 and name he*) 1.8 0 4.7

!MED
assign (segid a and resid 70 and name ha) (segid a and resid 74 and name hn) 1.8 0 3.2
assign (segid b and resid 70 and name ha) (segid b and resid 74 and name hn) 1.8 0 3.2

assign (segid a and resid 70 and name hd*) (segid a and resid 74 and name hn) 1.8 0 6.6
assign (segid b and resid 70 and name hd*) (segid b and resid 74 and name hn) 1.8 0 6.6

assign (segid a and resid 71 and name ha) (segid a and resid 74 and name hn) 1.8 0 1.7
assign (segid b and resid 71 and name ha) (segid b and resid 74 and name hn) 1.8 0 1.7

assign (segid a and resid 72 and name hn) (segid a and resid 74 and name hn) 1.8 0 4.2
assign (segid b and resid 72 and name hn) (segid b and resid 74 and name hn) 1.8 0 4.2

assign (segid a and resid 72 and name ha) (segid a and resid 74 and name hn) 1.8 0 4.2
assign (segid b and resid 72 and name ha) (segid b and resid 74 and name hn) 1.8 0 4.2

assign (segid a and resid 72 and name hb1) (segid a and resid 74 and name hn) 1.8 0 4.2
assign (segid b and resid 72 and name hb1) (segid b and resid 74 and name hn) 1.8 0 4.2

assign (segid a and resid 76 and name hn) (segid a and resid 74 and name hn) 1.8 0 3.2
assign (segid b and resid 76 and name hn) (segid b and resid 74 and name hn) 1.8 0 3.2

assign (segid a and resid 77 and name hb) (segid a and resid 74 and name ha) 1.8 0 1.5
assign (segid b and resid 77 and name hb) (segid b and resid 74 and name ha) 1.8 0 1.5

assign (segid a and resid 77 and name hg1*) (segid a and resid 74 and name he*) 1.8 0 4.5
assign (segid b and resid 77 and name hg1*) (segid b and resid 74 and name he*) 1.8 0 4.5

assign (segid a and resid 77 and name hg2*) (segid a and resid 74 and name hn) 1.8 0 5.7
assign (segid b and resid 77 and name hg2*) (segid b and resid 74 and name hn) 1.8 0 5.7

assign (segid a and resid 77 and name hg2*) (segid a and resid 74 and name he*) 1.8 0 6.2
assign (segid b and resid 77 and name hg2*) (segid b and resid 74 and name he*) 1.8 0 6.2

!LONG
assign (segid a and resid 10 and name hd1*) (segid a and resid 74 and name he*) 1.8 0 4.5
assign (segid b and resid 10 and name hd1*) (segid b and resid 74 and name he*) 1.8 0 4.5

assign (segid a and resid 10 and name hd2*) (segid a and resid 74 and name hn) 1.8 0 5.7
assign (segid b and resid 10 and name hd2*) (segid b and resid 74 and name hn) 1.8 0 5.7

assign (segid a and resid 10 and name hd2*) (segid a and resid 74 and name he*) 1.8 0 4.5
assign (segid b and resid 10 and name hd2*) (segid b and resid 74 and name he*) 1.8 0 4.5

assign (segid a and resid 10 and name ha) (segid a and resid 74 and name he*) 1.8 0 5.7
assign (segid b and resid 10 and name ha) (segid b and resid 74 and name he*) 1.8 0 5.7

assign (segid a and resid 27 and name hd*) (segid a and resid 74 and name hn) 1.8 0 7.6
assign (segid b and resid 27 and name hd*) (segid b and resid 74 and name hn) 1.8 0 7.6

!INTER
assign (segid a and resid 7 and name he*) (segid b and resid 74 and name he*) 1.8 0 4.5
assign (segid b and resid 7 and name he*) (segid a and resid 74 and name he*) 1.8 0 4.5

assign (segid a and resid 10 and name hd1*) (segid b and resid 74 and name he*) 1.8 0 6.2
assign (segid b and resid 10 and name hd1*) (segid a and resid 74 and name he*) 1.8 0 6.2

assign (segid a and resid 78 and name hb*) (segid b and resid 74 and name he*) 1.8 0 4.7
assign (segid b and resid 78 and name hb*) (segid a and resid 74 and name he*) 1.8 0 4.7




!Ala 75

!INTRA
assign (segid a and resid 75 and name hb*) (segid a and resid 75 and name hn) 1.8 0 2.2
assign (segid b and resid 75 and name hb*) (segid b and resid 75 and name hn) 1.8 0 2.2

!SEQ
assign (segid a and resid 74 and name ha) (segid a and resid 75 and name hn) 1.8 0 3.2
assign (segid b and resid 74 and name ha) (segid b and resid 75 and name hn) 1.8 0 3.2

assign (segid a and resid 74 and name hb1) (segid a and resid 75 and name hn) 1.8 0 1.1
assign (segid b and resid 74 and name hb1) (segid b and resid 75 and name hn) 1.8 0 1.1

assign (segid a and resid 74 and name hb2) (segid a and resid 75 and name hn) 1.8 0 1.1
assign (segid b and resid 74 and name hb2) (segid b and resid 75 and name hn) 1.8 0 1.1

assign (segid a and resid 74 and name hg*) (segid a and resid 75 and name hn) 1.8 0 4.2
assign (segid b and resid 74 and name hg*) (segid b and resid 75 and name hn) 1.8 0 4.2

assign (segid a and resid 76 and name hb1) (segid a and resid 75 and name hn) 1.8 0 4.2
assign (segid b and resid 76 and name hb1) (segid b and resid 75 and name hn) 1.8 0 4.2

!MED
assign (segid a and resid 71 and name ha) (segid a and resid 75 and name hn) 1.8 0 4.2
assign (segid b and resid 71 and name ha) (segid b and resid 75 and name hn) 1.8 0 4.2

assign (segid a and resid 71 and name hb*) (segid a and resid 75 and name hn) 1.8 0 5.2
assign (segid b and resid 71 and name hb*) (segid b and resid 75 and name hn) 1.8 0 5.2

assign (segid a and resid 71 and name hg*) (segid a and resid 75 and name hn) 1.8 0 5.2
assign (segid b and resid 71 and name hg*) (segid b and resid 75 and name hn) 1.8 0 5.2

assign (segid a and resid 72 and name ha) (segid a and resid 75 and name hn) 1.8 0 1.7
assign (segid b and resid 72 and name ha) (segid b and resid 75 and name hn) 1.8 0 1.7

assign (segid a and resid 72 and name ha) (segid a and resid 75 and name hb*) 1.8 0 2.4
assign (segid b and resid 72 and name ha) (segid b and resid 75 and name hb*) 1.8 0 2.4

assign (segid a and resid 73 and name hn) (segid a and resid 75 and name hn) 1.8 0 4.2
assign (segid b and resid 73 and name hn) (segid b and resid 75 and name hn) 1.8 0 4.2

assign (segid a and resid 73 and name hd*) (segid a and resid 75 and name hn) 1.8 0 6.6
assign (segid b and resid 73 and name hd*) (segid b and resid 75 and name hn) 1.8 0 6.6

assign (segid a and resid 77 and name hn) (segid a and resid 75 and name hn) 1.8 0 4.2
assign (segid b and resid 77 and name hn) (segid b and resid 75 and name hn) 1.8 0 4.2

assign (segid a and resid 77 and name hg2*) (segid a and resid 75 and name hn) 1.8 0 5.7
assign (segid b and resid 77 and name hg2*) (segid b and resid 75 and name hn) 1.8 0 5.7

assign (segid a and resid 78 and name hb*) (segid a and resid 75 and name ha) 1.8 0 2.5
assign (segid b and resid 78 and name hb*) (segid b and resid 75 and name ha) 1.8 0 2.5

!LONG

!INTER




!Phe 76

!INTRA
assign (segid a and resid 76 and name hb1) (segid a and resid 76 and name hn) 1.8 0 1.7
assign (segid b and resid 76 and name hb1) (segid b and resid 76 and name hn) 1.8 0 1.7

assign (segid a and resid 76 and name hb2) (segid a and resid 76 and name hn) 1.8 0 1.7
assign (segid b and resid 76 and name hb2) (segid b and resid 76 and name hn) 1.8 0 1.7

assign (segid a and resid 76 and name hd*) (segid a and resid 76 and name hn) 1.8 0 4.1
assign (segid b and resid 76 and name hd*) (segid b and resid 76 and name hn) 1.8 0 4.1

assign (segid a and resid 75 and name hn) (segid a and resid 76 and name hn) 1.8 0 1.1
assign (segid b and resid 75 and name hn) (segid b and resid 76 and name hn) 1.8 0 1.1

assign (segid a and resid 75 and name ha) (segid a and resid 76 and name hn) 1.8 0 3.2
assign (segid b and resid 75 and name ha) (segid b and resid 76 and name hn) 1.8 0 3.2

assign (segid a and resid 75 and name hb*) (segid a and resid 76 and name hn) 1.8 0 2.1
assign (segid b and resid 75 and name hb*) (segid b and resid 76 and name hn) 1.8 0 2.1

assign (segid a and resid 77 and name hg2*) (segid a and resid 76 and name hn) 1.8 0 4.7
assign (segid b and resid 77 and name hg2*) (segid b and resid 76 and name hn) 1.8 0 4.7

!MED
assign (segid a and resid 72 and name ha) (segid a and resid 76 and name hn) 1.8 0 3.2
assign (segid b and resid 72 and name ha) (segid b and resid 76 and name hn) 1.8 0 3.2

assign (segid a and resid 73 and name ha) (segid a and resid 76 and name hn) 1.8 0 3.2
assign (segid b and resid 73 and name ha) (segid b and resid 76 and name hn) 1.8 0 3.2


assign (segid a and resid 74 and name ha) (segid a and resid 76 and name hn) 1.8 0 3.2
assign (segid b and resid 74 and name ha) (segid b and resid 76 and name hn) 1.8 0 3.2

assign (segid a and resid 79 and name hb1) (segid a and resid 76 and name ha) 1.8 0 3.2
assign (segid b and resid 79 and name hb1) (segid b and resid 76 and name ha) 1.8 0 3.2

!LONG
assign (segid a and resid 32 and name hd2*) (segid a and resid 76 and name hn) 1.8 0 5.7
assign (segid b and resid 32 and name hd2*) (segid b and resid 76 and name hn) 1.8 0 5.7

!INTER



!Val 77

!INTRA
assign (segid a and resid 77 and name hb) (segid a and resid 77 and name hn) 1.8 0 1.1
assign (segid b and resid 77 and name hb) (segid b and resid 77 and name hn) 1.8 0 1.1

assign (segid a and resid 77 and name hg1*) (segid a and resid 77 and name hn) 1.8 0 3.2
assign (segid b and resid 77 and name hg1*) (segid b and resid 77 and name hn) 1.8 0 3.2

assign (segid a and resid 77 and name hg2*) (segid a and resid 77 and name hn) 1.8 0 2.6
assign (segid b and resid 77 and name hg2*) (segid b and resid 77 and name hn) 1.8 0 2.6

!SEQ
assign (segid a and resid 76 and name hn) (segid a and resid 77 and name hn) 1.8 0 1.1
assign (segid b and resid 76 and name hn) (segid b and resid 77 and name hn) 1.8 0 1.1

assign (segid a and resid 76 and name ha) (segid a and resid 77 and name hn) 1.8 0 4.2
assign (segid b and resid 76 and name ha) (segid b and resid 77 and name hn) 1.8 0 4.2

assign (segid a and resid 76 and name hb1) (segid a and resid 77 and name hn) 1.8 0 1.7
assign (segid b and resid 76 and name hb1) (segid b and resid 77 and name hn) 1.8 0 1.7

assign (segid a and resid 76 and name hb2) (segid a and resid 77 and name hn) 1.8 0 1.7
assign (segid b and resid 76 and name hb2) (segid b and resid 77 and name hn) 1.8 0 1.7

assign (segid a and resid 76 and name hd*) (segid a and resid 77 and name hn) 1.8 0 5.6
assign (segid b and resid 76 and name hd*) (segid b and resid 77 and name hn) 1.8 0 5.6

!MED
assign (segid a and resid 73 and name ha) (segid a and resid 77 and name hn) 1.8 0 4.2
assign (segid b and resid 73 and name ha) (segid b and resid 77 and name hn) 1.8 0 4.2

assign (segid a and resid 73 and name hd*) (segid a and resid 77 and name hn) 1.8 0 6.6
assign (segid b and resid 73 and name hd*) (segid b and resid 77 and name hn) 1.8 0 6.6

assign (segid a and resid 73 and name hd*) (segid a and resid 77 and name hg2*) 1.8 0 7.1
assign (segid b and resid 73 and name hd*) (segid b and resid 77 and name hg2*) 1.8 0 7.1

assign (segid a and resid 73 and name he*) (segid a and resid 77 and name hn) 1.8 0 6.6
assign (segid b and resid 73 and name he*) (segid b and resid 77 and name hn) 1.8 0 6.6

assign (segid a and resid 73 and name he*) (segid a and resid 77 and name hg2*) 1.8 0 7.1
assign (segid b and resid 73 and name he*) (segid b and resid 77 and name hg2*) 1.8 0 7.1

assign (segid a and resid 73 and name hz) (segid a and resid 77 and name hg2*) 1.8 0 4.7
assign (segid b and resid 73 and name hz) (segid b and resid 77 and name hg2*) 1.8 0 4.7

assign (segid a and resid 74 and name ha) (segid a and resid 77 and name hn) 1.8 0 1.7
assign (segid b and resid 74 and name ha) (segid b and resid 77 and name hn) 1.8 0 1.7

assign (segid a and resid 74 and name ha) (segid a and resid 77 and name hg1*) 1.8 0 4.7
assign (segid b and resid 74 and name ha) (segid b and resid 77 and name hg1*) 1.8 0 4.7

assign (segid a and resid 74 and name ha) (segid a and resid 77 and name hg2*) 1.8 0 3.0
assign (segid b and resid 74 and name ha) (segid b and resid 77 and name hg2*) 1.8 0 3.0

assign (segid a and resid 74 and name hb2) (segid a and resid 77 and name hn) 1.8 0 4.2
assign (segid b and resid 74 and name hb2) (segid b and resid 77 and name hn) 1.8 0 4.2

assign (segid a and resid 75 and name ha) (segid a and resid 77 and name hn) 1.8 0 3.2
assign (segid b and resid 75 and name ha) (segid b and resid 77 and name hn) 1.8 0 3.2

assign (segid a and resid 78 and name hb*) (segid a and resid 77 and name hn) 1.8 0 5.2
assign (segid b and resid 78 and name hb*) (segid b and resid 77 and name hn) 1.8 0 5.2

assign (segid a and resid 80 and name hb) (segid a and resid 77 and name ha) 1.8 0 3.2
assign (segid b and resid 80 and name hb) (segid b and resid 77 and name ha) 1.8 0 3.2

!LONG
assign (segid a and resid 10 and name hd1*) (segid a and resid 77 and name hn) 1.8 0 5.7
assign (segid b and resid 10 and name hd1*) (segid b and resid 77 and name hn) 1.8 0 5.7

assign (segid a and resid 32 and name hd1*) (segid a and resid 77 and name hn) 1.8 0 4.7
assign (segid b and resid 32 and name hd1*) (segid b and resid 77 and name hn) 1.8 0 4.7

assign (segid a and resid 32 and name hd1*) (segid a and resid 77 and name hg2*) 1.8 0 6.2
assign (segid b and resid 32 and name hd1*) (segid b and resid 77 and name hg2*) 1.8 0 6.2

assign (segid a and resid 36 and name hd*) (segid a and resid 77 and name hn) 1.8 0 4.7
assign (segid b and resid 36 and name hd*) (segid b and resid 77 and name hn) 1.8 0 4.7

assign (segid a and resid 36 and name hd*) (segid a and resid 77 and name hg2*) 1.8 0 6.2
assign (segid b and resid 36 and name hd*) (segid b and resid 77 and name hg2*) 1.8 0 6.2

!INTER
assign (segid a and resid 3 and name hg) (segid b and resid 77 and name hg1*) 1.8 0 4.7
assign (segid b and resid 3 and name hg) (segid a and resid 77 and name hg1*) 1.8 0 4.7

assign (segid a and resid 3 and name hd1*) (segid b and resid 77 and name hg1*) 1.8 0 4.5
assign (segid b and resid 3 and name hd1*) (segid a and resid 77 and name hg1*) 1.8 0 4.5

assign (segid a and resid 3 and name hd1*) (segid b and resid 77 and name hg2*) 1.8 0 6.2
assign (segid b and resid 3 and name hd1*) (segid a and resid 77 and name hg2*) 1.8 0 6.2


assign (segid a and resid 3 and name hd2*) (segid b and resid 77 and name hg2*) 1.8 0 4.5
assign (segid b and resid 3 and name hd2*) (segid a and resid 77 and name hg2*) 1.8 0 4.5

assign (segid a and resid 7 and name he*) (segid b and resid 77 and name hg1*) 1.8 0 4.5
assign (segid b and resid 7 and name he*) (segid a and resid 77 and name hg1*) 1.8 0 4.5



!Ser 78

!INTRA 
assign (segid a and resid 78 and name hb*) (segid a and resid 78 and name hn) 1.8 0 2.1
assign (segid b and resid 78 and name hb*) (segid b and resid 78 and name hn) 1.8 0 2.1

!SEQ
assign (segid a and resid 77 and name hn) (segid a and resid 78 and name hn) 1.8 0 1.1
assign (segid b and resid 77 and name hn) (segid b and resid 78 and name hn) 1.8 0 1.1

assign (segid a and resid 77 and name ha) (segid a and resid 78 and name hn) 1.8 0 3.2
assign (segid b and resid 77 and name ha) (segid b and resid 78 and name hn) 1.8 0 3.2

assign (segid a and resid 77 and name hb) (segid a and resid 78 and name hn) 1.8 0 1.1
assign (segid b and resid 77 and name hb) (segid b and resid 78 and name hn) 1.8 0 1.1

assign (segid a and resid 77 and name hg1*) (segid a and resid 78 and name hn) 1.8 0 3.2
assign (segid b and resid 77 and name hg1*) (segid b and resid 78 and name hn) 1.8 0 3.2

assign (segid a and resid 77 and name hg2*) (segid a and resid 78 and name hn) 1.8 0 3.2
assign (segid b and resid 77 and name hg2*) (segid b and resid 78 and name hn) 1.8 0 3.2

assign (segid a and resid 79 and name hn) (segid a and resid 78 and name hn) 1.8 0 1.1
assign (segid b and resid 79 and name hn) (segid b and resid 78 and name hn) 1.8 0 1.1

assign (segid a and resid 79 and name hg2) (segid a and resid 78 and name hn) 1.8 0 3.2
assign (segid b and resid 79 and name hg2) (segid b and resid 78 and name hn) 1.8 0 3.2

!MED
assign (segid a and resid 74 and name he*) (segid a and resid 78 and name hn) 1.8 0 4.7
assign (segid b and resid 74 and name he*) (segid b and resid 78 and name hn) 1.8 0 4.7

assign (segid a and resid 75 and name ha) (segid a and resid 78 and name hn) 1.8 0 1.7
assign (segid b and resid 75 and name ha) (segid b and resid 78 and name hn) 1.8 0 1.7

assign (segid a and resid 75 and name hn) (segid a and resid 78 and name hn) 1.8 0 3.2
assign (segid b and resid 75 and name hn) (segid b and resid 78 and name hn) 1.8 0 3.2

assign (segid a and resid 75 and name hb*) (segid a and resid 78 and name hn) 1.8 0 4.7
assign (segid b and resid 75 and name hb*) (segid b and resid 78 and name hn) 1.8 0 4.7

assign (segid a and resid 76 and name hn) (segid a and resid 78 and name hn) 1.8 0 3.2
assign (segid b and resid 76 and name hn) (segid b and resid 78 and name hn) 1.8 0 3.2

!LONG

!INTER




!Met 79

!INTRA
assign (segid a and resid 79 and name hb1) (segid a and resid 79 and name hn) 1.8 0 1.7
assign (segid b and resid 79 and name hb1) (segid b and resid 79 and name hn) 1.8 0 1.7

assign (segid a and resid 79 and name hg1) (segid a and resid 79 and name hn) 1.8 0 1.1
assign (segid b and resid 79 and name hg1) (segid b and resid 79 and name hn) 1.8 0 1.1

!SEQ
assign (segid a and resid 78 and name hb*) (segid a and resid 79 and name hn) 1.8 0 4.2
assign (segid b and resid 78 and name hb*) (segid b and resid 79 and name hn) 1.8 0 4.2

assign (segid a and resid 78 and name ha) (segid a and resid 79 and name hn) 1.8 0 3.2
assign (segid b and resid 78 and name ha) (segid b and resid 79 and name hn) 1.8 0 3.2

assign (segid a and resid 80 and name hg1*) (segid a and resid 79 and name hn) 1.8 0 4.7
assign (segid b and resid 80 and name hg1*) (segid b and resid 79 and name hn) 1.8 0 4.7

!MED
assign (segid a and resid 75 and name ha) (segid a and resid 79 and name hn) 1.8 0 3.2
assign (segid b and resid 75 and name ha) (segid b and resid 79 and name hn) 1.8 0 3.2

assign (segid a and resid 76 and name ha) (segid a and resid 79 and name hn) 1.8 0 4.2
assign (segid b and resid 76 and name ha) (segid b and resid 79 and name hn) 1.8 0 4.2

assign (segid a and resid 76 and name ha) (segid a and resid 79 and name he*) 1.8 0 3.0
assign (segid b and resid 76 and name ha) (segid b and resid 79 and name he*) 1.8 0 3.0

assign (segid a and resid 76 and name hb1) (segid a and resid 79 and name hn) 1.8 0 4.2
assign (segid b and resid 76 and name hb1) (segid b and resid 79 and name hn) 1.8 0 4.2

assign (segid a and resid 76 and name hd*) (segid a and resid 79 and name he*) 1.8 0 7.6
assign (segid b and resid 76 and name hd*) (segid b and resid 79 and name he*) 1.8 0 7.6

assign (segid a and resid 77 and name hn) (segid a and resid 79 and name hn) 1.8 0 4.2
assign (segid b and resid 77 and name hn) (segid b and resid 79 and name hn) 1.8 0 4.2

assign (segid a and resid 77 and name ha) (segid a and resid 79 and name hn) 1.8 0 4.2
assign (segid b and resid 77 and name ha) (segid b and resid 79 and name hn) 1.8 0 4.2

assign (segid a and resid 77 and name hg2*) (segid a and resid 79 and name hn) 1.8 0 5.7
assign (segid b and resid 77 and name hg2*) (segid b and resid 79 and name hn) 1.8 0 5.7

assign (segid a and resid 82 and name hb) (segid a and resid 79 and name ha) 1.8 0 4.2
assign (segid b and resid 82 and name hb) (segid b and resid 79 and name ha) 1.8 0 4.2

!LONG
assign (segid a and resid 52 and name hg2*) (segid a and resid 79 and name he*) 1.8 0 6.2
assign (segid b and resid 52 and name hg2*) (segid b and resid 79 and name he*) 1.8 0 6.2

assign (segid a and resid 56 and name hg1*) (segid a and resid 79 and name he*) 1.8 0 4.5
assign (segid b and resid 56 and name hg1*) (segid b and resid 79 and name he*) 1.8 0 4.5

assign (segid a and resid 56 and name hg2*) (segid a and resid 79 and name he*) 1.8 0 6.2
assign (segid b and resid 56 and name hg2*) (segid b and resid 79 and name he*) 1.8 0 6.2

!INTER
assign (segid a and resid 71 and name he21) (segid b and resid 79 and name hn) 1.8 0 4.2
assign (segid b and resid 71 and name he21) (segid a and resid 79 and name hn) 1.8 0 4.2

assign (segid a and resid 71 and name he22) (segid b and resid 79 and name hn) 1.8 0 4.2
assign (segid b and resid 71 and name he22) (segid a and resid 79 and name hn) 1.8 0 4.2




!Val 80

!INTRA
assign (segid a and resid 80 and name ha) (segid a and resid 80 and name hg1*) 1.8 0 2.4
assign (segid b and resid 80 and name ha) (segid b and resid 80 and name hg1*) 1.8 0 2.4

assign (segid a and resid 80 and name hb) (segid a and resid 80 and name hn) 1.8 0 1.7
assign (segid b and resid 80 and name hb) (segid b and resid 80 and name hn) 1.8 0 1.7

assign (segid a and resid 80 and name hg1*) (segid a and resid 80 and name hn) 1.8 0 2.6
assign (segid b and resid 80 and name hg1*) (segid b and resid 80 and name hn) 1.8 0 2.6

assign (segid a and resid 80 and name hg2*) (segid a and resid 80 and name hn) 1.8 0 3.2
assign (segid b and resid 80 and name hg2*) (segid b and resid 80 and name hn) 1.8 0 3.2

!SEQ
assign (segid a and resid 79 and name hn) (segid a and resid 80 and name hn) 1.8 0 1.1
assign (segid b and resid 79 and name hn) (segid b and resid 80 and name hn) 1.8 0 1.1

assign (segid a and resid 79 and name ha) (segid a and resid 80 and name hn) 1.8 0 3.2
assign (segid b and resid 79 and name ha) (segid b and resid 80 and name hn) 1.8 0 3.2

assign (segid a and resid 79 and name hb1) (segid a and resid 80 and name hn) 1.8 0 3.2
assign (segid b and resid 79 and name hb1) (segid b and resid 80 and name hn) 1.8 0 3.2

assign (segid a and resid 79 and name hb2) (segid a and resid 80 and name hn) 1.8 0 1.7
assign (segid b and resid 79 and name hb2) (segid b and resid 80 and name hn) 1.8 0 1.7

assign (segid a and resid 79 and name hb2) (segid a and resid 80 and name hg1*) 1.8 0 4.7
assign (segid b and resid 79 and name hb2) (segid b and resid 80 and name hg1*) 1.8 0 4.7

assign (segid a and resid 79 and name hg1) (segid a and resid 80 and name hn) 1.8 0 3.2
assign (segid b and resid 79 and name hg1) (segid b and resid 80 and name hn) 1.8 0 3.2

assign (segid a and resid 79 and name hg2) (segid a and resid 80 and name hn) 1.8 0 3.2
assign (segid b and resid 79 and name hg2) (segid b and resid 80 and name hn) 1.8 0 3.2

assign (segid a and resid 79 and name he*) (segid a and resid 80 and name hg1*) 1.8 0 6.2
assign (segid b and resid 79 and name he*) (segid b and resid 80 and name hg1*) 1.8 0 6.2

assign (segid a and resid 81 and name hb) (segid a and resid 80 and name hn) 1.8 0 4.2
assign (segid b and resid 81 and name hb) (segid b and resid 80 and name hn) 1.8 0 4.2

!MED
assign (segid a and resid 76 and name ha) (segid a and resid 80 and name hn) 1.8 0 4.2
assign (segid b and resid 76 and name ha) (segid b and resid 80 and name hn) 1.8 0 4.2

assign (segid a and resid 76 and name ha) (segid a and resid 80 and name hg1*) 1.8 0 4.7
assign (segid b and resid 76 and name ha) (segid b and resid 80 and name hg1*) 1.8 0 4.7

assign (segid a and resid 77 and name ha) (segid a and resid 80 and name hn) 1.8 0 3.2
assign (segid b and resid 77 and name ha) (segid b and resid 80 and name hn) 1.8 0 3.2

assign (segid a and resid 77 and name hg1*) (segid a and resid 80 and name hn) 1.8 0 5.7
assign (segid b and resid 77 and name hg1*) (segid b and resid 80 and name hn) 1.8 0 5.7

assign (segid a and resid 78 and name hn) (segid a and resid 80 and name hn) 1.8 0 4.2
assign (segid b and resid 78 and name hn) (segid b and resid 80 and name hn) 1.8 0 4.2

assign (segid a and resid 78 and name ha) (segid a and resid 80 and name hn) 1.8 0 4.2
assign (segid b and resid 78 and name ha) (segid b and resid 80 and name hn) 1.8 0 4.2

assign (segid a and resid 82 and name hg2*) (segid a and resid 80 and name hn) 1.8 0 5.7
assign (segid b and resid 82 and name hg2*) (segid b and resid 80 and name hn) 1.8 0 5.7

assign (segid a and resid 83 and name hb*) (segid a and resid 80 and name ha) 1.8 0 3.0
assign (segid b and resid 83 and name hb*) (segid b and resid 80 and name ha) 1.8 0 3.0

assign (segid a and resid 83 and name hb*) (segid a and resid 80 and name hg1*) 1.8 0 6.2
assign (segid b and resid 83 and name hb*) (segid b and resid 80 and name hg1*) 1.8 0 6.2

!LONG
assign (segid a and resid 36 and name hg2*) (segid a and resid 80 and name hg1*) 1.8 0 4.5
assign (segid b and resid 36 and name hg2*) (segid b and resid 80 and name hg1*) 1.8 0 4.5

assign (segid a and resid 36 and name hd*) (segid a and resid 80 and name hg1*) 1.8 0 4.5
assign (segid b and resid 36 and name hd*) (segid b and resid 80 and name hg1*) 1.8 0 4.5

assign (segid a and resid 40 and name hd1*) (segid a and resid 80 and name hg1*) 1.8 0 6.2
assign (segid b and resid 40 and name hd1*) (segid b and resid 80 and name hg1*) 1.8 0 6.2

assign (segid a and resid 52 and name hg2*) (segid a and resid 80 and name hg1*) 1.8 0 6.2
assign (segid b and resid 52 and name hg2*) (segid b and resid 80 and name hg1*) 1.8 0 6.2

assign (segid a and resid 56 and name hg2*) (segid a and resid 80 and name hg1*) 1.8 0 4.5
assign (segid b and resid 56 and name hg2*) (segid b and resid 80 and name hg1*) 1.8 0 4.5

assign (segid a and resid 60 and name hd1*) (segid a and resid 80 and name hg1*) 1.8 0 6.2
assign (segid b and resid 60 and name hd1*) (segid b and resid 80 and name hg1*) 1.8 0 6.2

!INTER




!Thr 81

!INTRA
assign (segid a and resid 81 and name hb) (segid a and resid 81 and name hn) 1.8 0 1.7
assign (segid b and resid 81 and name hb) (segid b and resid 81 and name hn) 1.8 0 1.7

assign (segid a and resid 81 and name hg2*) (segid a and resid 81 and name hn) 1.8 0 3.2
assign (segid b and resid 81 and name hg2*) (segid b and resid 81 and name hn) 1.8 0 3.2

!SEQ
assign (segid a and resid 80 and name hn) (segid a and resid 81 and name hn) 1.8 0 1.1
assign (segid b and resid 80 and name hn) (segid b and resid 81 and name hn) 1.8 0 1.1

assign (segid a and resid 80 and name ha) (segid a and resid 81 and name hn) 1.8 0 3.2
assign (segid b and resid 80 and name ha) (segid b and resid 81 and name hn) 1.8 0 3.2

assign (segid a and resid 80 and name hb) (segid a and resid 81 and name hn) 1.8 0 1.7
assign (segid b and resid 80 and name hb) (segid b and resid 81 and name hn) 1.8 0 1.7

assign (segid a and resid 80 and name hg2*) (segid a and resid 81 and name hn) 1.8 0 3.2
assign (segid b and resid 80 and name hg2*) (segid b and resid 81 and name hn) 1.8 0 3.2

assign (segid a and resid 82 and name hn) (segid a and resid 81 and name hn) 1.8 0 1.1
assign (segid b and resid 82 and name hn) (segid b and resid 81 and name hn) 1.8 0 1.1

!MED
assign (segid a and resid 77 and name ha) (segid a and resid 81 and name hn) 1.8 0 3.2
assign (segid b and resid 77 and name ha) (segid b and resid 81 and name hn) 1.8 0 3.2

assign (segid a and resid 78 and name ha) (segid a and resid 81 and name hn) 1.8 0 1.7
assign (segid b and resid 78 and name ha) (segid b and resid 81 and name hn) 1.8 0 1.7

assign (segid a and resid 79 and name hn) (segid a and resid 81 and name hn) 1.8 0 3.2
assign (segid b and resid 79 and name hn) (segid b and resid 81 and name hn) 1.8 0 3.2

assign (segid a and resid 79 and name ha) (segid a and resid 81 and name hn) 1.8 0 3.2
assign (segid b and resid 79 and name ha) (segid b and resid 81 and name hn) 1.8 0 3.2

!LONG
assign (segid a and resid 43 and name he*) (segid a and resid 81 and name hg2*) 1.8 0 7.6
assign (segid b and resid 43 and name he*) (segid b and resid 81 and name hg2*) 1.8 0 7.6

!INTER
assign (segid a and resid 7 and name he*) (segid b and resid 81 and name hg2*) 1.8 0 4.5
assign (segid b and resid 7 and name he*) (segid a and resid 81 and name hg2*) 1.8 0 4.5

assign (segid a and resid 7 and name hb2) (segid b and resid 81 and name hg2*) 1.8 0 4.7
assign (segid b and resid 7 and name hb2) (segid a and resid 81 and name hg2*) 1.8 0 4.7

assign (segid a and resid 8 and name hb) (segid b and resid 81 and name hg2*) 1.8 0 4.7
assign (segid b and resid 8 and name hb) (segid a and resid 81 and name hg2*) 1.8 0 4.7

assign (segid a and resid 8 and name hg1*) (segid b and resid 81 and name hg2*) 1.8 0 4.5
assign (segid b and resid 8 and name hg1*) (segid a and resid 81 and name hg2*) 1.8 0 4.5

assign (segid a and resid 11 and name hd*) (segid b and resid 81 and name hg2*) 1.8 0 6.2
assign (segid b and resid 11 and name hd*) (segid a and resid 81 and name hg2*) 1.8 0 6.2




!Thr 82

!INTRA
assign (segid a and resid 82 and name hg2*) (segid a and resid 82 and name hn) 1.8 0 3.2
assign (segid b and resid 82 and name hg2*) (segid b and resid 82 and name hn) 1.8 0 3.2

!SEQ

assign (segid a and resid 81 and name hb) (segid a and resid 82 and name hn) 1.8 0 3.2
assign (segid b and resid 81 and name hb) (segid b and resid 82 and name hn) 1.8 0 3.2

assign (segid a and resid 81 and name ha) (segid a and resid 82 and name hn) 1.8 0 3.2
assign (segid b and resid 81 and name ha) (segid b and resid 82 and name hn) 1.8 0 3.2

assign (segid a and resid 81 and name hg2*) (segid a and resid 82 and name hn) 1.8 0 4.7
assign (segid b and resid 81 and name hg2*) (segid b and resid 82 and name hn) 1.8 0 4.7

!MED
assign (segid a and resid 78 and name ha) (segid a and resid 82 and name hn) 1.8 0 3.2
assign (segid b and resid 78 and name ha) (segid b and resid 82 and name hn) 1.8 0 3.2

assign (segid a and resid 78 and name hb*) (segid a and resid 82 and name hn) 1.8 0 4.2
assign (segid b and resid 78 and name hb*) (segid b and resid 82 and name hn) 1.8 0 4.2

assign (segid a and resid 79 and name ha) (segid a and resid 82 and name hn) 1.8 0 3.2
assign (segid b and resid 79 and name ha) (segid b and resid 82 and name hn) 1.8 0 3.2

assign (segid a and resid 80 and name hn) (segid a and resid 82 and name hn) 1.8 0 3.2
assign (segid b and resid 80 and name hn) (segid b and resid 82 and name hn) 1.8 0 3.2

assign (segid a and resid 80 and name ha) (segid a and resid 82 and name hn) 1.8 0 3.2
assign (segid b and resid 80 and name ha) (segid b and resid 82 and name hn) 1.8 0 3.2

assign (segid a and resid 80 and name hb) (segid a and resid 82 and name hn) 1.8 0 3.2
assign (segid b and resid 80 and name hb) (segid b and resid 82 and name hn) 1.8 0 3.2

assign (segid a and resid 83 and name hb*) (segid a and resid 82 and name hn) 1.8 0 4.7
assign (segid b and resid 83 and name hb*) (segid b and resid 82 and name hn) 1.8 0 4.7

!LONG

!INTER
assign (segid a and resid 14 and name hd*) (segid b and resid 82 and name hg2*) 1.8 0 8.6
assign (segid b and resid 14 and name hd*) (segid a and resid 82 and name hg2*) 1.8 0 8.6

assign (segid a and resid 70 and name hd*) (segid b and resid 82 and name hg2*) 1.8 0 5.4
assign (segid b and resid 70 and name hd*) (segid a and resid 82 and name hg2*) 1.8 0 5.4



!Ala 83

!INTRA
assign (segid a and resid 83 and name hb*) (segid a and resid 83 and name hn) 1.8 0 2.2
assign (segid b and resid 83 and name hb*) (segid b and resid 83 and name hn) 1.8 0 2.2

!SEQ
assign (segid a and resid 82 and name hn) (segid a and resid 83 and name hn) 1.8 0 1.1
assign (segid b and resid 82 and name hn) (segid b and resid 83 and name hn) 1.8 0 1.1

assign (segid a and resid 82 and name ha) (segid a and resid 83 and name hn) 1.8 0 3.2
assign (segid b and resid 82 and name ha) (segid b and resid 83 and name hn) 1.8 0 3.2

assign (segid a and resid 82 and name hb) (segid a and resid 83 and name hn) 1.8 0 3.2
assign (segid b and resid 82 and name hb) (segid b and resid 83 and name hn) 1.8 0 3.2

assign (segid a and resid 82 and name hg2*) (segid a and resid 83 and name hn) 1.8 0 4.7
assign (segid b and resid 82 and name hg2*) (segid b and resid 83 and name hn) 1.8 0 4.7

assign (segid a and resid 84 and name hb2) (segid a and resid 83 and name hn) 1.8 0 4.2
assign (segid b and resid 84 and name hb2) (segid b and resid 83 and name hn) 1.8 0 4.2

!MED
assign (segid a and resid 79 and name ha) (segid a and resid 83 and name hn) 1.8 0 3.2
assign (segid b and resid 79 and name ha) (segid b and resid 83 and name hn) 1.8 0 3.2

assign (segid a and resid 79 and name hb2) (segid a and resid 83 and name hn) 1.8 0 4.2
assign (segid b and resid 79 and name hb2) (segid b and resid 83 and name hn) 1.8 0 4.2

assign (segid a and resid 79 and name hb2) (segid a and resid 83 and name hb*) 1.8 0 4.7
assign (segid b and resid 79 and name hb2) (segid b and resid 83 and name hb*) 1.8 0 4.7

assign (segid a and resid 80 and name ha) (segid a and resid 83 and name hn) 1.8 0 1.7
assign (segid b and resid 80 and name ha) (segid b and resid 83 and name hn) 1.8 0 1.7

assign (segid a and resid 80 and name hg1*) (segid a and resid 83 and name hb*) 1.8 0 6.2
assign (segid b and resid 80 and name hg1*) (segid b and resid 83 and name hb*) 1.8 0 6.2

assign (segid a and resid 80 and name hg2*) (segid a and resid 83 and name hn) 1.8 0 5.7
assign (segid b and resid 80 and name hg2*) (segid b and resid 83 and name hn) 1.8 0 5.7

assign (segid a and resid 81 and name hn) (segid a and resid 83 and name hn) 1.8 0 3.2
assign (segid b and resid 81 and name hn) (segid b and resid 83 and name hn) 1.8 0 3.2

assign (segid a and resid 81 and name ha) (segid a and resid 83 and name hn) 1.8 0 3.2
assign (segid b and resid 81 and name ha) (segid b and resid 83 and name hn) 1.8 0 3.2

!LONG
assign (segid a and resid 49 and name hb2) (segid a and resid 83 and name hb*) 1.8 0 3.0
assign (segid b and resid 49 and name hb2) (segid b and resid 83 and name hb*) 1.8 0 3.0

assign (segid a and resid 49 and name hg2) (segid a and resid 83 and name hb*) 1.8 0 4.7
assign (segid b and resid 49 and name hg2) (segid b and resid 83 and name hb*) 1.8 0 4.7

assign (segid a and resid 52 and name ha) (segid a and resid 83 and name hb*) 1.8 0 4.7
assign (segid b and resid 52 and name ha) (segid b and resid 83 and name hb*) 1.8 0 4.7

assign (segid a and resid 52 and name hb) (segid a and resid 83 and name hn) 1.8 0 3.2
assign (segid b and resid 52 and name hb) (segid b and resid 83 and name hn) 1.8 0 3.2

assign (segid a and resid 52 and name hb) (segid a and resid 83 and name hb*) 1.8 0 3.0
assign (segid b and resid 52 and name hb) (segid b and resid 83 and name hb*) 1.8 0 3.0

assign (segid a and resid 52 and name hg2*) (segid a and resid 83 and name hn) 1.8 0 4.7
assign (segid b and resid 52 and name hg2*) (segid b and resid 83 and name hn) 1.8 0 4.7

assign (segid a and resid 52 and name hg2*) (segid a and resid 83 and name hb*) 1.8 0 3.9
assign (segid b and resid 52 and name hg2*) (segid b and resid 83 and name hb*) 1.8 0 3.9

assign (segid a and resid 53 and name ha) (segid a and resid 83 and name hb*) 1.8 0 3.0
assign (segid b and resid 53 and name ha) (segid b and resid 83 and name hb*) 1.8 0 3.0

assign (segid a and resid 53 and name hb) (segid a and resid 83 and name hb*) 1.8 0 3.0
assign (segid b and resid 53 and name hb) (segid b and resid 83 and name hb*) 1.8 0 3.0




!Cys 84

!INTRA

!SEQ
assign (segid a and resid 83 and name hn) (segid a and resid 84 and name hn) 1.8 0 1.7
assign (segid b and resid 83 and name hn) (segid b and resid 84 and name hn) 1.8 0 1.7

assign (segid a and resid 83 and name ha) (segid a and resid 84 and name hn) 1.8 0 4.2
assign (segid b and resid 83 and name ha) (segid b and resid 84 and name hn) 1.8 0 4.2

assign (segid a and resid 83 and name hb*) (segid a and resid 84 and name hn) 1.8 0 4.7
assign (segid b and resid 83 and name hb*) (segid b and resid 84 and name hn) 1.8 0 4.7

!MED
assign (segid a and resid 81 and name ha) (segid a and resid 84 and name hn) 1.8 0 4.2
assign (segid b and resid 81 and name ha) (segid b and resid 84 and name hn) 1.8 0 4.2

assign (segid a and resid 80 and name ha) (segid a and resid 84 and name hn) 1.8 0 4.2
assign (segid b and resid 80 and name ha) (segid b and resid 84 and name hn) 1.8 0 4.2

assign (segid a and resid 82 and name hn) (segid a and resid 84 and name hn) 1.8 0 4.2
assign (segid b and resid 82 and name hn) (segid b and resid 84 and name hn) 1.8 0 4.2

!LONG

!INTER




!His 85  
!INTRA

!SEQ

!MED

!LONG

!INTER



!Glu 86
!INTRA

!SEQ

!MED

!LONG

!INTER



!Phe 87

!INTRA

!SEQ

!MED

!LONG
assign (segid a and resid 82 and name hg2*) (segid a and resid 87 and name hd*) 1.8 0 7.1
assign (segid b and resid 82 and name hg2*) (segid b and resid 87 and name hd*) 1.8 0 7.1

!INTER
assign (segid a and resid 14 and name hb2) (segid b and resid 87 and name he*) 1.8 0 5.6
assign (segid b and resid 14 and name hb2) (segid a and resid 87 and name he*) 1.8 0 5.6

assign (segid a and resid 14 and name hd*) (segid b and resid 87 and name he*) 1.8 0 8.0
assign (segid b and resid 14 and name hd*) (segid a and resid 87 and name he*) 1.8 0 8.0

assign (segid a and resid 25 and name hb2) (segid b and resid 87 and name he*) 1.8 0 5.6
assign (segid b and resid 25 and name hb2) (segid a and resid 87 and name he*) 1.8 0 5.6

assign (segid a and resid 70 and name hb*) (segid b and resid 87 and name he*) 1.8 0 6.6
assign (segid b and resid 70 and name hb*) (segid a and resid 87 and name he*) 1.8 0 6.6

assign (segid a and resid 70 and name hd*) (segid b and resid 87 and name hd*) 1.8 0 8.0
assign (segid b and resid 70 and name hd*) (segid a and resid 87 and name hd*) 1.8 0 8.0

assign (segid a and resid 70 and name hd*) (segid b and resid 87 and name he*) 1.8 0 6.3
assign (segid b and resid 70 and name hd*) (segid a and resid 87 and name he*) 1.8 0 6.3

assign (segid a and resid 70 and name he*) (segid b and resid 87 and name hd*) 1.8 0 8.0
assign (segid b and resid 70 and name he*) (segid a and resid 87 and name hd*) 1.8 0 8.0

assign (segid a and resid 71 and name ha) (segid b and resid 87 and name he*) 1.8 0 6.6
assign (segid b and resid 71 and name ha) (segid a and resid 87 and name he*) 1.8 0 6.6




!Phe 88

!INTRA 
assign (segid a and resid 88 and name ha) (segid a and resid 88 and name hn) 1.8 0 1.7
assign (segid b and resid 88 and name ha) (segid b and resid 88 and name hn) 1.8 0 1.7

assign (segid a and resid 88 and name hb2) (segid a and resid 88 and name hn) 1.8 0 1.7
assign (segid b and resid 88 and name hb2) (segid b and resid 88 and name hn) 1.8 0 1.7

assign (segid a and resid 88 and name hd*) (segid a and resid 88 and name hn) 1.8 0 3.5
assign (segid b and resid 88 and name hd*) (segid b and resid 88 and name hn) 1.8 0 3.5

!SEQ
assign (segid a and resid 87 and name ha) (segid a and resid 88 and name hn) 1.8 0 3.2
assign (segid b and resid 87 and name ha) (segid b and resid 88 and name hn) 1.8 0 3.2

assign (segid a and resid 87 and name hb*) (segid a and resid 88 and name hn) 1.8 0 4.2
assign (segid b and resid 87 and name hb*) (segid b and resid 88 and name hn) 1.8 0 4.2

assign (segid a and resid 87 and name hd*) (segid a and resid 88 and name hn) 1.8 0 6.6
assign (segid b and resid 87 and name hd*) (segid b and resid 88 and name hn) 1.8 0 6.6

assign (segid a and resid 87 and name he*) (segid a and resid 88 and name he*) 1.8 0 6.3
assign (segid b and resid 87 and name he*) (segid b and resid 88 and name he*) 1.8 0 6.3

assign (segid a and resid 89 and name ha) (segid a and resid 88 and name hn) 1.8 0 4.2
assign (segid b and resid 89 and name ha) (segid b and resid 88 and name hn) 1.8 0 4.2

assign (segid a and resid 89 and name hb1) (segid a and resid 88 and name hn) 1.8 0 4.2
assign (segid b and resid 89 and name hb1) (segid b and resid 88 and name hn) 1.8 0 4.2

!MED

!LONG

!INTER
assign (segid a and resid 11 and name hg2*) (segid b and resid 88 and name hn) 1.8 0 5.7
assign (segid b and resid 11 and name hg2*) (segid a and resid 88 and name hn) 1.8 0 5.7

assign (segid a and resid 14 and name hd*) (segid b and resid 88 and name he*) 1.8 0 6.3
assign (segid b and resid 14 and name hd*) (segid a and resid 88 and name he*) 1.8 0 6.3

assign (segid a and resid 25 and name hb2) (segid b and resid 88 and name he*) 1.8 0 6.6
assign (segid b and resid 25 and name hb2) (segid a and resid 88 and name he*) 1.8 0 6.6

assign (segid a and resid 70 and name he*) (segid b and resid 88 and name he*) 1.8 0 5.7
assign (segid b and resid 70 and name he*) (segid a and resid 88 and name he*) 1.8 0 5.7

assign (segid a and resid 74 and name he*) (segid b and resid 88 and name he*) 1.8 0 7.1
assign (segid b and resid 74 and name he*) (segid a and resid 88 and name he*) 1.8 0 7.1




!Glu 89

!INTRA
assign (segid a and resid 89 and name hb2) (segid a and resid 89 and name hn) 1.8 0 1.1
assign (segid b and resid 89 and name hb2) (segid b and resid 89 and name hn) 1.8 0 1.1

!SEQ
assign (segid a and resid 88 and name hn) (segid a and resid 89 and name hn) 1.8 0 3.2
assign (segid b and resid 88 and name hn) (segid b and resid 89 and name hn) 1.8 0 3.2

assign (segid a and resid 88 and name ha) (segid a and resid 89 and name hn) 1.8 0 1.7
assign (segid b and resid 88 and name ha) (segid b and resid 89 and name hn) 1.8 0 1.7

assign (segid a and resid 88 and name hb1) (segid a and resid 89 and name hn) 1.8 0 3.2
assign (segid b and resid 88 and name hb1) (segid b and resid 89 and name hn) 1.8 0 3.2

assign (segid a and resid 88 and name hb2) (segid a and resid 89 and name hn) 1.8 0 3.2
assign (segid b and resid 88 and name hb2) (segid b and resid 89 and name hn) 1.8 0 3.2

assign (segid a and resid 88 and name hd*) (segid a and resid 89 and name hn) 1.8 0 5.6
assign (segid b and resid 88 and name hd*) (segid b and resid 89 and name hn) 1.8 0 5.6

assign (segid a and resid 90 and name hn) (segid a and resid 89 and name hn) 1.8 0 4.2
assign (segid b and resid 90 and name hn) (segid b and resid 89 and name hn) 1.8 0 4.2

assign (segid a and resid 90 and name hb1) (segid a and resid 89 and name hn) 1.8 0 4.2
assign (segid b and resid 90 and name hb1) (segid b and resid 89 and name hn) 1.8 0 4.2

!MED
assign (segid a and resid 87 and name hb*) (segid a and resid 89 and name hn) 1.8 0 5.2
assign (segid b and resid 87 and name hb*) (segid b and resid 89 and name hn) 1.8 0 5.2

assign (segid a and resid 87 and name hd*) (segid a and resid 89 and name hn) 1.8 0 6.6
assign (segid b and resid 87 and name hd*) (segid b and resid 89 and name hn) 1.8 0 6.6

!LONG
assign (segid a and resid 43 and name hd*) (segid a and resid 89 and name hn) 1.8 0 6.6
assign (segid b and resid 43 and name hd*) (segid b and resid 89 and name hn) 1.8 0 6.6

!INTER
 



!His 90 

!INTRA
assign (segid a and resid 90 and name ha) (segid a and resid 90 and name hn) 1.8 0 1.7
assign (segid b and resid 90 and name ha) (segid b and resid 90 and name hn) 1.8 0 1.7

!SEQ
assign (segid a and resid 89 and name ha) (segid a and resid 90 and name hn) 1.8 0 1.7
assign (segid b and resid 89 and name ha) (segid b and resid 90 and name hn) 1.8 0 1.7

!MED
assign (segid a and resid 88 and name hn) (segid a and resid 90 and name hn) 1.8 0 4.2
assign (segid b and resid 88 and name hn) (segid b and resid 90 and name hn) 1.8 0 4.2

assign (segid a and resid 88 and name hd*) (segid a and resid 90 and name hn) 1.8 0 6.6
assign (segid b and resid 88 and name hd*) (segid b and resid 90 and name hn) 1.8 0 6.6

!LONG

!INTER



!Glu 91

!INTRA
assign (segid a and resid 91 and name hb2) (segid a and resid 91 and name hn) 1.8 0 1.7
assign (segid b and resid 91 and name hb2) (segid b and resid 91 and name hn) 1.8 0 1.7

!SEQ
assign (segid a and resid 89 and name hn) (segid a and resid 91 and name hn)  1.8 0 4.2
assign (segid b and resid 89 and name hn) (segid b and resid 91 and name hn)  1.8 0 4.2

assign (segid a and resid 90 and name hn) (segid a and resid 91 and name hn)  1.8 0 3.2
assign (segid b and resid 90 and name hn) (segid b and resid 91 and name hn)  1.8 0 3.2

assign (segid a and resid 90 and name ha) (segid a and resid 91 and name hn) 1.8 0 1.7
assign (segid b and resid 90 and name ha) (segid b and resid 91 and name hn) 1.8 0 1.7

assign (segid a and resid 90 and name hb1) (segid a and resid 91 and name hn) 1.8 0 4.2
assign (segid b and resid 90 and name hb1) (segid b and resid 91 and name hn) 1.8 0 4.2

assign (segid a and resid 90 and name hb2) (segid a and resid 91 and name hn) 1.8 0 4.2
assign (segid b and resid 90 and name hb2) (segid b and resid 91 and name hn) 1.8 0 4.2

!MED

!LONG

!INTER

!END OF NOE-DERIVED DISTANCE RESTRAINTS




! H-BOND RESTRAINTS

!FOR HELIX #1
assign (segid a and resid 1 and name o) (segid a and resid 5 and name hn) 1.5 0 1.3
assign (segid b and resid 1 and name o) (segid b and resid 5 and name hn) 1.5 0 1.3

assign (segid a and resid 1 and name o) (segid a and resid 5 and name n) 2.4 0 1.1
assign (segid b and resid 1 and name o) (segid b and resid 5 and name n) 2.4 0 1.1

assign (segid a and resid 2 and name o) (segid a and resid 6 and name hn) 1.5 0 1.3
assign (segid b and resid 2 and name o) (segid b and resid 6 and name hn) 1.5 0 1.3

assign (segid a and resid 2 and name o) (segid a and resid 6 and name n) 2.4 0 1.1
assign (segid b and resid 2 and name o) (segid b and resid 6 and name n) 2.4 0 1.1

assign (segid a and resid 3 and name o) (segid a and resid 7 and name hn) 1.5 0 1.3
assign (segid b and resid 3 and name o) (segid b and resid 7 and name hn) 1.5 0 1.3

assign (segid a and resid 3 and name o) (segid a and resid 7 and name n) 2.4 0 1.1
assign (segid b and resid 3 and name o) (segid b and resid 7 and name n) 2.4 0 1.1

assign (segid a and resid 4 and name o) (segid a and resid 8 and name hn) 1.5 0 1.3
assign (segid b and resid 4 and name o) (segid b and resid 8 and name hn) 1.5 0 1.3

assign (segid a and resid 4 and name o) (segid a and resid 8 and name n) 2.4 0 1.1
assign (segid b and resid 4 and name o) (segid b and resid 8 and name n) 2.4 0 1.1

assign (segid a and resid 5 and name o) (segid a and resid 9 and name hn) 1.5 0 1.3
assign (segid b and resid 5 and name o) (segid b and resid 9 and name hn) 1.5 0 1.3

assign (segid a and resid 5 and name o) (segid a and resid 9 and name n) 2.4 0 1.1
assign (segid b and resid 5 and name o) (segid b and resid 9 and name n) 2.4 0 1.1

assign (segid a and resid 6 and name o) (segid a and resid 10 and name hn) 1.5 0 1.3
assign (segid b and resid 6 and name o) (segid b and resid 10 and name hn) 1.5 0 1.3

assign (segid a and resid 6 and name o) (segid a and resid 10 and name n) 2.4 0 1.1
assign (segid b and resid 6 and name o) (segid b and resid 10 and name n) 2.4 0 1.1

assign (segid a and resid 7 and name o) (segid a and resid 11 and name hn) 1.5 0 1.3
assign (segid b and resid 7 and name o) (segid b and resid 11 and name hn) 1.5 0 1.3

assign (segid a and resid 7 and name o) (segid a and resid 11 and name n) 2.4 0 1.1
assign (segid b and resid 7 and name o) (segid b and resid 11 and name n) 2.4 0 1.1

assign (segid a and resid 8 and name o) (segid a and resid 12 and name hn) 1.5 0 1.3
assign (segid b and resid 8 and name o) (segid b and resid 12 and name hn) 1.5 0 1.3

assign (segid a and resid 8 and name o) (segid a and resid 12 and name n) 2.4 0 1.1
assign (segid b and resid 8 and name o) (segid b and resid 12 and name n) 2.4 0 1.1

assign (segid a and resid 9 and name o) (segid a and resid 13 and name hn) 1.5 0 1.3
assign (segid b and resid 9 and name o) (segid b and resid 13 and name hn) 1.5 0 1.3

assign (segid a and resid 9 and name o) (segid a and resid 13 and name n) 2.4 0 1.1
assign (segid b and resid 9 and name o) (segid b and resid 13 and name n) 2.4 0 1.1

assign (segid a and resid 10 and name o) (segid a and resid 14 and name hn) 1.5 0 1.3
assign (segid b and resid 10 and name o) (segid b and resid 14 and name hn) 1.5 0 1.3

assign (segid a and resid 10 and name o) (segid a and resid 14 and name n) 2.4 0 1.1
assign (segid b and resid 10 and name o) (segid b and resid 14 and name n) 2.4 0 1.1

assign (segid a and resid 11 and name o) (segid a and resid 15 and name hn) 1.5 0 1.3
assign (segid b and resid 11 and name o) (segid b and resid 15 and name hn) 1.5 0 1.3

assign (segid a and resid 11 and name o) (segid a and resid 15 and name n) 2.4 0 1.1
assign (segid b and resid 11 and name o) (segid b and resid 15 and name n) 2.4 0 1.1

assign (segid a and resid 12 and name o) (segid a and resid 16 and name hn) 1.5 0 1.3
assign (segid b and resid 12 and name o) (segid b and resid 16 and name hn) 1.5 0 1.3

assign (segid a and resid 12 and name o) (segid a and resid 16 and name n) 2.4 0 1.1
assign (segid b and resid 12 and name o) (segid b and resid 16 and name n) 2.4 0 1.1

assign (segid a and resid 13 and name o) (segid a and resid 17 and name hn) 1.5 0 1.3
assign (segid b and resid 13 and name o) (segid b and resid 17 and name hn) 1.5 0 1.3

assign (segid a and resid 13 and name o) (segid a and resid 17 and name n) 2.4 0 1.1
assign (segid b and resid 13 and name o) (segid b and resid 17 and name n) 2.4 0 1.1

!LOOP 1
!K26
assign (segid a and resid 18 and name og) (segid a and resid 26 and name hn) 1.5 0 1.3
assign (segid b and resid 18 and name og) (segid b and resid 26 and name hn) 1.5 0 1.3

assign (segid a and resid 18 and name og) (segid a and resid 26 and name n) 2.4 0 1.1
assign (segid b and resid 18 and name og) (segid b and resid 26 and name n) 2.4 0 1.1

!HELIX #2
assign (segid a and resid 28 and name o) (segid a and resid 32 and name hn) 1.5 0 1.3
assign (segid b and resid 28 and name o) (segid b and resid 32 and name hn) 1.5 0 1.3

assign (segid a and resid 28 and name o) (segid a and resid 32 and name n) 2.4 0 1.1
assign (segid b and resid 28 and name o) (segid b and resid 32 and name n) 2.4 0 1.1

assign (segid a and resid 29 and name o) (segid a and resid 33 and name hn) 1.5 0 1.3
assign (segid b and resid 29 and name o) (segid b and resid 33 and name hn) 1.5 0 1.3

assign (segid a and resid 29 and name o) (segid a and resid 33 and name n) 2.4 0 1.1
assign (segid b and resid 29 and name o) (segid b and resid 33 and name n) 2.4 0 1.1

assign (segid a and resid 30 and name o) (segid a and resid 34 and name hn) 1.5 0 1.3
assign (segid b and resid 30 and name o) (segid b and resid 34 and name hn) 1.5 0 1.3

assign (segid a and resid 30 and name o) (segid a and resid 34 and name n) 2.4 0 1.1
assign (segid b and resid 30 and name o) (segid b and resid 34 and name n) 2.4 0 1.1

assign (segid a and resid 31 and name o) (segid a and resid 35 and name hn) 1.5 0 1.3
assign (segid b and resid 31 and name o) (segid b and resid 35 and name hn) 1.5 0 1.3

assign (segid a and resid 31 and name o) (segid a and resid 35 and name n) 2.4 0 1.1
assign (segid b and resid 31 and name o) (segid b and resid 35 and name n) 2.4 0 1.1

assign (segid a and resid 32 and name o) (segid a and resid 36 and name hn) 1.5 0 1.3
assign (segid b and resid 32 and name o) (segid b and resid 36 and name hn) 1.5 0 1.3

assign (segid a and resid 32 and name o) (segid a and resid 36 and name n) 2.4 0 1.1
assign (segid b and resid 32 and name o) (segid b and resid 36 and name n) 2.4 0 1.1

assign (segid a and resid 33 and name o) (segid a and resid 37 and name hn) 1.5 0 1.3
assign (segid b and resid 33 and name o) (segid b and resid 37 and name hn) 1.5 0 1.3

assign (segid a and resid 33 and name o) (segid a and resid 37 and name n) 2.4 0 1.1
assign (segid b and resid 33 and name o) (segid b and resid 37 and name n) 2.4 0 1.1

assign (segid a and resid 34 and name o) (segid a and resid 38 and name hn) 1.5 0 1.3
assign (segid b and resid 34 and name o) (segid b and resid 38 and name hn) 1.5 0 1.3

assign (segid a and resid 34 and name o) (segid a and resid 38 and name n) 2.4 0 1.1
assign (segid b and resid 34 and name o) (segid b and resid 38 and name n) 2.4 0 1.1

assign (segid a and resid 35 and name o) (segid a and resid 39 and name hn) 1.5 0 1.3
assign (segid b and resid 35 and name o) (segid b and resid 39 and name hn) 1.5 0 1.3

assign (segid a and resid 35 and name o) (segid a and resid 39 and name n) 2.4 0 1.1
assign (segid b and resid 35 and name o) (segid b and resid 39 and name n) 2.4 0 1.1

assign (segid a and resid 36 and name o) (segid a and resid 40 and name hn) 1.5 0 1.3
assign (segid b and resid 36 and name o) (segid b and resid 40 and name hn) 1.5 0 1.3

assign (segid a and resid 36 and name o) (segid a and resid 40 and name n) 2.4 0 1.1
assign (segid b and resid 36 and name o) (segid b and resid 40 and name n) 2.4 0 1.1


!HELIX #3

assign (segid a and resid 49 and name o) (segid a and resid 53 and name hn) 1.5 0 1.3
assign (segid b and resid 49 and name o) (segid b and resid 53 and name hn) 1.5 0 1.3

assign (segid a and resid 49 and name o) (segid a and resid 53 and name n) 2.4 0 1.1
assign (segid b and resid 49 and name o) (segid b and resid 53 and name n) 2.4 0 1.1

assign (segid a and resid 50 and name o) (segid a and resid 54 and name hn) 1.5 0 1.3
assign (segid b and resid 50 and name o) (segid b and resid 54 and name hn) 1.5 0 1.3

assign (segid a and resid 50 and name o) (segid a and resid 54 and name n) 2.4 0 1.1
assign (segid b and resid 50 and name o) (segid b and resid 54 and name n) 2.4 0 1.1

assign (segid a and resid 51 and name o) (segid a and resid 55 and name hn) 1.5 0 1.3
assign (segid b and resid 51 and name o) (segid b and resid 55 and name hn) 1.5 0 1.3

assign (segid a and resid 51 and name o) (segid a and resid 55 and name n) 2.4 0 1.1
assign (segid b and resid 51 and name o) (segid b and resid 55 and name n) 2.4 0 1.1

assign (segid a and resid 52 and name o) (segid a and resid 56 and name hn) 1.5 0 1.3
assign (segid b and resid 52 and name o) (segid b and resid 56 and name hn) 1.5 0 1.3

assign (segid a and resid 52 and name o) (segid a and resid 56 and name n) 2.4 0 1.1
assign (segid b and resid 52 and name o) (segid b and resid 56 and name n) 2.4 0 1.1

assign (segid a and resid 53 and name o) (segid a and resid 57 and name hn) 1.5 0 1.3
assign (segid b and resid 53 and name o) (segid b and resid 57 and name hn) 1.5 0 1.3

assign (segid a and resid 53 and name o) (segid a and resid 57 and name n) 2.4 0 1.1
assign (segid b and resid 53 and name o) (segid b and resid 57 and name n) 2.4 0 1.1

assign (segid a and resid 54 and name o) (segid a and resid 58 and name hn) 1.5 0 1.3
assign (segid b and resid 54 and name o) (segid b and resid 58 and name hn) 1.5 0 1.3

assign (segid a and resid 54 and name o) (segid a and resid 58 and name n) 2.4 0 1.1
assign (segid b and resid 54 and name o) (segid b and resid 58 and name n) 2.4 0 1.1

assign (segid a and resid 55 and name o) (segid a and resid 59 and name hn) 1.5 0 1.3
assign (segid b and resid 55 and name o) (segid b and resid 59 and name hn) 1.5 0 1.3

assign (segid a and resid 55 and name o) (segid a and resid 59 and name n) 2.4 0 1.1
assign (segid b and resid 55 and name o) (segid b and resid 59 and name n) 2.4 0 1.1

assign (segid a and resid 56 and name o) (segid a and resid 60 and name hn) 1.5 0 1.3
assign (segid b and resid 56 and name o) (segid b and resid 60 and name hn) 1.5 0 1.3

assign (segid a and resid 56 and name o) (segid a and resid 60 and name n) 2.4 0 1.1
assign (segid b and resid 56 and name o) (segid b and resid 60 and name n) 2.4 0 1.1

assign (segid a and resid 57 and name o) (segid a and resid 61 and name hn) 1.5 0 1.3
assign (segid b and resid 57 and name o) (segid b and resid 61 and name hn) 1.5 0 1.3

assign (segid a and resid 57 and name o) (segid a and resid 61 and name n) 2.4 0 1.1
assign (segid b and resid 57 and name o) (segid b and resid 61 and name n) 2.4 0 1.1

assign (segid a and resid 58 and name o) (segid a and resid 62 and name hn) 1.5 0 1.3
assign (segid b and resid 58 and name o) (segid b and resid 62 and name hn) 1.5 0 1.3

assign (segid a and resid 58 and name o) (segid a and resid 62 and name n) 2.4 0 1.1
assign (segid b and resid 58 and name o) (segid b and resid 62 and name n) 2.4 0 1.1


!HELIX #4

assign (segid a and resid 69 and name o) (segid a and resid 73 and name hn) 1.5 0 1.3
assign (segid b and resid 69 and name o) (segid b and resid 73 and name hn) 1.5 0 1.3

assign (segid a and resid 69 and name o) (segid a and resid 73 and name n) 2.4 0 1.1
assign (segid b and resid 69 and name o) (segid b and resid 73 and name n) 2.4 0 1.1

assign (segid a and resid 70 and name o) (segid a and resid 74 and name hn) 1.5 0 1.3
assign (segid b and resid 70 and name o) (segid b and resid 74 and name hn) 1.5 0 1.3

assign (segid a and resid 70 and name o) (segid a and resid 74 and name n) 2.4 0 1.1
assign (segid b and resid 70 and name o) (segid b and resid 74 and name n) 2.4 0 1.1

assign (segid a and resid 71 and name o) (segid a and resid 75 and name hn) 1.5 0 1.3
assign (segid b and resid 71 and name o) (segid b and resid 75 and name hn) 1.5 0 1.3

assign (segid a and resid 71 and name o) (segid a and resid 75 and name n) 2.4 0 1.1
assign (segid b and resid 71 and name o) (segid b and resid 75 and name n) 2.4 0 1.1

assign (segid a and resid 72 and name o) (segid a and resid 76 and name hn) 1.5 0 1.3
assign (segid b and resid 72 and name o) (segid b and resid 76 and name hn) 1.5 0 1.3

assign (segid a and resid 72 and name o) (segid a and resid 76 and name n) 2.4 0 1.1
assign (segid b and resid 72 and name o) (segid b and resid 76 and name n) 2.4 0 1.1

assign (segid a and resid 73 and name o) (segid a and resid 77 and name hn) 1.5 0 1.3
assign (segid b and resid 73 and name o) (segid b and resid 77 and name hn) 1.5 0 1.3

assign (segid a and resid 73 and name o) (segid a and resid 77 and name n) 2.4 0 1.1
assign (segid b and resid 73 and name o) (segid b and resid 77 and name n) 2.4 0 1.1

assign (segid a and resid 74 and name o) (segid a and resid 78 and name hn) 1.5 0 1.3
assign (segid b and resid 74 and name o) (segid b and resid 78 and name hn) 1.5 0 1.3

assign (segid a and resid 74 and name o) (segid a and resid 78 and name n) 2.4 0 1.1
assign (segid b and resid 74 and name o) (segid b and resid 78 and name n) 2.4 0 1.1

assign (segid a and resid 75 and name o) (segid a and resid 79 and name hn) 1.5 0 1.3
assign (segid b and resid 75 and name o) (segid b and resid 79 and name hn) 1.5 0 1.3

assign (segid a and resid 75 and name o) (segid a and resid 79 and name n) 2.4 0 1.1
assign (segid b and resid 75 and name o) (segid b and resid 79 and name n) 2.4 0 1.1

assign (segid a and resid 76 and name o) (segid a and resid 80 and name hn) 1.5 0 1.3
assign (segid b and resid 76 and name o) (segid b and resid 80 and name hn) 1.5 0 1.3

assign (segid a and resid 76 and name o) (segid a and resid 80 and name n) 2.4 0 1.1
assign (segid b and resid 76 and name o) (segid b and resid 80 and name n) 2.4 0 1.1

assign (segid a and resid 77 and name o) (segid a and resid 81 and name hn) 1.5 0 1.3
assign (segid b and resid 77 and name o) (segid b and resid 81 and name hn) 1.5 0 1.3

assign (segid a and resid 77 and name o) (segid a and resid 81 and name n) 2.4 0 1.1
assign (segid b and resid 77 and name o) (segid b and resid 81 and name n) 2.4 0 1.1

assign (segid a and resid 78 and name o) (segid a and resid 82 and name hn) 1.5 0 1.3
assign (segid b and resid 78 and name o) (segid b and resid 82 and name hn) 1.5 0 1.3

assign (segid a and resid 78 and name o) (segid a and resid 82 and name n) 2.4 0 1.1
assign (segid b and resid 78 and name o) (segid b and resid 82 and name n) 2.4 0 1.1

assign (segid a and resid 79 and name o) (segid a and resid 83 and name hn) 1.5 0 1.3
assign (segid b and resid 79 and name o) (segid b and resid 83 and name hn) 1.5 0 1.3

assign (segid a and resid 79 and name o) (segid a and resid 83 and name n) 2.4 0 1.1
assign (segid b and resid 79 and name o) (segid b and resid 83 and name n) 2.4 0 1.1

!BETA SHEET

assign (segid a and resid 27 and name o) (segid a and resid 68 and name hn) 1.5 0 1.3
assign (segid b and resid 27 and name o) (segid b and resid 68 and name hn) 1.5 0 1.3

assign (segid a and resid 27 and name o) (segid a and resid 68 and name n) 2.4 0 1.1
assign (segid b and resid 27 and name o) (segid b and resid 68 and name n) 2.4 0 1.1

assign (segid a and resid 68 and name o) (segid a and resid 27 and name hn) 1.5 0 1.3
assign (segid b and resid 68 and name o) (segid b and resid 27 and name hn) 1.5 0 1.3

assign (segid a and resid 68 and name o) (segid a and resid 27 and name n) 2.4 0 1.1
assign (segid b and resid 68 and name o) (segid b and resid 27 and name n) 2.4 0 1.1

assign (segid a and resid 66 and name o) (segid a and resid 29 and name hn) 1.5 0 1.3
assign (segid b and resid 66 and name o) (segid b and resid 29 and name hn) 1.5 0 1.3

assign (segid a and resid 66 and name o) (segid a and resid 29 and name n) 2.4 0 1.1
assign (segid b and resid 66 and name o) (segid b and resid 29 and name n) 2.4 0 1.1

!HELIX CAPS

!HELIX 1, N-terminal
assign (segid a and resid 1 and name og) (segid a and resid 4 and name hn) 1.5 0 1.3
assign (segid b and resid 1 and name og) (segid b and resid 4 and name hn) 1.5 0 1.3

assign (segid a and resid 1 and name og) (segid a and resid 4 and name n) 2.4 0 1.1
assign (segid b and resid 1 and name og) (segid b and resid 4 and name n) 2.4 0 1.1

assign (segid a and resid 4 and name oe1) (segid a and resid 1 and name hn) 1.5 0 1.3
assign (segid b and resid 4 and name oe1) (segid b and resid 1 and name hn) 1.5 0 1.3

assign (segid a and resid 4 and name oe1) (segid a and resid 1 and name n) 2.4 0 1.1
assign (segid b and resid 4 and name oe1) (segid b and resid 1 and name n) 2.4 0 1.1


!helix 3
N-terminal

assign (segid a and resid 49 and name oe1) (segid a and resid 52 and name hn) 1.5 0 1.3
assign (segid b and resid 49 and name oe1) (segid b and resid 52 and name hn) 1.5 0 1.3

assign (segid a and resid 49 and name oe1) (segid a and resid 52 and name n) 2.4 0 1.1
assign (segid b and resid 49 and name oe1) (segid b and resid 52 and name n) 2.4 0 1.1

!C-terminal
assign (segid a and resid 59 and name o) (segid a and resid 63 and name hn) 1.5 0 1.3
assign (segid b and resid 59 and name o) (segid b and resid 63 and name hn) 1.5 0 1.3

assign (segid a and resid 59 and name o) (segid a and resid 63 and name n) 2.4 0 1.1
assign (segid b and resid 59 and name o) (segid b and resid 63 and name n) 2.4 0 1.1

assign (segid a and resid 60 and name o) (segid a and resid 64 and name hn) 1.5 0 1.3
assign (segid b and resid 60 and name o) (segid b and resid 64 and name hn) 1.5 0 1.3

assign (segid a and resid 60 and name o) (segid a and resid 64 and name n) 2.4 0 1.1
assign (segid b and resid 60 and name o) (segid b and resid 64 and name n) 2.4 0 1.1

!END OF HYDROGEN-BOND RESTRAINTS



!PHI DIHEDRAL ANGLE RESTRAINTS

assign (segid a and resid 1 and name c) (segid a and resid 2 and name n)
	(segid a and resid 2 and name ca) (segid a and resid 2 and name c) 1 -60 20 2

assign (segid a and resid 2 and name c) (segid a and resid 3 and name n)
	(segid a and resid 3 and name ca) (segid a and resid 3 and name c) 1 -60 20 2

assign (segid a and resid 3 and name c) (segid a and resid 4 and name n)
	(segid a and resid 4 and name ca) (segid a and resid 4 and name c) 1 -60 20 2

assign (segid a and resid 4 and name c) (segid a and resid 5 and name n)
	(segid a and resid 5 and name ca) (segid a and resid 5 and name c) 1 -60 20 2

assign (segid a and resid 5 and name c) (segid a and resid 6 and name n)
	(segid a and resid 6 and name ca) (segid a and resid 6 and name c) 1 -60 20 2

assign (segid a and resid 8 and name c) (segid a and resid 9 and name n)
	(segid a and resid 9 and name ca) (segid a and resid 9 and name c) 1 -60 20 2

assign (segid a and resid 9 and name c) (segid a and resid 10 and name n)
	(segid a and resid 10 and name ca) (segid a and resid 10 and name c) 1 -60 20 2

assign (segid a and resid 12 and name c) (segid a and resid 13 and name n)
	(segid a and resid 13 and name ca) (segid a and resid 13 and name c) 1 -60 20 2

assign (segid a and resid 13 and name c) (segid a and resid 14 and name n)
	(segid a and resid 14 and name ca) (segid a and resid 14 and name c) 1 -60 20 2

assign (segid a and resid 25 and name c) (segid a and resid 26 and name n)
	(segid a and resid 26 and name ca) (segid a and resid 26 and name c) 1 -120 30 2

assign (segid a and resid 26 and name c) (segid a and resid 27 and name n)
	(segid a and resid 27 and name ca) (segid a and resid 27 and name c) 1 -120 30 2

assign (segid a and resid 27 and name c) (segid a and resid 28 and name n)
	(segid a and resid 28 and name ca) (segid a and resid 28 and name c) 1 -120 30 2

assign (segid a and resid 29 and name c) (segid a and resid 30 and name n)
	(segid a and resid 30 and name ca) (segid a and resid 30 and name c) 1 -60 20 2

assign (segid a and resid 31 and name c) (segid a and resid 32 and name n)
	(segid a and resid 32 and name ca) (segid a and resid 32 and name c) 1 -60 20 2

assign (segid a and resid 32 and name c) (segid a and resid 33 and name n)
	(segid a and resid 33 and name ca) (segid a and resid 33 and name c) 1 -60 20 2

assign (segid a and resid 33 and name c) (segid a and resid 34 and name n)
	(segid a and resid 34 and name ca) (segid a and resid 34 and name c) 1 -60 20 2

assign (segid a and resid 34 and name c) (segid a and resid 35 and name n)
	(segid a and resid 35 and name ca) (segid a and resid 35 and name c) 1 -60 20 2

assign (segid a and resid 35 and name c) (segid a and resid 36 and name n)
	(segid a and resid 36 and name ca) (segid a and resid 36 and name c) 1 -60 20 2

assign (segid a and resid 36 and name c) (segid a and resid 37 and name n)
	(segid a and resid 37 and name ca) (segid a and resid 37 and name c) 1 -60 20 2

assign (segid a and resid 49 and name c) (segid a and resid 50 and name n)
	(segid a and resid 50 and name ca) (segid a and resid 50 and name c) 1 -60 20 2

assign (segid a and resid 50 and name c) (segid a and resid 51 and name n)
	(segid a and resid 51 and name ca) (segid a and resid 51 and name c) 1 -60 20 2

assign (segid a and resid 51 and name c) (segid a and resid 52 and name n)
	(segid a and resid 52 and name ca) (segid a and resid 52 and name c) 1 -60 20 2

assign (segid a and resid 52 and name c) (segid a and resid 53 and name n)
	(segid a and resid 53 and name ca) (segid a and resid 53 and name c) 1 -60 20 2

assign (segid a and resid 54 and name c) (segid a and resid 55 and name n)
	(segid a and resid 55 and name ca) (segid a and resid 55 and name c) 1 -60 20 2

assign (segid a and resid 55 and name c) (segid a and resid 56 and name n)
	(segid a and resid 56 and name ca) (segid a and resid 56 and name c) 1 -60 20 2

assign (segid a and resid 56 and name c) (segid a and resid 57 and name n)
	(segid a and resid 57 and name ca) (segid a and resid 57 and name c) 1 -60 20 2

assign (segid a and resid 57 and name c) (segid a and resid 58 and name n)
	(segid a and resid 58 and name ca) (segid a and resid 58 and name c) 1 -60 20 2

assign (segid a and resid 58 and name c) (segid a and resid 59 and name n)
	(segid a and resid 59 and name ca) (segid a and resid 59 and name c) 1 -60 20 2

assign (segid a and resid 59 and name c) (segid a and resid 60 and name n)
	(segid a and resid 60 and name ca) (segid a and resid 60 and name c) 1 -60 20 2

assign (segid a and resid 60 and name c) (segid a and resid 61 and name n)
	(segid a and resid 61 and name ca) (segid a and resid 61 and name c) 1 -60 20 2

assign (segid a and resid 61 and name c) (segid a and resid 62 and name n)
	(segid a and resid 62 and name ca) (segid a and resid 62 and name c) 1 -60 20 2

assign (segid a and resid 65 and name c) (segid a and resid 66 and name n)
	(segid a and resid 66 and name ca) (segid a and resid 66 and name c) 1 -120 30 2

assign (segid a and resid 67 and name c) (segid a and resid 68 and name n)
	(segid a and resid 68 and name ca) (segid a and resid 68 and name c) 1 -120 30 2

assign (segid a and resid 68 and name c) (segid a and resid 69 and name n)
	(segid a and resid 69 and name ca) (segid a and resid 69 and name c) 1 -120 30 2

assign (segid a and resid 70 and name c) (segid a and resid 71 and name n)
	(segid a and resid 71 and name ca) (segid a and resid 71 and name c) 1 -60 20 2

assign (segid a and resid 71 and name c) (segid a and resid 72 and name n)
	(segid a and resid 72 and name ca) (segid a and resid 72 and name c) 1 -60 20 2

assign (segid a and resid 72 and name c) (segid a and resid 73 and name n)
	(segid a and resid 73 and name ca) (segid a and resid 73 and name c) 1 -60 20 2

assign (segid a and resid 73 and name c) (segid a and resid 74 and name n)
	(segid a and resid 74 and name ca) (segid a and resid 74 and name c) 1 -60 20 2

assign (segid a and resid 74 and name c) (segid a and resid 75 and name n)
	(segid a and resid 75 and name ca) (segid a and resid 75 and name c) 1 -60 20 2

assign (segid a and resid 75 and name c) (segid a and resid 76 and name n)
	(segid a and resid 76 and name ca) (segid a and resid 76 and name c) 1 -60 20 2

assign (segid a and resid 76 and name c) (segid a and resid 77 and name n)
	(segid a and resid 77 and name ca) (segid a and resid 77 and name c) 1 -60 20 2

assign (segid a and resid 77 and name c) (segid a and resid 78 and name n)
	(segid a and resid 78 and name ca) (segid a and resid 78 and name c) 1 -60 20 2

assign (segid a and resid 78 and name c) (segid a and resid 79 and name n)
	(segid a and resid 79 and name ca) (segid a and resid 79 and name c) 1 -60 20 2

assign (segid a and resid 79 and name c) (segid a and resid 80 and name n)
	(segid a and resid 80 and name ca) (segid a and resid 80 and name c) 1 -60 20 2
assign (segid b and resid 1 and name c) (segid b and resid 2 and name n)
	(segid b and resid 2 and name ca) (segid b and resid 2 and name c) 1 -60 20 2

assign (segid b and resid 2 and name c) (segid b and resid 3 and name n)
	(segid b and resid 3 and name ca) (segid b and resid 3 and name c) 1 -60 20 2

assign (segid b and resid 3 and name c) (segid b and resid 4 and name n)
	(segid b and resid 4 and name ca) (segid b and resid 4 and name c) 1 -60 20 2

assign (segid b and resid 4 and name c) (segid b and resid 5 and name n)
	(segid b and resid 5 and name ca) (segid b and resid 5 and name c) 1 -60 20 2

assign (segid b and resid 5 and name c) (segid b and resid 6 and name n)
	(segid b and resid 6 and name ca) (segid b and resid 6 and name c) 1 -60 20 2

assign (segid b and resid 8 and name c) (segid b and resid 9 and name n)
	(segid b and resid 9 and name ca) (segid b and resid 9 and name c) 1 -60 20 2

assign (segid b and resid 9 and name c) (segid b and resid 10 and name n)
	(segid b and resid 10 and name ca) (segid b and resid 10 and name c) 1 -60 20 2

assign (segid b and resid 12 and name c) (segid b and resid 13 and name n)
	(segid b and resid 13 and name ca) (segid b and resid 13 and name c) 1 -60 20 2

assign (segid b and resid 13 and name c) (segid b and resid 14 and name n)
	(segid b and resid 14 and name ca) (segid b and resid 14 and name c) 1 -60 20 2

assign (segid b and resid 25 and name c) (segid b and resid 26 and name n)
	(segid b and resid 26 and name ca) (segid b and resid 26 and name c) 1 -120 30 2

assign (segid b and resid 26 and name c) (segid b and resid 27 and name n)
	(segid b and resid 27 and name ca) (segid b and resid 27 and name c) 1 -120 30 2

assign (segid b and resid 27 and name c) (segid b and resid 28 and name n)
	(segid b and resid 28 and name ca) (segid b and resid 28 and name c) 1 -120 30 2

assign (segid b and resid 29 and name c) (segid b and resid 30 and name n)
	(segid b and resid 30 and name ca) (segid b and resid 30 and name c) 1 -60 20 2

assign (segid b and resid 31 and name c) (segid b and resid 32 and name n)
	(segid b and resid 32 and name ca) (segid b and resid 32 and name c) 1 -60 20 2

assign (segid b and resid 32 and name c) (segid b and resid 33 and name n)
	(segid b and resid 33 and name ca) (segid b and resid 33 and name c) 1 -60 20 2

assign (segid b and resid 33 and name c) (segid b and resid 34 and name n)
	(segid b and resid 34 and name ca) (segid b and resid 34 and name c) 1 -60 20 2

assign (segid b and resid 34 and name c) (segid b and resid 35 and name n)
	(segid b and resid 35 and name ca) (segid b and resid 35 and name c) 1 -60 20 2

assign (segid b and resid 35 and name c) (segid b and resid 36 and name n)
	(segid b and resid 36 and name ca) (segid b and resid 36 and name c) 1 -60 20 2

assign (segid b and resid 36 and name c) (segid b and resid 37 and name n)
	(segid b and resid 37 and name ca) (segid b and resid 37 and name c) 1 -60 20 2

assign (segid b and resid 49 and name c) (segid b and resid 50 and name n)
	(segid b and resid 50 and name ca) (segid b and resid 50 and name c) 1 -60 20 2

assign (segid b and resid 50 and name c) (segid b and resid 51 and name n)
	(segid b and resid 51 and name ca) (segid b and resid 51 and name c) 1 -60 20 2

assign (segid b and resid 51 and name c) (segid b and resid 52 and name n)
	(segid b and resid 52 and name ca) (segid b and resid 52 and name c) 1 -60 20 2

assign (segid b and resid 52 and name c) (segid b and resid 53 and name n)
	(segid b and resid 53 and name ca) (segid b and resid 53 and name c) 1 -60 20 2

assign (segid b and resid 54 and name c) (segid b and resid 55 and name n)
	(segid b and resid 55 and name ca) (segid b and resid 55 and name c) 1 -60 20 2

assign (segid b and resid 55 and name c) (segid b and resid 56 and name n)
	(segid b and resid 56 and name ca) (segid b and resid 56 and name c) 1 -60 20 2

assign (segid b and resid 56 and name c) (segid b and resid 57 and name n)
	(segid b and resid 57 and name ca) (segid b and resid 57 and name c) 1 -60 20 2

assign (segid b and resid 57 and name c) (segid b and resid 58 and name n)
	(segid b and resid 58 and name ca) (segid b and resid 58 and name c) 1 -60 20 2

assign (segid b and resid 58 and name c) (segid b and resid 59 and name n)
	(segid b and resid 59 and name ca) (segid b and resid 59 and name c) 1 -60 20 2

assign (segid b and resid 59 and name c) (segid b and resid 60 and name n)
	(segid b and resid 60 and name ca) (segid b and resid 60 and name c) 1 -60 20 2

assign (segid b and resid 60 and name c) (segid b and resid 61 and name n)
	(segid b and resid 61 and name ca) (segid b and resid 61 and name c) 1 -60 20 2

assign (segid b and resid 61 and name c) (segid b and resid 62 and name n)
	(segid b and resid 62 and name ca) (segid b and resid 62 and name c) 1 -60 20 2

assign (segid b and resid 65 and name c) (segid b and resid 66 and name n)
	(segid b and resid 66 and name ca) (segid b and resid 66 and name c) 1 -120 30 2

assign (segid b and resid 67 and name c) (segid b and resid 68 and name n)
	(segid b and resid 68 and name ca) (segid b and resid 68 and name c) 1 -120 30 2

assign (segid b and resid 68 and name c) (segid b and resid 69 and name n)
	(segid b and resid 69 and name ca) (segid b and resid 69 and name c) 1 -120 30 2

assign (segid b and resid 70 and name c) (segid b and resid 71 and name n)
	(segid b and resid 71 and name ca) (segid b and resid 71 and name c) 1 -60 20 2

assign (segid b and resid 71 and name c) (segid b and resid 72 and name n)
	(segid b and resid 72 and name ca) (segid b and resid 72 and name c) 1 -60 20 2

assign (segid b and resid 72 and name c) (segid b and resid 73 and name n)
	(segid b and resid 73 and name ca) (segid b and resid 73 and name c) 1 -60 20 2

assign (segid b and resid 73 and name c) (segid b and resid 74 and name n)
	(segid b and resid 74 and name ca) (segid b and resid 74 and name c) 1 -60 20 2

assign (segid b and resid 74 and name c) (segid b and resid 75 and name n)
	(segid b and resid 75 and name ca) (segid b and resid 75 and name c) 1 -60 20 2

assign (segid b and resid 75 and name c) (segid b and resid 76 and name n)
	(segid b and resid 76 and name ca) (segid b and resid 76 and name c) 1 -60 20 2

assign (segid b and resid 76 and name c) (segid b and resid 77 and name n)
	(segid b and resid 77 and name ca) (segid b and resid 77 and name c) 1 -60 20 2

assign (segid b and resid 77 and name c) (segid b and resid 78 and name n)
	(segid b and resid 78 and name ca) (segid b and resid 78 and name c) 1 -60 20 2

assign (segid b and resid 78 and name c) (segid b and resid 79 and name n)
	(segid b and resid 79 and name ca) (segid b and resid 79 and name c) 1 -60 20 2

assign (segid b and resid 79 and name c) (segid b and resid 80 and name n)
	(segid b and resid 80 and name ca) (segid b and resid 80 and name c) 1 -60 20 2

!END OF PHI DIHEDRAL ANGLE RESTRAINTS





! DISTACNE SYMMETRY RESTRAINTS
! references:
!	Michael Nilges, 1993, Proteins:Structure, Function, Genetics 17:297-309
!	X-PLOR v3.1 manual
 
assign (segid a and resid 0 and name ca) (segid b and resid 91 and name ca) 0 0.1 0.1 
assign (segid b and resid 0 and name ca) (segid a and resid 91 and name ca) 0 0.1 0.1

assign (segid a and resid 1 and name ca) (segid b and resid 90 and name ca) 0 0.1 0.1 
assign (segid b and resid 1 and name ca) (segid a and resid 90 and name ca) 0 0.1 0.1

assign (segid a and resid 2 and name ca) (segid b and resid 89 and name ca) 0 0.1 0.1 
assign (segid b and resid 2 and name ca) (segid a and resid 89 and name ca) 0 0.1 0.1

assign (segid a and resid 3 and name ca) (segid b and resid 88 and name ca) 0 0.1 0.1 
assign (segid b and resid 3 and name ca) (segid a and resid 88 and name ca) 0 0.1 0.1

assign (segid a and resid 4 and name ca) (segid b and resid 87 and name ca) 0 0.1 0.1 
assign (segid b and resid 4 and name ca) (segid a and resid 87 and name ca) 0 0.1 0.1

assign (segid a and resid 5 and name ca) (segid b and resid 86 and name ca) 0 0.1 0.1 
assign (segid b and resid 5 and name ca) (segid a and resid 86 and name ca) 0 0.1 0.1

assign (segid a and resid 6 and name ca) (segid b and resid 85 and name ca) 0 0.1 0.1 
assign (segid b and resid 6 and name ca) (segid a and resid 85 and name ca) 0 0.1 0.1

assign (segid a and resid 7 and name ca) (segid b and resid 84 and name ca) 0 0.1 0.1 
assign (segid b and resid 7 and name ca) (segid a and resid 84 and name ca) 0 0.1 0.1

assign (segid a and resid 8 and name ca) (segid b and resid 83 and name ca) 0 0.1 0.1 
assign (segid b and resid 8 and name ca) (segid a and resid 83 and name ca) 0 0.1 0.1

assign (segid a and resid 9 and name ca) (segid b and resid 82 and name ca) 0 0.1 0.1 
assign (segid b and resid 9 and name ca) (segid a and resid 82 and name ca) 0 0.1 0.1

assign (segid a and resid 10 and name ca) (segid b and resid 81 and name ca) 0 0.1 0.1 
assign (segid b and resid 10 and name ca) (segid a and resid 81 and name ca) 0 0.1 0.1

assign (segid a and resid 11 and name ca) (segid b and resid 80 and name ca) 0 0.1 0.1 
assign (segid b and resid 11 and name ca) (segid a and resid 80 and name ca) 0 0.1 0.1

assign (segid a and resid 12 and name ca) (segid b and resid 79 and name ca) 0 0.1 0.1 
assign (segid b and resid 12 and name ca) (segid a and resid 79 and name ca) 0 0.1 0.1

assign (segid a and resid 13 and name ca) (segid b and resid 78 and name ca) 0 0.1 0.1 
assign (segid b and resid 13 and name ca) (segid a and resid 78 and name ca) 0 0.1 0.1

assign (segid a and resid 14 and name ca) (segid b and resid 77 and name ca) 0 0.1 0.1 
assign (segid b and resid 14 and name ca) (segid a and resid 77 and name ca) 0 0.1 0.1

assign (segid a and resid 15 and name ca) (segid b and resid 76 and name ca) 0 0.1 0.1 
assign (segid b and resid 15 and name ca) (segid a and resid 76 and name ca) 0 0.1 0.1

assign (segid a and resid 16 and name ca) (segid b and resid 75 and name ca) 0 0.1 0.1 
assign (segid b and resid 16 and name ca) (segid a and resid 75 and name ca) 0 0.1 0.1

assign (segid a and resid 17 and name ca) (segid b and resid 74 and name ca) 0 0.1 0.1 
assign (segid b and resid 17 and name ca) (segid a and resid 74 and name ca) 0 0.1 0.1

assign (segid a and resid 16 and name ca) (segid b and resid 73 and name ca) 0 0.1 0.1 
assign (segid b and resid 16 and name ca) (segid a and resid 73 and name ca) 0 0.1 0.1

assign (segid a and resid 17 and name ca) (segid b and resid 72 and name ca) 0 0.1 0.1 
assign (segid b and resid 17 and name ca) (segid a and resid 72 and name ca) 0 0.1 0.1

assign (segid a and resid 18 and name ca) (segid b and resid 71 and name ca) 0 0.1 0.1 
assign (segid b and resid 18 and name ca) (segid a and resid 71 and name ca) 0 0.1 0.1

assign (segid a and resid 19 and name ca) (segid b and resid 70 and name ca) 0 0.1 0.1 
assign (segid b and resid 19 and name ca) (segid a and resid 70 and name ca) 0 0.1 0.1

assign (segid a and resid 20 and name ca) (segid b and resid 69 and name ca) 0 0.1 0.1 
assign (segid b and resid 20 and name ca) (segid a and resid 69 and name ca) 0 0.1 0.1

assign (segid a and resid 21 and name ca) (segid b and resid 68 and name ca) 0 0.1 0.1 
assign (segid b and resid 21 and name ca) (segid a and resid 68 and name ca) 0 0.1 0.1

assign (segid a and resid 22 and name ca) (segid b and resid 67 and name ca) 0 0.1 0.1 
assign (segid b and resid 22 and name ca) (segid a and resid 67 and name ca) 0 0.1 0.1

assign (segid a and resid 23 and name ca) (segid b and resid 66 and name ca) 0 0.1 0.1 
assign (segid b and resid 23 and name ca) (segid a and resid 66 and name ca) 0 0.1 0.1

assign (segid a and resid 24 and name ca) (segid b and resid 65 and name ca) 0 0.1 0.1 
assign (segid b and resid 24 and name ca) (segid a and resid 65 and name ca) 0 0.1 0.1

assign (segid a and resid 25 and name ca) (segid b and resid 64 and name ca) 0 0.1 0.1 
assign (segid b and resid 25 and name ca) (segid a and resid 64 and name ca) 0 0.1 0.1

assign (segid a and resid 26 and name ca) (segid b and resid 63 and name ca) 0 0.1 0.1 
assign (segid b and resid 26 and name ca) (segid a and resid 63 and name ca) 0 0.1 0.1

assign (segid a and resid 27 and name ca) (segid b and resid 62 and name ca) 0 0.1 0.1 
assign (segid b and resid 27 and name ca) (segid a and resid 62 and name ca) 0 0.1 0.1

assign (segid a and resid 28 and name ca) (segid b and resid 61 and name ca) 0 0.1 0.1 
assign (segid b and resid 28 and name ca) (segid a and resid 61 and name ca) 0 0.1 0.1

assign (segid a and resid 29 and name ca) (segid b and resid 60 and name ca) 0 0.1 0.1 
assign (segid b and resid 29 and name ca) (segid a and resid 60 and name ca) 0 0.1 0.1

assign (segid a and resid 30 and name ca) (segid b and resid 59 and name ca) 0 0.1 0.1 
assign (segid b and resid 30 and name ca) (segid a and resid 59 and name ca) 0 0.1 0.1

assign (segid a and resid 31 and name ca) (segid b and resid 58 and name ca) 0 0.1 0.1 
assign (segid b and resid 31 and name ca) (segid a and resid 58 and name ca) 0 0.1 0.1

assign (segid a and resid 32 and name ca) (segid b and resid 57 and name ca) 0 0.1 0.1 
assign (segid b and resid 32 and name ca) (segid a and resid 57 and name ca) 0 0.1 0.1

assign (segid a and resid 33 and name ca) (segid b and resid 56 and name ca) 0 0.1 0.1 
assign (segid b and resid 33 and name ca) (segid a and resid 56 and name ca) 0 0.1 0.1

assign (segid a and resid 34 and name ca) (segid b and resid 55 and name ca) 0 0.1 0.1 
assign (segid b and resid 34 and name ca) (segid a and resid 55 and name ca) 0 0.1 0.1

assign (segid a and resid 35 and name ca) (segid b and resid 54 and name ca) 0 0.1 0.1 
assign (segid b and resid 35 and name ca) (segid a and resid 54 and name ca) 0 0.1 0.1

assign (segid a and resid 36 and name ca) (segid b and resid 53 and name ca) 0 0.1 0.1 
assign (segid b and resid 36 and name ca) (segid a and resid 53 and name ca) 0 0.1 0.1

assign (segid a and resid 37 and name ca) (segid b and resid 52 and name ca) 0 0.1 0.1 
assign (segid b and resid 37 and name ca) (segid a and resid 52 and name ca) 0 0.1 0.1

assign (segid a and resid 38 and name ca) (segid b and resid 51 and name ca) 0 0.1 0.1 
assign (segid b and resid 38 and name ca) (segid a and resid 51 and name ca) 0 0.1 0.1

assign (segid a and resid 39 and name ca) (segid b and resid 50 and name ca) 0 0.1 0.1 
assign (segid b and resid 39 and name ca) (segid a and resid 50 and name ca) 0 0.1 0.1

assign (segid a and resid 40 and name ca) (segid b and resid 49 and name ca) 0 0.1 0.1 
assign (segid b and resid 40 and name ca) (segid a and resid 49 and name ca) 0 0.1 0.1

assign (segid a and resid 41 and name ca) (segid b and resid 48 and name ca) 0 0.1 0.1 
assign (segid b and resid 41 and name ca) (segid a and resid 48 and name ca) 0 0.1 0.1

assign (segid a and resid 42 and name ca) (segid b and resid 47 and name ca) 0 0.1 0.1 
assign (segid b and resid 42 and name ca) (segid a and resid 47 and name ca) 0 0.1 0.1

assign (segid a and resid 43 and name ca) (segid b and resid 46 and name ca) 0 0.1 0.1 
assign (segid b and resid 43 and name ca) (segid a and resid 46 and name ca) 0 0.1 0.1

assign (segid a and resid 44 and name ca) (segid b and resid 45 and name ca) 0 0.1 0.1 
assign (segid b and resid 44 and name ca) (segid a and resid 45 and name ca) 0 0.1 0.1


!END OF DISTANCE SYMMETRY RESTRAINTS

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   0          1H        MET   0   9.709   5.109 -13.984
    2   2H    MET   0          2H        MET   0   9.032   5.924 -15.312
    3   3H    MET   0          3H        MET   0   8.038   5.028 -14.265
    4    HA   MET   0           HA       MET   0   8.265   3.640 -16.099
    5   1HB   MET   0          1HB       MET   0  10.742   3.185 -16.872
    6   2HB   MET   0          2HB       MET   0   9.904   4.632 -17.434
    7   1HG   MET   0          1HG       MET   0  10.925   5.926 -15.576
    8   2HG   MET   0          2HG       MET   0  11.804   4.482 -15.075
    9   1HE   MET   0          1HE       MET   0  13.223   3.240 -16.185
   10   2HE   MET   0          2HE       MET   0  13.126   3.165 -17.942
   11   3HE   MET   0          3HE       MET   0  14.543   3.878 -17.176
   12    H    SER   1           H        SER   1   8.302   3.253 -13.245
   13    HA   SER   1           HA       SER   1   9.879   0.716 -13.139
   14   1HB   SER   1          1HB       SER   1  10.610   1.150 -10.947
   15   2HB   SER   1          2HB       SER   1  10.768   2.720 -11.729
   16    HG   SER   1           HG       SER   1   9.371   3.445 -10.351
   17    H    GLU   2           H        GLU   2   8.971  -0.600 -11.107
   18    HA   GLU   2           HA       GLU   2   6.127  -0.988 -11.667
   19   1HB   GLU   2          1HB       GLU   2   7.949  -2.353  -9.665
   20   2HB   GLU   2          2HB       GLU   2   6.319  -2.874 -10.091
   21   1HG   GLU   2          1HG       GLU   2   8.751  -2.783 -11.889
   22   2HG   GLU   2          2HG       GLU   2   7.827  -4.204 -11.401
   23    H    LEU   3           H        LEU   3   7.941  -0.416  -8.627
   24    HA   LEU   3           HA       LEU   3   5.653   0.079  -7.020
   25   1HB   LEU   3          1HB       LEU   3   8.378  -0.038  -6.600
   26   2HB   LEU   3          2HB       LEU   3   8.010   1.656  -6.278
   27    HG   LEU   3           HG       LEU   3   6.074   0.809  -4.831
   28   1HD1  LEU   3          1HD1      LEU   3   7.561  -1.745  -5.422
   29   2HD1  LEU   3          2HD1      LEU   3   6.677  -1.550  -3.907
   30   3HD1  LEU   3          3HD1      LEU   3   5.823  -1.447  -5.447
   31   1HD2  LEU   3          1HD2      LEU   3   8.896   1.054  -4.313
   32   2HD2  LEU   3          2HD2      LEU   3   7.547   1.419  -3.236
   33   3HD2  LEU   3          3HD2      LEU   3   8.228  -0.208  -3.279
   34    H    GLU   4           H        GLU   4   7.451   2.243  -9.147
   35    HA   GLU   4           HA       GLU   4   6.268   4.658  -8.071
   36   1HB   GLU   4          1HB       GLU   4   8.372   4.747  -9.318
   37   2HB   GLU   4          2HB       GLU   4   7.568   4.126 -10.762
   38   1HG   GLU   4          1HG       GLU   4   5.956   6.197 -10.335
   39   2HG   GLU   4          2HG       GLU   4   7.373   6.832  -9.498
   40    H    LYS   5           H        LYS   5   5.746   3.198 -11.315
   41    HA   LYS   5           HA       LYS   5   3.425   4.683 -11.912
   42   1HB   LYS   5          1HB       LYS   5   4.597   2.120 -12.859
   43   2HB   LYS   5          2HB       LYS   5   2.890   2.379 -13.220
   44   1HG   LYS   5          1HG       LYS   5   3.324   4.061 -14.693
   45   2HG   LYS   5          2HG       LYS   5   4.630   4.719 -13.704
   46   1HD   LYS   5          1HD       LYS   5   6.040   3.828 -15.233
   47   2HD   LYS   5          2HD       LYS   5   5.630   2.262 -14.533
   48   1HE   LYS   5          1HE       LYS   5   3.754   3.399 -16.557
   49   2HE   LYS   5          2HE       LYS   5   5.291   2.759 -17.140
   50   1HZ   LYS   5          1HZ       LYS   5   3.758   1.162 -15.223
   51   2HZ   LYS   5          2HZ       LYS   5   3.213   1.219 -16.833
   52   3HZ   LYS   5          3HZ       LYS   5   4.777   0.656 -16.484
   53    H    ALA   6           H        ALA   6   3.751   1.675 -10.083
   54    HA   ALA   6           HA       ALA   6   0.862   1.331  -9.815
   55   1HB   ALA   6          1HB       ALA   6   2.988  -0.376  -9.619
   56   2HB   ALA   6          2HB       ALA   6   2.627  -0.082  -7.917
   57   3HB   ALA   6          3HB       ALA   6   1.379  -0.723  -8.986
   58    H    MET   7           H        MET   7   3.333   1.619  -7.242
   59    HA   MET   7           HA       MET   7   1.626   2.340  -5.159
   60   1HB   MET   7          1HB       MET   7   4.178   1.927  -5.126
   61   2HB   MET   7          2HB       MET   7   4.329   3.647  -5.495
   62   1HG   MET   7          1HG       MET   7   4.422   3.329  -3.072
   63   2HG   MET   7          2HG       MET   7   2.922   4.157  -3.493
   64   1HE   MET   7          1HE       MET   7   2.841   3.234  -0.826
   65   2HE   MET   7          2HE       MET   7   1.324   3.637  -1.643
   66   3HE   MET   7          3HE       MET   7   1.442   2.176  -0.666
   67    H    VAL   8           H        VAL   8   3.392   4.596  -7.276
   68    HA   VAL   8           HA       VAL   8   2.257   6.983  -6.272
   69    HB   VAL   8           HB       VAL   8   2.971   6.487  -9.170
   70   1HG1  VAL   8          1HG1      VAL   8   2.523   8.854  -7.418
   71   2HG1  VAL   8          2HG1      VAL   8   3.850   8.962  -8.577
   72   3HG1  VAL   8          3HG1      VAL   8   2.207   8.656  -9.144
   73   1HG2  VAL   8          1HG2      VAL   8   4.615   5.977  -6.999
   74   2HG2  VAL   8          2HG2      VAL   8   5.170   6.356  -8.630
   75   3HG2  VAL   8          3HG2      VAL   8   5.030   7.637  -7.425
   76    H    ALA   9           H        ALA   9   0.964   4.661  -8.619
   77    HA   ALA   9           HA       ALA   9  -1.195   6.263  -9.587
   78   1HB   ALA   9          1HB       ALA   9  -0.407   3.469  -9.676
   79   2HB   ALA   9          2HB       ALA   9  -2.147   3.620  -9.434
   80   3HB   ALA   9          3HB       ALA   9  -1.381   4.385 -10.826
   81    H    LEU  10           H        LEU  10  -0.828   4.302  -6.664
   82    HA   LEU  10           HA       LEU  10  -3.536   4.346  -5.798
   83   1HB   LEU  10          1HB       LEU  10  -0.998   3.614  -4.703
   84   2HB   LEU  10          2HB       LEU  10  -1.817   4.648  -3.531
   85    HG   LEU  10           HG       LEU  10  -3.246   2.363  -4.891
   86   1HD1  LEU  10          1HD1      LEU  10  -1.261   2.321  -2.676
   87   2HD1  LEU  10          2HD1      LEU  10  -2.734   1.382  -2.429
   88   3HD1  LEU  10          3HD1      LEU  10  -1.700   1.051  -3.820
   89   1HD2  LEU  10          1HD2      LEU  10  -3.915   4.432  -3.002
   90   2HD2  LEU  10          2HD2      LEU  10  -4.967   3.202  -3.701
   91   3HD2  LEU  10          3HD2      LEU  10  -4.075   2.861  -2.218
   92    H    ILE  11           H        ILE  11  -0.864   6.611  -5.074
   93    HA   ILE  11           HA       ILE  11  -2.259   8.457  -3.483
   94    HB   ILE  11           HB       ILE  11  -0.165   8.980  -5.621
   95   1HG1  ILE  11          1HG1      ILE  11  -0.033   8.527  -2.624
   96   2HG1  ILE  11          2HG1      ILE  11   0.666   7.511  -3.888
   97   1HG2  ILE  11          1HG2      ILE  11  -1.681  10.942  -4.741
   98   2HG2  ILE  11          2HG2      ILE  11  -0.711  10.783  -3.277
   99   3HG2  ILE  11          3HG2      ILE  11   0.067  11.161  -4.814
  100   1HD1  ILE  11          1HD1      ILE  11   1.442  10.407  -3.460
  101   2HD1  ILE  11          2HD1      ILE  11   2.320   9.052  -2.750
  102   3HD1  ILE  11          3HD1      ILE  11   2.241   9.228  -4.504
  103    H    ASP  12           H        ASP  12  -2.486   7.821  -6.903
  104    HA   ASP  12           HA       ASP  12  -3.881  10.252  -7.624
  105   1HB   ASP  12          1HB       ASP  12  -2.649   8.475  -9.117
  106   2HB   ASP  12          2HB       ASP  12  -4.206   7.654  -9.106
  107    H    VAL  13           H        VAL  13  -4.936   6.933  -6.863
  108    HA   VAL  13           HA       VAL  13  -7.686   7.192  -7.303
  109    HB   VAL  13           HB       VAL  13  -6.145   5.660  -5.202
  110   1HG1  VAL  13          1HG1      VAL  13  -8.996   6.261  -5.268
  111   2HG1  VAL  13          2HG1      VAL  13  -8.693   4.528  -5.397
  112   3HG1  VAL  13          3HG1      VAL  13  -8.059   5.437  -4.023
  113   1HG2  VAL  13          1HG2      VAL  13  -6.626   5.267  -7.914
  114   2HG2  VAL  13          2HG2      VAL  13  -6.107   4.028  -6.771
  115   3HG2  VAL  13          3HG2      VAL  13  -7.823   4.237  -7.129
  116    H    PHE  14           H        PHE  14  -5.879   8.106  -4.352
  117    HA   PHE  14           HA       PHE  14  -8.152   9.003  -2.879
  118   1HB   PHE  14          1HB       PHE  14  -5.422   8.856  -2.400
  119   2HB   PHE  14          2HB       PHE  14  -5.741  10.592  -2.399
  120    HD1  PHE  14           HD1      PHE  14  -7.956   7.750  -1.405
  121    HD2  PHE  14           HD2      PHE  14  -5.787  11.233  -0.131
  122    HE1  PHE  14           HE1      PHE  14  -8.984   7.570   0.845
  123    HE2  PHE  14           HE2      PHE  14  -6.816  11.053   2.119
  124    HZ   PHE  14           HZ       PHE  14  -8.415   9.223   2.606
  125    H    HIS  15           H        HIS  15  -6.016  10.712  -5.151
  126    HA   HIS  15           HA       HIS  15  -7.296  13.276  -4.789
  127   1HB   HIS  15          1HB       HIS  15  -5.004  12.916  -5.787
  128   2HB   HIS  15          2HB       HIS  15  -5.795  12.287  -7.233
  129    HD1  HIS  15           HD1      HIS  15  -7.050  15.222  -5.196
  130    HD2  HIS  15           HD2      HIS  15  -5.318  14.481  -8.918
  131    HE1  HIS  15           HE1      HIS  15  -7.169  17.397  -6.486
  132    H    GLN  16           H        GLN  16  -8.146  10.403  -6.489
  133    HA   GLN  16           HA       GLN  16 -10.040  11.837  -8.263
  134   1HB   GLN  16          1HB       GLN  16  -8.806  10.042  -9.313
  135   2HB   GLN  16          2HB       GLN  16  -9.245   8.922  -8.024
  136   1HG   GLN  16          1HG       GLN  16 -11.504   8.828  -8.709
  137   2HG   GLN  16          2HG       GLN  16 -11.360  10.293  -9.681
  138   1HE2  GLN  16          1HE2      GLN  16 -10.517   6.717 -11.354
  139   2HE2  GLN  16          2HE2      GLN  16 -11.151   6.855  -9.784
  140    H    TYR  17           H        TYR  17 -10.492   8.772  -6.516
  141    HA   TYR  17           HA       TYR  17 -13.218   8.906  -6.106
  142   1HB   TYR  17          1HB       TYR  17 -10.969   7.681  -4.607
  143   2HB   TYR  17          2HB       TYR  17 -12.485   7.841  -3.720
  144    HD1  TYR  17           HD1      TYR  17 -10.902   6.411  -6.760
  145    HD2  TYR  17           HD2      TYR  17 -14.418   6.533  -4.293
  146    HE1  TYR  17           HE1      TYR  17 -11.827   4.461  -7.984
  147    HE2  TYR  17           HE2      TYR  17 -15.342   4.582  -5.517
  148    HH   TYR  17           HH       TYR  17 -14.769   3.640  -8.175
  149    H    SER  18           H        SER  18 -10.774  10.249  -3.849
  150    HA   SER  18           HA       SER  18 -12.760  11.506  -2.163
  151   1HB   SER  18          1HB       SER  18 -10.159  10.942  -1.798
  152   2HB   SER  18          2HB       SER  18 -10.000  12.623  -2.301
  153    HG   SER  18           HG       SER  18 -11.513  13.156  -0.660
  154    H    GLY  19           H        GLY  19 -10.971  12.500  -5.023
  155   1HA   GLY  19          1HA       GLY  19 -11.584  15.316  -4.804
  156   2HA   GLY  19          2HA       GLY  19 -11.045  14.494  -6.269
  157    H    ARG  20           H        ARG  20 -13.586  12.694  -5.303
  158    HA   ARG  20           HA       ARG  20 -15.326  13.574  -7.379
  159   1HB   ARG  20          1HB       ARG  20 -15.776  11.866  -4.927
  160   2HB   ARG  20          2HB       ARG  20 -17.052  12.178  -6.104
  161   1HG   ARG  20          1HG       ARG  20 -15.089  11.444  -7.796
  162   2HG   ARG  20          2HG       ARG  20 -14.590  10.527  -6.373
  163   1HD   ARG  20          1HD       ARG  20 -16.612   9.316  -6.296
  164   2HD   ARG  20          2HD       ARG  20 -17.452  10.480  -7.320
  165    HE   ARG  20           HE       ARG  20 -15.271   8.741  -8.407
  166   1HH1  ARG  20          1HH1      ARG  20 -17.694  10.923  -9.162
  167   2HH1  ARG  20          2HH1      ARG  20 -18.413   9.968 -10.416
  168   1HH2  ARG  20          1HH2      ARG  20 -16.503   7.155  -9.736
  169   2HH2  ARG  20          2HH2      ARG  20 -17.739   7.835 -10.741
  170    H    GLU  21           H        GLU  21 -16.040  13.722  -3.884
  171    HA   GLU  21           HA       GLU  21 -17.973  15.865  -4.328
  172   1HB   GLU  21          1HB       GLU  21 -16.992  14.316  -1.951
  173   2HB   GLU  21          2HB       GLU  21 -17.915  15.798  -1.704
  174   1HG   GLU  21          1HG       GLU  21 -18.983  13.838  -3.683
  175   2HG   GLU  21          2HG       GLU  21 -19.120  13.420  -1.976
  176    H    GLY  22           H        GLY  22 -17.648  17.597  -2.255
  177   1HA   GLY  22          1HA       GLY  22 -15.714  19.433  -3.198
  178   2HA   GLY  22          2HA       GLY  22 -16.476  19.523  -1.612
  179    H    ASP  23           H        ASP  23 -15.569  17.523  -0.181
  180    HA   ASP  23           HA       ASP  23 -13.033  18.149   0.695
  181   1HB   ASP  23          1HB       ASP  23 -12.978  16.032   1.797
  182   2HB   ASP  23          2HB       ASP  23 -14.678  16.484   1.709
  183    H    LYS  24           H        LYS  24 -10.915  17.441   0.227
  184    HA   LYS  24           HA       LYS  24 -10.550  15.734  -2.184
  185   1HB   LYS  24          1HB       LYS  24 -10.221  18.550  -2.186
  186   2HB   LYS  24          2HB       LYS  24  -8.598  17.858  -2.194
  187   1HG   LYS  24          1HG       LYS  24  -8.828  17.347  -4.373
  188   2HG   LYS  24          2HG       LYS  24 -10.204  16.315  -3.981
  189   1HD   LYS  24          1HD       LYS  24 -11.737  17.894  -4.594
  190   2HD   LYS  24          2HD       LYS  24 -10.753  19.229  -3.991
  191   1HE   LYS  24          1HE       LYS  24  -9.361  18.026  -6.181
  192   2HE   LYS  24          2HE       LYS  24 -11.024  18.318  -6.689
  193   1HZ   LYS  24          1HZ       LYS  24 -10.805  20.604  -5.885
  194   2HZ   LYS  24          2HZ       LYS  24  -9.183  20.310  -5.476
  195   3HZ   LYS  24          3HZ       LYS  24  -9.676  20.254  -7.102
  196    H    HIS  25           H        HIS  25 -10.099  15.647   0.862
  197    HA   HIS  25           HA       HIS  25  -7.435  14.402   0.684
  198   1HB   HIS  25          1HB       HIS  25  -7.825  16.396   2.899
  199   2HB   HIS  25          2HB       HIS  25  -6.324  15.767   2.216
  200    HD1  HIS  25           HD1      HIS  25  -5.651  16.675  -0.195
  201    HD2  HIS  25           HD2      HIS  25  -8.796  18.709   1.642
  202    HE1  HIS  25           HE1      HIS  25  -5.953  18.837  -1.478
  203    H    LYS  26           H        LYS  26 -10.424  13.903   1.429
  204    HA   LYS  26           HA       LYS  26  -9.769  12.136   3.700
  205   1HB   LYS  26          1HB       LYS  26 -12.089  13.041   4.693
  206   2HB   LYS  26          2HB       LYS  26 -10.545  13.776   5.122
  207   1HG   LYS  26          1HG       LYS  26 -11.754  14.815   2.636
  208   2HG   LYS  26          2HG       LYS  26 -12.670  15.164   4.104
  209   1HD   LYS  26          1HD       LYS  26  -9.722  15.572   4.231
  210   2HD   LYS  26          2HD       LYS  26 -10.648  16.729   3.275
  211   1HE   LYS  26          1HE       LYS  26 -11.480  17.712   5.127
  212   2HE   LYS  26          2HE       LYS  26 -11.973  16.158   5.798
  213   1HZ   LYS  26          1HZ       LYS  26  -9.136  16.952   5.811
  214   2HZ   LYS  26          2HZ       LYS  26 -10.190  17.528   7.014
  215   3HZ   LYS  26          3HZ       LYS  26  -9.944  15.857   6.824
  216    H    LEU  27           H        LEU  27 -10.797  10.214   3.425
  217    HA   LEU  27           HA       LEU  27 -12.881  10.069   1.308
  218   1HB   LEU  27          1HB       LEU  27 -10.673   8.509   1.729
  219   2HB   LEU  27          2HB       LEU  27 -11.917   7.567   2.551
  220    HG   LEU  27           HG       LEU  27 -13.338   7.830   0.459
  221   1HD1  LEU  27          1HD1      LEU  27 -10.917   9.324  -0.301
  222   2HD1  LEU  27          2HD1      LEU  27 -11.454   8.160  -1.513
  223   3HD1  LEU  27          3HD1      LEU  27 -12.552   9.423  -0.954
  224   1HD2  LEU  27          1HD2      LEU  27 -11.037   6.138   0.963
  225   2HD2  LEU  27          2HD2      LEU  27 -12.581   5.718   0.220
  226   3HD2  LEU  27          3HD2      LEU  27 -11.272   6.362  -0.771
  227    H    LYS  28           H        LYS  28 -14.217   7.777   2.091
  228    HA   LYS  28           HA       LYS  28 -15.342   8.465   4.773
  229   1HB   LYS  28          1HB       LYS  28 -16.624   8.755   2.249
  230   2HB   LYS  28          2HB       LYS  28 -17.376   7.380   3.060
  231   1HG   LYS  28          1HG       LYS  28 -17.531   8.873   5.135
  232   2HG   LYS  28          2HG       LYS  28 -17.118  10.218   4.072
  233   1HD   LYS  28          1HD       LYS  28 -19.446   8.329   3.626
  234   2HD   LYS  28          2HD       LYS  28 -19.582   9.938   4.339
  235   1HE   LYS  28          1HE       LYS  28 -18.348  10.740   2.191
  236   2HE   LYS  28          2HE       LYS  28 -18.834   9.183   1.520
  237   1HZ   LYS  28          1HZ       LYS  28 -21.144   9.798   2.340
  238   2HZ   LYS  28          2HZ       LYS  28 -20.553  11.380   2.501
  239   3HZ   LYS  28          3HZ       LYS  28 -20.559  10.626   0.976
  240    H    LYS  29           H        LYS  29 -15.621   6.678   6.057
  241    HA   LYS  29           HA       LYS  29 -14.408   4.253   5.644
  242   1HB   LYS  29          1HB       LYS  29 -16.555   3.338   7.040
  243   2HB   LYS  29          2HB       LYS  29 -15.210   4.203   7.774
  244   1HG   LYS  29          1HG       LYS  29 -17.269   5.210   8.545
  245   2HG   LYS  29          2HG       LYS  29 -16.499   6.345   7.452
  246   1HD   LYS  29          1HD       LYS  29 -18.176   4.591   5.921
  247   2HD   LYS  29          2HD       LYS  29 -19.106   5.239   7.261
  248   1HE   LYS  29          1HE       LYS  29 -17.385   7.106   5.686
  249   2HE   LYS  29          2HE       LYS  29 -18.933   6.598   5.012
  250   1HZ   LYS  29          1HZ       LYS  29 -18.795   7.524   7.801
  251   2HZ   LYS  29          2HZ       LYS  29 -18.811   8.666   6.548
  252   3HZ   LYS  29          3HZ       LYS  29 -20.099   7.572   6.714
  253    H    SER  30           H        SER  30 -17.500   5.215   4.270
  254    HA   SER  30           HA       SER  30 -18.117   2.503   3.351
  255   1HB   SER  30          1HB       SER  30 -19.808   4.385   3.844
  256   2HB   SER  30          2HB       SER  30 -19.335   5.056   2.285
  257    HG   SER  30           HG       SER  30 -21.152   3.600   2.203
  258    H    GLU  31           H        GLU  31 -16.794   5.460   1.861
  259    HA   GLU  31           HA       GLU  31 -16.626   4.273  -0.780
  260   1HB   GLU  31          1HB       GLU  31 -16.598   6.802  -0.101
  261   2HB   GLU  31          2HB       GLU  31 -14.874   6.539   0.164
  262   1HG   GLU  31          1HG       GLU  31 -14.849   7.150  -2.072
  263   2HG   GLU  31          2HG       GLU  31 -15.017   5.401  -2.231
  264    H    LEU  32           H        LEU  32 -14.798   4.012   2.111
  265    HA   LEU  32           HA       LEU  32 -12.289   3.257   0.791
  266   1HB   LEU  32          1HB       LEU  32 -12.193   4.285   3.022
  267   2HB   LEU  32          2HB       LEU  32 -13.211   3.003   3.677
  268    HG   LEU  32           HG       LEU  32 -11.515   1.339   3.253
  269   1HD1  LEU  32          1HD1      LEU  32 -10.411   3.502   1.539
  270   2HD1  LEU  32          2HD1      LEU  32  -9.232   2.494   2.377
  271   3HD1  LEU  32          3HD1      LEU  32 -10.407   1.756   1.289
  272   1HD2  LEU  32          1HD2      LEU  32 -10.454   3.889   4.497
  273   2HD2  LEU  32          2HD2      LEU  32 -11.126   2.483   5.322
  274   3HD2  LEU  32          3HD2      LEU  32  -9.553   2.373   4.532
  275    H    LYS  33           H        LYS  33 -14.745   1.597   2.788
  276    HA   LYS  33           HA       LYS  33 -13.854  -1.058   2.348
  277   1HB   LYS  33          1HB       LYS  33 -15.814  -0.051   3.826
  278   2HB   LYS  33          2HB       LYS  33 -16.791  -0.426   2.408
  279   1HG   LYS  33          1HG       LYS  33 -15.757  -2.765   2.486
  280   2HG   LYS  33          2HG       LYS  33 -15.149  -2.334   4.086
  281   1HD   LYS  33          1HD       LYS  33 -17.404  -1.934   4.896
  282   2HD   LYS  33          2HD       LYS  33 -18.067  -2.181   3.279
  283   1HE   LYS  33          1HE       LYS  33 -17.809  -4.467   3.368
  284   2HE   LYS  33          2HE       LYS  33 -16.388  -4.370   4.407
  285   1HZ   LYS  33          1HZ       LYS  33 -17.862  -3.687   6.234
  286   2HZ   LYS  33          2HZ       LYS  33 -19.207  -3.910   5.221
  287   3HZ   LYS  33          3HZ       LYS  33 -18.234  -5.236   5.647
  288    H    GLU  34           H        GLU  34 -15.846   1.106   0.450
  289    HA   GLU  34           HA       GLU  34 -16.536  -0.833  -1.599
  290   1HB   GLU  34          1HB       GLU  34 -16.902   2.067  -1.113
  291   2HB   GLU  34          2HB       GLU  34 -16.823   1.599  -2.811
  292   1HG   GLU  34          1HG       GLU  34 -18.458  -0.296  -1.408
  293   2HG   GLU  34          2HG       GLU  34 -19.023   1.331  -1.030
  294    H    LEU  35           H        LEU  35 -14.013   1.571  -1.120
  295    HA   LEU  35           HA       LEU  35 -12.852   1.591  -3.710
  296   1HB   LEU  35          1HB       LEU  35 -12.283   2.776  -1.295
  297   2HB   LEU  35          2HB       LEU  35 -10.950   1.631  -1.451
  298    HG   LEU  35           HG       LEU  35 -10.263   3.691  -2.504
  299   1HD1  LEU  35          1HD1      LEU  35  -9.767   1.495  -3.662
  300   2HD1  LEU  35          2HD1      LEU  35 -11.145   1.813  -4.715
  301   3HD1  LEU  35          3HD1      LEU  35  -9.756   2.901  -4.727
  302   1HD2  LEU  35          1HD2      LEU  35 -13.049   3.768  -3.274
  303   2HD2  LEU  35          2HD2      LEU  35 -11.852   5.062  -3.328
  304   3HD2  LEU  35          3HD2      LEU  35 -12.027   3.966  -4.699
  305    H    ILE  36           H        ILE  36 -12.404  -0.637  -0.986
  306    HA   ILE  36           HA       ILE  36 -10.354  -2.182  -2.387
  307    HB   ILE  36           HB       ILE  36 -11.822  -3.322  -0.052
  308   1HG1  ILE  36          1HG1      ILE  36 -10.162  -0.792   0.001
  309   2HG1  ILE  36          2HG1      ILE  36 -11.751  -1.065   0.713
  310   1HG2  ILE  36          1HG2      ILE  36  -9.759  -4.290  -1.234
  311   2HG2  ILE  36          2HG2      ILE  36  -8.857  -2.955  -0.516
  312   3HG2  ILE  36          3HG2      ILE  36  -9.659  -4.135   0.522
  313   1HD1  ILE  36          1HD1      ILE  36 -10.546  -2.893   2.126
  314   2HD1  ILE  36          2HD1      ILE  36  -9.069  -2.049   1.662
  315   3HD1  ILE  36          3HD1      ILE  36 -10.322  -1.202   2.571
  316    H    ASN  37           H        ASN  37 -13.714  -2.882  -1.348
  317    HA   ASN  37           HA       ASN  37 -13.782  -5.383  -2.815
  318   1HB   ASN  37          1HB       ASN  37 -15.162  -4.873  -0.775
  319   2HB   ASN  37          2HB       ASN  37 -16.123  -3.773  -1.763
  320   1HD2  ASN  37          1HD2      ASN  37 -16.824  -7.744  -1.969
  321   2HD2  ASN  37          2HD2      ASN  37 -15.722  -7.081  -0.861
  322    H    ASN  38           H        ASN  38 -13.845  -2.259  -3.965
  323    HA   ASN  38           HA       ASN  38 -15.661  -3.018  -6.217
  324   1HB   ASN  38          1HB       ASN  38 -16.094  -0.890  -4.790
  325   2HB   ASN  38          2HB       ASN  38 -14.724  -0.206  -5.667
  326   1HD2  ASN  38          1HD2      ASN  38 -16.612   0.385  -8.579
  327   2HD2  ASN  38          2HD2      ASN  38 -15.165   0.638  -7.727
  328    H    GLU  39           H        GLU  39 -12.795  -0.907  -5.764
  329    HA   GLU  39           HA       GLU  39 -11.937  -1.169  -8.484
  330   1HB   GLU  39          1HB       GLU  39 -10.783  -0.116  -5.958
  331   2HB   GLU  39          2HB       GLU  39  -9.625  -0.587  -7.202
  332   1HG   GLU  39          1HG       GLU  39 -10.442   1.832  -7.303
  333   2HG   GLU  39          2HG       GLU  39 -10.580   0.907  -8.800
  334    H    LEU  40           H        LEU  40 -10.557  -2.680  -5.527
  335    HA   LEU  40           HA       LEU  40  -8.950  -4.513  -7.105
  336   1HB   LEU  40          1HB       LEU  40  -9.521  -4.096  -4.199
  337   2HB   LEU  40          2HB       LEU  40  -8.897  -5.669  -4.696
  338    HG   LEU  40           HG       LEU  40  -7.594  -3.113  -5.623
  339   1HD1  LEU  40          1HD1      LEU  40  -7.750  -4.016  -2.926
  340   2HD1  LEU  40          2HD1      LEU  40  -6.120  -4.369  -3.503
  341   3HD1  LEU  40          3HD1      LEU  40  -6.745  -2.722  -3.574
  342   1HD2  LEU  40          1HD2      LEU  40  -7.035  -6.033  -5.666
  343   2HD2  LEU  40          2HD2      LEU  40  -6.610  -4.792  -6.843
  344   3HD2  LEU  40          3HD2      LEU  40  -5.651  -4.981  -5.376
  345    H    SER  41           H        SER  41 -10.717  -6.052  -4.553
  346    HA   SER  41           HA       SER  41 -11.964  -8.056  -4.693
  347   1HB   SER  41          1HB       SER  41 -13.602  -6.116  -4.880
  348   2HB   SER  41          2HB       SER  41 -13.594  -6.387  -6.621
  349    HG   SER  41           HG       SER  41 -15.136  -7.742  -6.069
  350    H    HIS  42           H        HIS  42 -10.475  -9.427  -5.847
  351    HA   HIS  42           HA       HIS  42 -11.475 -10.332  -8.417
  352   1HB   HIS  42          1HB       HIS  42  -9.736  -8.203  -8.608
  353   2HB   HIS  42          2HB       HIS  42  -8.652  -9.585  -8.769
  354    HD1  HIS  42           HD1      HIS  42  -8.465  -8.718 -11.340
  355    HD2  HIS  42           HD2      HIS  42 -12.138 -10.331 -10.210
  356    HE1  HIS  42           HE1      HIS  42  -9.699  -9.261 -13.485
  357    H    PHE  43           H        PHE  43  -8.347 -10.277  -6.647
  358    HA   PHE  43           HA       PHE  43  -8.086 -13.181  -7.097
  359   1HB   PHE  43          1HB       PHE  43  -5.889 -12.876  -5.925
  360   2HB   PHE  43          2HB       PHE  43  -6.073 -11.843  -7.342
  361    HD1  PHE  43           HD1      PHE  43  -6.209 -11.926  -3.630
  362    HD2  PHE  43           HD2      PHE  43  -6.175  -9.456  -7.144
  363    HE1  PHE  43           HE1      PHE  43  -5.853  -9.919  -2.214
  364    HE2  PHE  43           HE2      PHE  43  -5.818  -7.450  -5.729
  365    HZ   PHE  43           HZ       PHE  43  -5.657  -7.680  -3.264
  366    H    LEU  44           H        LEU  44 -10.172 -11.947  -5.248
  367    HA   LEU  44           HA       LEU  44  -9.310 -12.918  -2.599
  368   1HB   LEU  44          1HB       LEU  44 -11.339 -11.128  -3.595
  369   2HB   LEU  44          2HB       LEU  44 -12.096 -12.380  -2.610
  370    HG   LEU  44           HG       LEU  44 -10.339 -11.922  -0.845
  371   1HD1  LEU  44          1HD1      LEU  44  -9.305 -10.312  -2.968
  372   2HD1  LEU  44          2HD1      LEU  44  -9.747  -9.240  -1.637
  373   3HD1  LEU  44          3HD1      LEU  44  -8.619 -10.569  -1.363
  374   1HD2  LEU  44          1HD2      LEU  44 -12.324  -9.818  -1.724
  375   2HD2  LEU  44          2HD2      LEU  44 -12.488 -11.001  -0.427
  376   3HD2  LEU  44          3HD2      LEU  44 -11.387  -9.637  -0.239
  377    H    GLU  45           H        GLU  45  -9.629 -15.005  -1.977
  378    HA   GLU  45           HA       GLU  45 -11.796 -16.544  -3.341
  379   1HB   GLU  45          1HB       GLU  45  -8.971 -17.461  -2.739
  380   2HB   GLU  45          2HB       GLU  45 -10.270 -18.538  -3.255
  381   1HG   GLU  45          1HG       GLU  45 -10.354 -16.426  -5.086
  382   2HG   GLU  45          2HG       GLU  45  -8.633 -16.735  -4.851
  383    H    GLU  46           H        GLU  46  -9.448 -17.478  -0.845
  384    HA   GLU  46           HA       GLU  46 -11.766 -18.092   0.934
  385   1HB   GLU  46          1HB       GLU  46 -10.149 -19.588   2.121
  386   2HB   GLU  46          2HB       GLU  46 -10.382 -20.034   0.429
  387   1HG   GLU  46          1HG       GLU  46  -8.303 -19.097  -0.222
  388   2HG   GLU  46          2HG       GLU  46  -8.150 -18.190   1.284
  389    H    ILE  47           H        ILE  47  -8.902 -16.141   0.639
  390    HA   ILE  47           HA       ILE  47  -8.032 -14.477   2.054
  391    HB   ILE  47           HB       ILE  47 -10.582 -14.734   3.660
  392   1HG1  ILE  47          1HG1      ILE  47 -10.228 -13.088   1.139
  393   2HG1  ILE  47          2HG1      ILE  47 -11.022 -14.664   1.155
  394   1HG2  ILE  47          1HG2      ILE  47  -8.409 -12.744   3.288
  395   2HG2  ILE  47          2HG2      ILE  47 -10.043 -12.093   3.408
  396   3HG2  ILE  47          3HG2      ILE  47  -9.391 -13.084   4.713
  397   1HD1  ILE  47          1HD1      ILE  47 -12.409 -13.579   3.138
  398   2HD1  ILE  47          2HD1      ILE  47 -11.929 -12.073   2.357
  399   3HD1  ILE  47          3HD1      ILE  47 -12.857 -13.275   1.459
  400    H    LYS  48           H        LYS  48  -6.407 -15.905   2.907
  401    HA   LYS  48           HA       LYS  48  -6.953 -17.669   5.132
  402   1HB   LYS  48          1HB       LYS  48  -4.870 -17.389   3.366
  403   2HB   LYS  48          2HB       LYS  48  -4.182 -16.711   4.843
  404   1HG   LYS  48          1HG       LYS  48  -4.587 -18.715   6.074
  405   2HG   LYS  48          2HG       LYS  48  -5.640 -19.360   4.814
  406   1HD   LYS  48          1HD       LYS  48  -3.748 -19.559   3.280
  407   2HD   LYS  48          2HD       LYS  48  -2.676 -18.817   4.470
  408   1HE   LYS  48          1HE       LYS  48  -3.209 -20.696   6.042
  409   2HE   LYS  48          2HE       LYS  48  -4.127 -21.464   4.746
  410   1HZ   LYS  48          1HZ       LYS  48  -1.861 -20.993   3.476
  411   2HZ   LYS  48          2HZ       LYS  48  -1.249 -21.154   5.052
  412   3HZ   LYS  48          3HZ       LYS  48  -2.137 -22.420   4.349
  413    H    GLU  49           H        GLU  49  -5.865 -14.310   4.864
  414    HA   GLU  49           HA       GLU  49  -5.338 -14.162   7.757
  415   1HB   GLU  49          1HB       GLU  49  -5.060 -12.295   5.432
  416   2HB   GLU  49          2HB       GLU  49  -5.220 -11.602   7.045
  417   1HG   GLU  49          1HG       GLU  49  -3.255 -13.822   6.496
  418   2HG   GLU  49          2HG       GLU  49  -2.829 -12.134   6.212
  419    H    GLN  50           H        GLN  50  -7.804 -14.979   7.796
  420    HA   GLN  50           HA       GLN  50  -9.936 -13.203   7.317
  421   1HB   GLN  50          1HB       GLN  50 -10.079 -15.628   8.095
  422   2HB   GLN  50          2HB       GLN  50  -9.764 -15.029   9.726
  423   1HG   GLN  50          1HG       GLN  50 -11.747 -13.620   9.648
  424   2HG   GLN  50          2HG       GLN  50 -12.031 -14.059   7.962
  425   1HE2  GLN  50          1HE2      GLN  50 -13.621 -16.368  10.778
  426   2HE2  GLN  50          2HE2      GLN  50 -13.094 -14.774  11.029
  427    H    GLU  51           H        GLU  51  -7.426 -13.071   9.702
  428    HA   GLU  51           HA       GLU  51  -8.866 -11.263  11.498
  429   1HB   GLU  51          1HB       GLU  51  -6.325 -12.676  11.481
  430   2HB   GLU  51          2HB       GLU  51  -6.118 -10.998  11.986
  431   1HG   GLU  51          1HG       GLU  51  -8.147 -11.396  13.527
  432   2HG   GLU  51          2HG       GLU  51  -7.885 -13.113  13.217
  433    H    VAL  52           H        VAL  52  -6.518 -10.964   8.861
  434    HA   VAL  52           HA       VAL  52  -6.030  -8.146   9.231
  435    HB   VAL  52           HB       VAL  52  -5.806  -9.851   6.724
  436   1HG1  VAL  52          1HG1      VAL  52  -4.874  -7.072   7.444
  437   2HG1  VAL  52          2HG1      VAL  52  -4.047  -8.024   6.210
  438   3HG1  VAL  52          3HG1      VAL  52  -5.746  -7.599   6.004
  439   1HG2  VAL  52          1HG2      VAL  52  -4.456 -10.282   9.002
  440   2HG2  VAL  52          2HG2      VAL  52  -3.701 -10.469   7.417
  441   3HG2  VAL  52          3HG2      VAL  52  -3.456  -8.987   8.344
  442    H    VAL  53           H        VAL  53  -8.145  -9.928   6.955
  443    HA   VAL  53           HA       VAL  53  -9.365  -7.490   5.974
  444    HB   VAL  53           HB       VAL  53 -10.420 -10.329   5.805
  445   1HG1  VAL  53          1HG1      VAL  53 -11.215  -7.706   4.677
  446   2HG1  VAL  53          2HG1      VAL  53 -11.178  -9.044   3.528
  447   3HG1  VAL  53          3HG1      VAL  53 -12.188  -9.147   4.970
  448   1HG2  VAL  53          1HG2      VAL  53  -8.037  -9.240   4.737
  449   2HG2  VAL  53          2HG2      VAL  53  -8.793 -10.774   4.307
  450   3HG2  VAL  53          3HG2      VAL  53  -9.183  -9.315   3.398
  451    H    ASP  54           H        ASP  54 -10.085  -9.741   8.577
  452    HA   ASP  54           HA       ASP  54 -12.744  -8.611   9.039
  453   1HB   ASP  54          1HB       ASP  54 -12.131 -10.973   9.658
  454   2HB   ASP  54          2HB       ASP  54 -11.071 -10.317  10.907
  455    H    LYS  55           H        LYS  55  -9.496  -7.831   9.876
  456    HA   LYS  55           HA       LYS  55 -10.199  -6.312  12.281
  457   1HB   LYS  55          1HB       LYS  55  -7.967  -7.300  12.108
  458   2HB   LYS  55          2HB       LYS  55  -7.658  -6.400  10.623
  459   1HG   LYS  55          1HG       LYS  55  -8.510  -4.759  12.938
  460   2HG   LYS  55          2HG       LYS  55  -6.925  -5.522  13.095
  461   1HD   LYS  55          1HD       LYS  55  -6.167  -4.527  11.026
  462   2HD   LYS  55          2HD       LYS  55  -7.782  -3.910  10.678
  463   1HE   LYS  55          1HE       LYS  55  -7.245  -2.025  11.785
  464   2HE   LYS  55          2HE       LYS  55  -7.132  -2.977  13.267
  465   1HZ   LYS  55          1HZ       LYS  55  -4.805  -3.569  12.182
  466   2HZ   LYS  55          2HZ       LYS  55  -5.018  -2.027  11.502
  467   3HZ   LYS  55          3HZ       LYS  55  -5.022  -2.216  13.188
  468    H    VAL  56           H        VAL  56  -9.179  -5.495   8.942
  469    HA   VAL  56           HA       VAL  56  -9.701  -2.656   9.382
  470    HB   VAL  56           HB       VAL  56  -9.523  -2.669   6.784
  471   1HG1  VAL  56          1HG1      VAL  56  -7.218  -3.602   8.518
  472   2HG1  VAL  56          2HG1      VAL  56  -7.055  -2.862   6.926
  473   3HG1  VAL  56          3HG1      VAL  56  -7.714  -1.928   8.271
  474   1HG2  VAL  56          1HG2      VAL  56  -9.740  -5.401   7.170
  475   2HG2  VAL  56          2HG2      VAL  56  -9.146  -4.624   5.704
  476   3HG2  VAL  56          3HG2      VAL  56  -8.008  -5.173   6.933
  477    H    MET  57           H        MET  57 -11.397  -5.400   7.997
  478    HA   MET  57           HA       MET  57 -13.617  -3.873   6.936
  479   1HB   MET  57          1HB       MET  57 -12.951  -6.244   6.268
  480   2HB   MET  57          2HB       MET  57 -13.643  -6.775   7.802
  481   1HG   MET  57          1HG       MET  57 -15.771  -6.501   7.071
  482   2HG   MET  57          2HG       MET  57 -15.391  -4.988   6.249
  483   1HE   MET  57          1HE       MET  57 -14.501  -4.641   4.153
  484   2HE   MET  57          2HE       MET  57 -13.080  -5.695   4.108
  485   3HE   MET  57          3HE       MET  57 -14.284  -5.780   2.825
  486    H    GLU  58           H        GLU  58 -12.723  -5.122  10.066
  487    HA   GLU  58           HA       GLU  58 -15.397  -4.994  11.213
  488   1HB   GLU  58          1HB       GLU  58 -12.629  -5.416  12.230
  489   2HB   GLU  58          2HB       GLU  58 -13.796  -4.766  13.381
  490   1HG   GLU  58          1HG       GLU  58 -15.313  -6.622  12.975
  491   2HG   GLU  58          2HG       GLU  58 -14.263  -7.246  11.700
  492    H    THR  59           H        THR  59 -12.496  -2.895  11.557
  493    HA   THR  59           HA       THR  59 -13.867  -0.802  12.950
  494    HB   THR  59           HB       THR  59 -11.561  -0.371  11.032
  495    HG1  THR  59           HG1      THR  59 -11.495  -1.323  13.704
  496   1HG2  THR  59          1HG2      THR  59 -12.950   1.207  13.005
  497   2HG2  THR  59          2HG2      THR  59 -11.271   0.989  13.499
  498   3HG2  THR  59          3HG2      THR  59 -11.643   1.691  11.924
  499    H    LEU  60           H        LEU  60 -13.692  -1.727   9.603
  500    HA   LEU  60           HA       LEU  60 -14.611   0.726   8.423
  501   1HB   LEU  60          1HB       LEU  60 -14.409  -2.139   7.616
  502   2HB   LEU  60          2HB       LEU  60 -15.516  -1.129   6.691
  503    HG   LEU  60           HG       LEU  60 -12.633  -0.385   7.248
  504   1HD1  LEU  60          1HD1      LEU  60 -13.587  -2.400   5.527
  505   2HD1  LEU  60          2HD1      LEU  60 -13.264  -1.015   4.485
  506   3HD1  LEU  60          3HD1      LEU  60 -11.983  -1.667   5.508
  507   1HD2  LEU  60          1HD2      LEU  60 -14.879   0.760   5.594
  508   2HD2  LEU  60          2HD2      LEU  60 -13.824   1.585   6.742
  509   3HD2  LEU  60          3HD2      LEU  60 -13.199   1.083   5.170
  510    H    ASP  61           H        ASP  61 -16.352  -2.275   9.250
  511    HA   ASP  61           HA       ASP  61 -18.958  -1.017   8.858
  512   1HB   ASP  61          1HB       ASP  61 -17.978  -3.645   8.934
  513   2HB   ASP  61          2HB       ASP  61 -19.001  -3.503  10.365
  514    H    GLU  62           H        GLU  62 -16.700  -0.872  11.315
  515    HA   GLU  62           HA       GLU  62 -18.541  -1.007  13.580
  516   1HB   GLU  62          1HB       GLU  62 -16.125  -1.559  13.805
  517   2HB   GLU  62          2HB       GLU  62 -15.732   0.123  13.446
  518   1HG   GLU  62          1HG       GLU  62 -17.170   0.798  15.405
  519   2HG   GLU  62          2HG       GLU  62 -17.315  -0.911  15.814
  520    H    ASP  63           H        ASP  63 -16.938   1.579  11.749
  521    HA   ASP  63           HA       ASP  63 -18.472   3.585  13.304
  522   1HB   ASP  63          1HB       ASP  63 -17.125   5.108  11.540
  523   2HB   ASP  63          2HB       ASP  63 -16.409   4.552  13.051
  524    H    GLY  64           H        GLY  64 -17.831   2.993   9.836
  525   1HA   GLY  64          1HA       GLY  64 -19.175   3.551   7.976
  526   2HA   GLY  64          2HA       GLY  64 -20.437   2.761   8.921
  527    H    ASP  65           H        ASP  65 -18.878   5.616  10.168
  528    HA   ASP  65           HA       ASP  65 -21.157   7.320   9.328
  529   1HB   ASP  65          1HB       ASP  65 -21.418   6.107  11.636
  530   2HB   ASP  65          2HB       ASP  65 -20.272   7.323  12.191
  531    H    GLY  66           H        GLY  66 -17.814   6.992   9.897
  532   1HA   GLY  66          1HA       GLY  66 -17.514   9.949  10.073
  533   2HA   GLY  66          2HA       GLY  66 -16.328   8.813  10.707
  534    H    GLU  67           H        GLU  67 -14.837  10.101   9.305
  535    HA   GLU  67           HA       GLU  67 -14.933   9.125   6.475
  536   1HB   GLU  67          1HB       GLU  67 -13.989  11.767   7.614
  537   2HB   GLU  67          2HB       GLU  67 -13.554  11.223   5.992
  538   1HG   GLU  67          1HG       GLU  67 -15.536  11.951   5.220
  539   2HG   GLU  67          2HG       GLU  67 -16.362  10.836   6.307
  540    H    CYS  68           H        CYS  68 -12.827   8.634   5.529
  541    HA   CYS  68           HA       CYS  68 -10.862   7.764   7.588
  542   1HB   CYS  68          1HB       CYS  68 -11.462   6.935   4.756
  543   2HB   CYS  68          2HB       CYS  68  -9.892   6.565   5.471
  544    HG   CYS  68           HG       CYS  68 -11.272   5.332   7.436
  545    H    ASP  69           H        ASP  69  -8.503   8.019   6.953
  546    HA   ASP  69           HA       ASP  69  -8.128  10.723   5.747
  547   1HB   ASP  69          1HB       ASP  69  -7.136   9.665   8.093
  548   2HB   ASP  69          2HB       ASP  69  -5.786   9.445   6.983
  549    H    PHE  70           H        PHE  70  -5.416  10.480   5.074
  550    HA   PHE  70           HA       PHE  70  -5.670   8.787   2.656
  551   1HB   PHE  70          1HB       PHE  70  -3.967  10.086   1.688
  552   2HB   PHE  70          2HB       PHE  70  -4.855  11.250   2.666
  553    HD1  PHE  70           HD1      PHE  70  -3.986  11.686   5.077
  554    HD2  PHE  70           HD2      PHE  70  -1.666   9.778   2.002
  555    HE1  PHE  70           HE1      PHE  70  -1.904  12.233   6.309
  556    HE2  PHE  70           HE2      PHE  70   0.413  10.327   3.231
  557    HZ   PHE  70           HZ       PHE  70   0.297  11.555   5.385
  558    H    GLN  71           H        GLN  71  -3.756   9.056   5.606
  559    HA   GLN  71           HA       GLN  71  -1.927   6.899   4.809
  560   1HB   GLN  71          1HB       GLN  71  -2.432   8.302   7.459
  561   2HB   GLN  71          2HB       GLN  71  -1.226   7.034   7.242
  562   1HG   GLN  71          1HG       GLN  71  -0.817   8.861   5.130
  563   2HG   GLN  71          2HG       GLN  71  -1.041   9.836   6.585
  564   1HE2  GLN  71          1HE2      GLN  71   2.011   7.070   6.722
  565   2HE2  GLN  71          2HE2      GLN  71   0.556   6.652   5.953
  566    H    GLU  72           H        GLU  72  -5.002   7.263   6.352
  567    HA   GLU  72           HA       GLU  72  -5.009   4.647   7.642
  568   1HB   GLU  72          1HB       GLU  72  -6.964   6.873   7.213
  569   2HB   GLU  72          2HB       GLU  72  -7.607   5.276   7.591
  570   1HG   GLU  72          1HG       GLU  72  -5.366   5.852   9.315
  571   2HG   GLU  72          2HG       GLU  72  -6.537   7.168   9.405
  572    H    PHE  73           H        PHE  73  -6.733   6.037   4.825
  573    HA   PHE  73           HA       PHE  73  -7.778   3.512   3.942
  574   1HB   PHE  73          1HB       PHE  73  -8.932   4.970   2.651
  575   2HB   PHE  73          2HB       PHE  73  -7.826   6.268   3.075
  576    HD1  PHE  73           HD1      PHE  73  -5.617   6.439   1.770
  577    HD2  PHE  73           HD2      PHE  73  -8.940   4.045   0.476
  578    HE1  PHE  73           HE1      PHE  73  -4.696   6.404  -0.534
  579    HE2  PHE  73           HE2      PHE  73  -8.019   4.008  -1.828
  580    HZ   PHE  73           HZ       PHE  73  -5.896   5.188  -2.333
  581    H    MET  74           H        MET  74  -4.664   4.956   3.780
  582    HA   MET  74           HA       MET  74  -3.715   3.442   1.467
  583   1HB   MET  74          1HB       MET  74  -2.641   5.431   3.350
  584   2HB   MET  74          2HB       MET  74  -1.469   4.193   2.906
  585   1HG   MET  74          1HG       MET  74  -3.040   5.189   0.630
  586   2HG   MET  74          2HG       MET  74  -2.045   6.426   1.399
  587   1HE   MET  74          1HE       MET  74  -2.610   3.598  -0.524
  588   2HE   MET  74          2HE       MET  74  -1.481   4.174  -1.758
  589   3HE   MET  74          3HE       MET  74  -1.124   2.707  -0.850
  590    H    ALA  75           H        ALA  75  -3.120   3.253   4.996
  591    HA   ALA  75           HA       ALA  75  -1.688   0.750   4.779
  592   1HB   ALA  75          1HB       ALA  75  -1.439   2.333   6.699
  593   2HB   ALA  75          2HB       ALA  75  -3.084   1.941   7.199
  594   3HB   ALA  75          3HB       ALA  75  -1.834   0.695   7.219
  595    H    PHE  76           H        PHE  76  -5.006   1.618   4.741
  596    HA   PHE  76           HA       PHE  76  -6.010  -0.943   5.731
  597   1HB   PHE  76          1HB       PHE  76  -7.135   1.620   4.834
  598   2HB   PHE  76          2HB       PHE  76  -8.084   0.224   4.324
  599    HD1  PHE  76           HD1      PHE  76  -6.445   1.759   7.316
  600    HD2  PHE  76           HD2      PHE  76  -9.499  -0.887   5.853
  601    HE1  PHE  76           HE1      PHE  76  -7.360   1.550   9.612
  602    HE2  PHE  76           HE2      PHE  76 -10.413  -1.096   8.152
  603    HZ   PHE  76           HZ       PHE  76  -9.344   0.123  10.030
  604    H    VAL  77           H        VAL  77  -5.494   0.586   2.563
  605    HA   VAL  77           HA       VAL  77  -6.689  -1.572   1.041
  606    HB   VAL  77           HB       VAL  77  -4.660   0.517   0.195
  607   1HG1  VAL  77          1HG1      VAL  77  -6.077  -1.668  -1.196
  608   2HG1  VAL  77          2HG1      VAL  77  -6.213  -0.097  -1.985
  609   3HG1  VAL  77          3HG1      VAL  77  -4.623  -0.792  -1.670
  610   1HG2  VAL  77          1HG2      VAL  77  -7.104   1.060   1.180
  611   2HG2  VAL  77          2HG2      VAL  77  -6.409   1.976  -0.157
  612   3HG2  VAL  77          3HG2      VAL  77  -7.561   0.680  -0.481
  613    H    SER  78           H        SER  78  -3.496  -1.020   2.387
  614    HA   SER  78           HA       SER  78  -2.198  -3.032   0.720
  615   1HB   SER  78          1HB       SER  78  -1.180  -2.018   3.375
  616   2HB   SER  78          2HB       SER  78  -0.247  -2.602   1.998
  617    HG   SER  78           HG       SER  78  -0.644  -0.756   0.933
  618    H    MET  79           H        MET  79  -3.398  -2.960   4.090
  619    HA   MET  79           HA       MET  79  -2.544  -5.542   4.846
  620   1HB   MET  79          1HB       MET  79  -5.160  -4.274   5.690
  621   2HB   MET  79          2HB       MET  79  -4.160  -5.396   6.606
  622   1HG   MET  79          1HG       MET  79  -2.616  -3.080   5.804
  623   2HG   MET  79          2HG       MET  79  -4.052  -2.595   6.709
  624   1HE   MET  79          1HE       MET  79  -4.787  -3.158   8.572
  625   2HE   MET  79          2HE       MET  79  -4.264  -4.438   9.674
  626   3HE   MET  79          3HE       MET  79  -3.649  -2.798   9.868
  627    H    VAL  80           H        VAL  80  -5.598  -4.562   3.268
  628    HA   VAL  80           HA       VAL  80  -6.672  -7.232   3.218
  629    HB   VAL  80           HB       VAL  80  -8.158  -6.173   1.373
  630   1HG1  VAL  80          1HG1      VAL  80  -7.953  -5.312   4.256
  631   2HG1  VAL  80          2HG1      VAL  80  -9.237  -4.685   3.222
  632   3HG1  VAL  80          3HG1      VAL  80  -9.110  -6.419   3.516
  633   1HG2  VAL  80          1HG2      VAL  80  -6.166  -4.214   1.518
  634   2HG2  VAL  80          2HG2      VAL  80  -7.726  -4.056   0.713
  635   3HG2  VAL  80          3HG2      VAL  80  -7.536  -3.512   2.379
  636    H    THR  81           H        THR  81  -4.843  -5.330   0.807
  637    HA   THR  81           HA       THR  81  -5.076  -7.309  -1.277
  638    HB   THR  81           HB       THR  81  -2.685  -5.500  -1.027
  639    HG1  THR  81           HG1      THR  81  -5.367  -4.813  -1.241
  640   1HG2  THR  81          1HG2      THR  81  -3.449  -7.215  -2.975
  641   2HG2  THR  81          2HG2      THR  81  -4.313  -5.769  -3.498
  642   3HG2  THR  81          3HG2      THR  81  -2.561  -5.728  -3.305
  643    H    THR  82           H        THR  82  -3.455  -7.383   1.680
  644    HA   THR  82           HA       THR  82  -1.552  -9.453   0.650
  645    HB   THR  82           HB       THR  82  -0.305  -8.926   2.840
  646    HG1  THR  82           HG1      THR  82  -2.043  -7.747   3.765
  647   1HG2  THR  82          1HG2      THR  82  -0.351  -7.598   0.287
  648   2HG2  THR  82          2HG2      THR  82   0.078  -6.439   1.547
  649   3HG2  THR  82          3HG2      THR  82   1.027  -7.912   1.343
  650    H    ALA  83           H        ALA  83  -4.427  -9.100   2.246
  651    HA   ALA  83           HA       ALA  83  -4.174 -10.794   4.523
  652   1HB   ALA  83          1HB       ALA  83  -6.356  -9.706   2.887
  653   2HB   ALA  83          2HB       ALA  83  -6.724 -11.287   3.575
  654   3HB   ALA  83          3HB       ALA  83  -6.273  -9.949   4.634
  655    H    CYS  84           H        CYS  84  -5.591 -11.704   1.350
  656    HA   CYS  84           HA       CYS  84  -5.652 -14.473   1.758
  657   1HB   CYS  84          1HB       CYS  84  -6.212 -12.828  -0.357
  658   2HB   CYS  84          2HB       CYS  84  -4.780 -13.675  -0.949
  659    HG   CYS  84           HG       CYS  84  -6.707 -15.664   0.243
  660    H    HIS  85           H        HIS  85  -4.100 -16.043   1.888
  661    HA   HIS  85           HA       HIS  85  -1.321 -15.315   2.076
  662   1HB   HIS  85          1HB       HIS  85  -2.923 -17.602   2.640
  663   2HB   HIS  85          2HB       HIS  85  -1.610 -18.126   1.582
  664    HD1  HIS  85           HD1      HIS  85  -0.631 -19.355   3.765
  665    HD2  HIS  85           HD2      HIS  85  -0.645 -15.188   3.905
  666    HE1  HIS  85           HE1      HIS  85   0.915 -18.696   5.660
  667    H    GLU  86           H        GLU  86  -3.178 -17.092  -0.408
  668    HA   GLU  86           HA       GLU  86  -0.875 -17.315  -2.175
  669   1HB   GLU  86          1HB       GLU  86  -2.494 -18.165  -3.816
  670   2HB   GLU  86          2HB       GLU  86  -2.767 -18.925  -2.248
  671   1HG   GLU  86          1HG       GLU  86  -4.326 -16.614  -2.151
  672   2HG   GLU  86          2HG       GLU  86  -4.542 -17.208  -3.799
  673    H    PHE  87           H        PHE  87  -0.050 -15.313  -2.762
  674    HA   PHE  87           HA       PHE  87  -1.971 -13.460  -4.112
  675   1HB   PHE  87          1HB       PHE  87   0.031 -11.777  -3.486
  676   2HB   PHE  87          2HB       PHE  87  -1.322 -12.076  -2.397
  677    HD1  PHE  87           HD1      PHE  87   1.818 -13.933  -3.300
  678    HD2  PHE  87           HD2      PHE  87  -0.650 -12.304  -0.183
  679    HE1  PHE  87           HE1      PHE  87   3.393 -14.809  -1.599
  680    HE2  PHE  87           HE2      PHE  87   0.924 -13.178   1.520
  681    HZ   PHE  87           HZ       PHE  87   2.944 -14.433   0.814
  682    H    PHE  88           H        PHE  88   0.763 -15.438  -4.455
  683    HA   PHE  88           HA       PHE  88   1.488 -14.026  -6.995
  684   1HB   PHE  88          1HB       PHE  88   3.270 -15.865  -5.370
  685   2HB   PHE  88          2HB       PHE  88   3.738 -14.896  -6.765
  686    HD1  PHE  88           HD1      PHE  88   2.031 -12.430  -5.961
  687    HD2  PHE  88           HD2      PHE  88   4.842 -14.869  -3.814
  688    HE1  PHE  88           HE1      PHE  88   2.544 -10.522  -4.457
  689    HE2  PHE  88           HE2      PHE  88   5.351 -12.959  -2.312
  690    HZ   PHE  88           HZ       PHE  88   4.202 -10.788  -2.635
  691    H    GLU  89           H        GLU  89  -0.278 -16.532  -5.934
  692    HA   GLU  89           HA       GLU  89   0.538 -18.271  -8.232
  693   1HB   GLU  89          1HB       GLU  89   0.423 -18.948  -5.507
  694   2HB   GLU  89          2HB       GLU  89  -1.026 -19.659  -6.219
  695   1HG   GLU  89          1HG       GLU  89   0.207 -20.963  -7.741
  696   2HG   GLU  89          2HG       GLU  89   1.645 -19.955  -7.578
  697    H    HIS  90           H        HIS  90  -0.950 -17.560  -9.758
  698    HA   HIS  90           HA       HIS  90  -3.827 -17.777  -8.966
  699   1HB   HIS  90          1HB       HIS  90  -4.297 -16.129 -10.777
  700   2HB   HIS  90          2HB       HIS  90  -3.281 -15.464  -9.500
  701    HD1  HIS  90           HD1      HIS  90  -1.296 -17.724 -11.544
  702    HD2  HIS  90           HD2      HIS  90  -2.483 -13.737 -11.842
  703    HE1  HIS  90           HE1      HIS  90   0.251 -16.643 -13.224
  704    H    GLU  91           H        GLU  91  -3.335 -20.132  -9.574
  705    HA   GLU  91           HA       GLU  91  -3.126 -20.597 -12.490
  706   1HB   GLU  91          1HB       GLU  91  -2.443 -22.075 -10.141
  707   2HB   GLU  91          2HB       GLU  91  -3.637 -23.010 -11.044
  708   1HG   GLU  91          1HG       GLU  91  -1.916 -23.680 -12.351
  709   2HG   GLU  91          2HG       GLU  91  -1.949 -22.052 -13.030
  710   1H    MET   0          1H        MET   0 -10.249  -3.365 -14.024
  711   2H    MET   0          2H        MET   0  -9.637  -4.010 -15.473
  712   3H    MET   0          3H        MET   0  -8.594  -3.241 -14.374
  713    HA   MET   0           HA       MET   0  -8.905  -1.643 -16.009
  714   1HB   MET   0          1HB       MET   0 -11.415  -1.111 -16.603
  715   2HB   MET   0          2HB       MET   0 -10.605  -2.474 -17.378
  716   1HG   MET   0          1HG       MET   0 -11.539  -3.988 -15.644
  717   2HG   MET   0          2HG       MET   0 -12.393  -2.619 -14.929
  718   1HE   MET   0          1HE       MET   0 -13.862  -1.259 -15.809
  719   2HE   MET   0          2HE       MET   0 -13.847  -0.972 -17.547
  720   3HE   MET   0          3HE       MET   0 -15.227  -1.779 -16.807
  721    H    SER   1           H        SER   1  -8.806  -1.605 -13.131
  722    HA   SER   1           HA       SER   1 -10.372   0.893 -12.639
  723   1HB   SER   1          1HB       SER   1 -10.999   0.194 -10.483
  724   2HB   SER   1          2HB       SER   1 -11.197  -1.269 -11.444
  725    HG   SER   1           HG       SER   1  -9.737  -2.150 -10.235
  726    H    GLU   2           H        GLU   2  -9.367   1.958 -10.507
  727    HA   GLU   2           HA       GLU   2  -6.553   2.423 -11.150
  728   1HB   GLU   2          1HB       GLU   2  -8.276   3.528  -8.910
  729   2HB   GLU   2          2HB       GLU   2  -6.668   4.105  -9.347
  730   1HG   GLU   2          1HG       GLU   2  -9.182   4.220 -11.023
  731   2HG   GLU   2          2HG       GLU   2  -8.234   5.576 -10.409
  732    H    LEU   3           H        LEU   3  -8.222   1.480  -8.119
  733    HA   LEU   3           HA       LEU   3  -5.861   0.805  -6.696
  734   1HB   LEU   3          1HB       LEU   3  -8.561   0.859  -6.136
  735   2HB   LEU   3          2HB       LEU   3  -8.183  -0.861  -6.043
  736    HG   LEU   3           HG       LEU   3  -6.178  -0.187  -4.595
  737   1HD1  LEU   3          1HD1      LEU   3  -7.689   2.413  -4.796
  738   2HD1  LEU   3          2HD1      LEU   3  -6.734   2.041  -3.361
  739   3HD1  LEU   3          3HD1      LEU   3  -5.954   2.129  -4.940
  740   1HD2  LEU   3          1HD2      LEU   3  -8.973  -0.505  -3.977
  741   2HD2  LEU   3          2HD2      LEU   3  -7.574  -0.991  -3.019
  742   3HD2  LEU   3          3HD2      LEU   3  -8.253   0.626  -2.829
  743    H    GLU   4           H        GLU   4  -7.760  -1.094  -8.985
  744    HA   GLU   4           HA       GLU   4  -6.530  -3.614  -8.272
  745   1HB   GLU   4          1HB       GLU   4  -8.691  -3.563  -9.418
  746   2HB   GLU   4          2HB       GLU   4  -7.957  -2.767 -10.811
  747   1HG   GLU   4          1HG       GLU   4  -6.328  -4.868 -10.719
  748   2HG   GLU   4          2HG       GLU   4  -7.705  -5.606  -9.900
  749    H    LYS   5           H        LYS   5  -6.160  -1.771 -11.333
  750    HA   LYS   5           HA       LYS   5  -3.873  -3.164 -12.217
  751   1HB   LYS   5          1HB       LYS   5  -5.086  -0.510 -12.786
  752   2HB   LYS   5          2HB       LYS   5  -3.398  -0.715 -13.257
  753   1HG   LYS   5          1HG       LYS   5  -3.903  -2.209 -14.902
  754   2HG   LYS   5          2HG       LYS   5  -5.162  -2.986 -13.942
  755   1HD   LYS   5          1HD       LYS   5  -6.642  -1.925 -15.280
  756   2HD   LYS   5          2HD       LYS   5  -6.197  -0.453 -14.414
  757   1HE   LYS   5          1HE       LYS   5  -4.420  -1.329 -16.649
  758   2HE   LYS   5          2HE       LYS   5  -5.982  -0.630 -17.075
  759   1HZ   LYS   5          1HZ       LYS   5  -4.358   0.731 -15.052
  760   2HZ   LYS   5          2HZ       LYS   5  -3.891   0.870 -16.681
  761   3HZ   LYS   5          3HZ       LYS   5  -5.436   1.381 -16.191
  762    H    ALA   6           H        ALA   6  -4.110  -0.400 -10.020
  763    HA   ALA   6           HA       ALA   6  -1.209  -0.078  -9.849
  764   1HB   ALA   6          1HB       ALA   6  -3.321   1.583  -9.344
  765   2HB   ALA   6          2HB       ALA   6  -2.881   1.088  -7.709
  766   3HB   ALA   6          3HB       ALA   6  -1.683   1.859  -8.751
  767    H    MET   7           H        MET   7  -3.556  -0.686  -7.216
  768    HA   MET   7           HA       MET   7  -1.752  -1.645  -5.321
  769   1HB   MET   7          1HB       MET   7  -4.300  -1.251  -5.115
  770   2HB   MET   7          2HB       MET   7  -4.471  -2.914  -5.685
  771   1HG   MET   7          1HG       MET   7  -4.448  -2.893  -3.239
  772   2HG   MET   7          2HG       MET   7  -2.971  -3.657  -3.830
  773   1HE   MET   7          1HE       MET   7  -2.762  -3.063  -1.077
  774   2HE   MET   7          2HE       MET   7  -1.286  -3.356  -2.008
  775   3HE   MET   7          3HE       MET   7  -1.355  -2.026  -0.854
  776    H    VAL   8           H        VAL   8  -3.620  -3.637  -7.612
  777    HA   VAL   8           HA       VAL   8  -2.442  -6.123  -6.963
  778    HB   VAL   8           HB       VAL   8  -3.292  -5.284  -9.743
  779   1HG1  VAL   8          1HG1      VAL   8  -2.764  -7.841  -8.318
  780   2HG1  VAL   8          2HG1      VAL   8  -4.145  -7.814  -9.415
  781   3HG1  VAL   8          3HG1      VAL   8  -2.530  -7.435 -10.017
  782   1HG2  VAL   8          1HG2      VAL   8  -4.830  -5.047  -7.448
  783   2HG2  VAL   8          2HG2      VAL   8  -5.462  -5.228  -9.086
  784   3HG2  VAL   8          3HG2      VAL   8  -5.267  -6.645  -8.055
  785    H    ALA   9           H        ALA   9  -1.259  -3.528  -9.067
  786    HA   ALA   9           HA       ALA   9   0.850  -4.991 -10.325
  787   1HB   ALA   9          1HB       ALA   9   0.061  -2.211 -10.034
  788   2HB   ALA   9          2HB       ALA   9   1.811  -2.381  -9.897
  789   3HB   ALA   9          3HB       ALA   9   0.978  -2.976 -11.334
  790    H    LEU  10           H        LEU  10   0.625  -3.401  -7.171
  791    HA   LEU  10           HA       LEU  10   3.371  -3.536  -6.446
  792   1HB   LEU  10          1HB       LEU  10   0.888  -2.953  -5.150
  793   2HB   LEU  10          2HB       LEU  10   1.761  -4.118  -4.153
  794    HG   LEU  10           HG       LEU  10   3.127  -1.678  -5.290
  795   1HD1  LEU  10          1HD1      LEU  10   1.249  -1.913  -2.993
  796   2HD1  LEU  10          2HD1      LEU  10   2.733  -1.005  -2.703
  797   3HD1  LEU  10          3HD1      LEU  10   1.634  -0.512  -3.992
  798   1HD2  LEU  10          1HD2      LEU  10   3.880  -3.958  -3.701
  799   2HD2  LEU  10          2HD2      LEU  10   4.901  -2.648  -4.295
  800   3HD2  LEU  10          3HD2      LEU  10   4.081  -2.492  -2.740
  801    H    ILE  11           H        ILE  11   0.732  -5.884  -5.878
  802    HA   ILE  11           HA       ILE  11   2.199  -7.901  -4.595
  803    HB   ILE  11           HB       ILE  11   0.006  -8.172  -6.679
  804   1HG1  ILE  11          1HG1      ILE  11   0.017  -8.085  -3.646
  805   2HG1  ILE  11          2HG1      ILE  11  -0.741  -6.928  -4.741
  806   1HG2  ILE  11          1HG2      ILE  11   1.559 -10.219  -6.120
  807   2HG2  ILE  11          2HG2      ILE  11   0.660 -10.243  -4.603
  808   3HG2  ILE  11          3HG2      ILE  11  -0.191 -10.435  -6.136
  809   1HD1  ILE  11          1HD1      ILE  11  -1.499  -9.857  -4.635
  810   2HD1  ILE  11          2HD1      ILE  11  -2.340  -8.602  -3.723
  811   3HD1  ILE  11          3HD1      ILE  11  -2.344  -8.565  -5.487
  812    H    ASP  12           H        ASP  12   2.265  -6.856  -7.918
  813    HA   ASP  12           HA       ASP  12   3.621  -9.175  -8.997
  814   1HB   ASP  12          1HB       ASP  12   2.322  -7.236 -10.202
  815   2HB   ASP  12          2HB       ASP  12   3.879  -6.416 -10.164
  816    H    VAL  13           H        VAL  13   4.715  -5.969  -7.886
  817    HA   VAL  13           HA       VAL  13   7.441  -6.159  -8.485
  818    HB   VAL  13           HB       VAL  13   6.003  -4.900  -6.141
  819   1HG1  VAL  13          1HG1      VAL  13   8.847  -5.477  -6.415
  820   2HG1  VAL  13          2HG1      VAL  13   8.541  -3.741  -6.317
  821   3HG1  VAL  13          3HG1      VAL  13   7.970  -4.811  -5.035
  822   1HG2  VAL  13          1HG2      VAL  13   6.355  -4.180  -8.804
  823   2HG2  VAL  13          2HG2      VAL  13   5.893  -3.090  -7.494
  824   3HG2  VAL  13          3HG2      VAL  13   7.589  -3.247  -7.957
  825    H    PHE  14           H        PHE  14   5.775  -7.432  -5.586
  826    HA   PHE  14           HA       PHE  14   8.114  -8.490  -4.344
  827   1HB   PHE  14          1HB       PHE  14   5.410  -8.415  -3.721
  828   2HB   PHE  14          2HB       PHE  14   5.728 -10.136  -3.948
  829    HD1  PHE  14           HD1      PHE  14   7.990  -7.425  -2.719
  830    HD2  PHE  14           HD2      PHE  14   5.879 -11.045  -1.782
  831    HE1  PHE  14           HE1      PHE  14   9.124  -7.514  -0.515
  832    HE2  PHE  14           HE2      PHE  14   7.013 -11.135   0.423
  833    HZ   PHE  14           HZ       PHE  14   8.637  -9.370   1.055
  834    H    HIS  15           H        HIS  15   5.870  -9.921  -6.704
  835    HA   HIS  15           HA       HIS  15   7.162 -12.505  -6.722
  836   1HB   HIS  15          1HB       HIS  15   4.826 -12.036  -7.556
  837   2HB   HIS  15          2HB       HIS  15   5.549 -11.233  -8.951
  838    HD1  HIS  15           HD1      HIS  15   6.895 -14.387  -7.352
  839    HD2  HIS  15           HD2      HIS  15   4.989 -13.210 -10.868
  840    HE1  HIS  15           HE1      HIS  15   6.951 -16.390  -8.903
  841    H    GLN  16           H        GLN  16   7.935  -9.444  -8.095
  842    HA   GLN  16           HA       GLN  16   9.742 -10.642 -10.120
  843   1HB   GLN  16          1HB       GLN  16   8.461  -8.739 -10.881
  844   2HB   GLN  16          2HB       GLN  16   8.962  -7.782  -9.487
  845   1HG   GLN  16          1HG       GLN  16  11.185  -7.596 -10.261
  846   2HG   GLN  16          2HG       GLN  16  10.994  -8.933 -11.398
  847   1HE2  GLN  16          1HE2      GLN  16  10.077  -5.185 -12.577
  848   2HE2  GLN  16          2HE2      GLN  16  10.785  -5.509 -11.069
  849    H    TYR  17           H        TYR  17  10.280  -7.810  -8.033
  850    HA   TYR  17           HA       TYR  17  13.021  -7.980  -7.772
  851   1HB   TYR  17          1HB       TYR  17  10.847  -6.955  -6.029
  852   2HB   TYR  17          2HB       TYR  17  12.404  -7.214  -5.241
  853    HD1  TYR  17           HD1      TYR  17  10.681  -5.436  -8.003
  854    HD2  TYR  17           HD2      TYR  17  14.310  -5.839  -5.740
  855    HE1  TYR  17           HE1      TYR  17  11.547  -3.348  -9.021
  856    HE2  TYR  17           HE2      TYR  17  15.176  -3.750  -6.758
  857    HH   TYR  17           HH       TYR  17  14.478  -2.495  -9.251
  858    H    SER  18           H        SER  18  10.685  -9.598  -5.583
  859    HA   SER  18           HA       SER  18  12.748 -11.040  -4.161
  860   1HB   SER  18          1HB       SER  18  10.168 -10.537  -3.606
  861   2HB   SER  18          2HB       SER  18   9.983 -12.144  -4.302
  862    HG   SER  18           HG       SER  18  11.572 -12.865  -2.812
  863    H    GLY  19           H        GLY  19  10.824 -11.688  -7.033
  864   1HA   GLY  19          1HA       GLY  19  11.444 -14.508  -7.190
  865   2HA   GLY  19          2HA       GLY  19  10.837 -13.517  -8.517
  866    H    ARG  20           H        ARG  20  13.423 -11.835  -7.458
  867    HA   ARG  20           HA       ARG  20  15.062 -12.449  -9.708
  868   1HB   ARG  20          1HB       ARG  20  15.628 -11.048  -7.088
  869   2HB   ARG  20          2HB       ARG  20  16.848 -11.210  -8.354
  870   1HG   ARG  20          1HG       ARG  20  14.806 -10.285  -9.849
  871   2HG   ARG  20          2HG       ARG  20  14.377  -9.550  -8.301
  872   1HD   ARG  20          1HD       ARG  20  16.402  -8.349  -8.172
  873   2HD   ARG  20          2HD       ARG  20  17.191  -9.374  -9.371
  874    HE   ARG  20           HE       ARG  20  14.962  -7.529 -10.131
  875   1HH1  ARG  20          1HH1      ARG  20  17.345  -9.592 -11.263
  876   2HH1  ARG  20          2HH1      ARG  20  18.005  -8.489 -12.424
  877   1HH2  ARG  20          1HH2      ARG  20  16.133  -5.787 -11.313
  878   2HH2  ARG  20          2HH2      ARG  20  17.319  -6.335 -12.452
  879    H    GLU  21           H        GLU  21  15.940 -13.016  -6.294
  880    HA   GLU  21           HA       GLU  21  17.846 -15.080  -7.090
  881   1HB   GLU  21          1HB       GLU  21  16.982 -13.835  -4.496
  882   2HB   GLU  21          2HB       GLU  21  17.913 -15.331  -4.478
  883   1HG   GLU  21          1HG       GLU  21  18.888 -13.142  -6.251
  884   2HG   GLU  21          2HG       GLU  21  19.107 -12.933  -4.512
  885    H    GLY  22           H        GLY  22  17.619 -17.052  -5.233
  886   1HA   GLY  22          1HA       GLY  22  15.640 -18.769  -6.300
  887   2HA   GLY  22          2HA       GLY  22  16.477 -19.047  -4.775
  888    H    ASP  23           H        ASP  23  15.640 -17.238  -3.068
  889    HA   ASP  23           HA       ASP  23  13.148 -17.978  -2.155
  890   1HB   ASP  23          1HB       ASP  23  13.148 -16.010  -0.801
  891   2HB   ASP  23          2HB       ASP  23  14.841 -16.439  -1.025
  892    H    LYS  24           H        LYS  24  11.011 -17.228  -2.431
  893    HA   LYS  24           HA       LYS  24  10.534 -15.244  -4.594
  894   1HB   LYS  24          1HB       LYS  24  10.201 -18.040  -4.927
  895   2HB   LYS  24          2HB       LYS  24   8.580 -17.359  -4.773
  896   1HG   LYS  24          1HG       LYS  24   8.709 -16.588  -6.882
  897   2HG   LYS  24          2HG       LYS  24  10.103 -15.604  -6.431
  898   1HD   LYS  24          1HD       LYS  24  11.602 -17.091  -7.306
  899   2HD   LYS  24          2HD       LYS  24  10.647 -18.494  -6.826
  900   1HE   LYS  24          1HE       LYS  24   9.154 -17.040  -8.782
  901   2HE   LYS  24          2HE       LYS  24  10.790 -17.261  -9.400
  902   1HZ   LYS  24          1HZ       LYS  24  10.608 -19.629  -8.875
  903   2HZ   LYS  24          2HZ       LYS  24   9.007 -19.393  -8.356
  904   3HZ   LYS  24          3HZ       LYS  24   9.422 -19.140  -9.984
  905    H    HIS  25           H        HIS  25  10.228 -15.528  -1.543
  906    HA   HIS  25           HA       HIS  25   7.559 -14.282  -1.440
  907   1HB   HIS  25          1HB       HIS  25   8.053 -16.527   0.493
  908   2HB   HIS  25          2HB       HIS  25   6.522 -15.828  -0.034
  909    HD1  HIS  25           HD1      HIS  25   5.735 -16.440  -2.505
  910    HD2  HIS  25           HD2      HIS  25   8.960 -18.668  -1.084
  911    HE1  HIS  25           HE1      HIS  25   5.972 -18.430  -4.057
  912    H    LYS  26           H        LYS  26  10.581 -13.863  -0.783
  913    HA   LYS  26           HA       LYS  26  10.037 -12.388   1.718
  914   1HB   LYS  26          1HB       LYS  26  12.401 -13.395   2.480
  915   2HB   LYS  26          2HB       LYS  26  10.878 -14.185   2.889
  916   1HG   LYS  26          1HG       LYS  26  11.967 -14.909   0.239
  917   2HG   LYS  26          2HG       LYS  26  12.951 -15.429   1.607
  918   1HD   LYS  26          1HD       LYS  26  10.012 -15.862   1.824
  919   2HD   LYS  26          2HD       LYS  26  10.890 -16.891   0.689
  920   1HE   LYS  26          1HE       LYS  26  11.808 -18.086   2.365
  921   2HE   LYS  26          2HE       LYS  26  12.335 -16.624   3.198
  922   1HZ   LYS  26          1HZ       LYS  26   9.501 -17.426   3.249
  923   2HZ   LYS  26          2HZ       LYS  26  10.610 -18.139   4.320
  924   3HZ   LYS  26          3HZ       LYS  26  10.356 -16.458   4.349
  925    H    LEU  27           H        LEU  27  11.053 -10.441   1.631
  926    HA   LEU  27           HA       LEU  27  13.036 -10.033  -0.549
  927   1HB   LEU  27          1HB       LEU  27  10.852  -8.545   0.165
  928   2HB   LEU  27          2HB       LEU  27  12.134  -7.705   1.038
  929    HG   LEU  27           HG       LEU  27  13.455  -7.705  -1.136
  930   1HD1  LEU  27          1HD1      LEU  27  10.998  -9.109  -1.959
  931   2HD1  LEU  27          2HD1      LEU  27  11.478  -7.803  -3.043
  932   3HD1  LEU  27          3HD1      LEU  27  12.601  -9.119  -2.695
  933   1HD2  LEU  27          1HD2      LEU  27  11.181  -6.097  -0.320
  934   2HD2  LEU  27          2HD2      LEU  27  12.689  -5.582  -1.080
  935   3HD2  LEU  27          3HD2      LEU  27  11.334  -6.108  -2.078
  936    H    LYS  28           H        LYS  28  14.409  -7.846   0.445
  937    HA   LYS  28           HA       LYS  28  15.659  -8.848   2.966
  938   1HB   LYS  28          1HB       LYS  28  16.821  -8.825   0.368
  939   2HB   LYS  28          2HB       LYS  28  17.612  -7.555   1.304
  940   1HG   LYS  28          1HG       LYS  28  17.862  -9.287   3.171
  941   2HG   LYS  28          2HG       LYS  28  17.398 -10.494   1.972
  942   1HD   LYS  28          1HD       LYS  28  19.704  -8.556   1.650
  943   2HD   LYS  28          2HD       LYS  28  19.873 -10.238   2.153
  944   1HE   LYS  28          1HE       LYS  28  18.537 -10.780  -0.016
  945   2HE   LYS  28          2HE       LYS  28  18.993  -9.151  -0.514
  946   1HZ   LYS  28          1HZ       LYS  28  21.339  -9.851   0.115
  947   2HZ   LYS  28          2HZ       LYS  28  20.753 -11.442   0.108
  948   3HZ   LYS  28          3HZ       LYS  28  20.688 -10.511  -1.312
  949    H    LYS  29           H        LYS  29  16.001  -7.228   4.445
  950    HA   LYS  29           HA       LYS  29  14.773  -4.778   4.391
  951   1HB   LYS  29          1HB       LYS  29  16.986  -4.029   5.785
  952   2HB   LYS  29          2HB       LYS  29  15.676  -4.981   6.471
  953   1HG   LYS  29          1HG       LYS  29  17.769  -6.065   7.013
  954   2HG   LYS  29          2HG       LYS  29  16.945  -7.063   5.827
  955   1HD   LYS  29          1HD       LYS  29  18.550  -5.128   4.445
  956   2HD   LYS  29          2HD       LYS  29  19.542  -5.930   5.651
  957   1HE   LYS  29          1HE       LYS  29  17.745  -7.601   3.941
  958   2HE   LYS  29          2HE       LYS  29  19.260  -7.007   3.261
  959   1HZ   LYS  29          1HZ       LYS  29  19.254  -8.264   5.919
  960   2HZ   LYS  29          2HZ       LYS  29  19.208  -9.247   4.535
  961   3HZ   LYS  29          3HZ       LYS  29  20.505  -8.174   4.773
  962    H    SER  30           H        SER  30  17.795  -5.552   2.764
  963    HA   SER  30           HA       SER  30  18.372  -2.746   2.157
  964   1HB   SER  30          1HB       SER  30  20.081  -4.666   2.333
  965   2HB   SER  30          2HB       SER  30  19.534  -5.145   0.728
  966    HG   SER  30           HG       SER  30  21.346  -3.681   0.739
  967    H    GLU  31           H        GLU  31  16.976  -5.507   0.379
  968    HA   GLU  31           HA       GLU  31  16.683  -4.010  -2.086
  969   1HB   GLU  31          1HB       GLU  31  16.685  -6.601  -1.722
  970   2HB   GLU  31          2HB       GLU  31  14.976  -6.381  -1.344
  971   1HG   GLU  31          1HG       GLU  31  14.844  -6.717  -3.634
  972   2HG   GLU  31          2HG       GLU  31  15.007  -4.961  -3.585
  973    H    LEU  32           H        LEU  32  14.996  -4.109   0.900
  974    HA   LEU  32           HA       LEU  32  12.428  -3.211  -0.196
  975   1HB   LEU  32          1HB       LEU  32  12.437  -4.502   1.893
  976   2HB   LEU  32          2HB       LEU  32  13.486  -3.304   2.651
  977    HG   LEU  32           HG       LEU  32  11.773  -1.608   2.516
  978   1HD1  LEU  32          1HD1      LEU  32  10.587  -3.554   0.604
  979   2HD1  LEU  32          2HD1      LEU  32   9.450  -2.660   1.616
  980   3HD1  LEU  32          3HD1      LEU  32  10.573  -1.791   0.571
  981   1HD2  LEU  32          1HD2      LEU  32  10.769  -4.295   3.487
  982   2HD2  LEU  32          2HD2      LEU  32  11.482  -2.997   4.445
  983   3HD2  LEU  32          3HD2      LEU  32   9.873  -2.798   3.750
  984    H    LYS  33           H        LYS  33  14.978  -1.794   1.869
  985    HA   LYS  33           HA       LYS  33  14.069   0.891   1.801
  986   1HB   LYS  33          1HB       LYS  33  16.097  -0.279   3.051
  987   2HB   LYS  33          2HB       LYS  33  17.005   0.271   1.643
  988   1HG   LYS  33          1HG       LYS  33  15.979   2.577   2.058
  989   2HG   LYS  33          2HG       LYS  33  15.448   1.952   3.620
  990   1HD   LYS  33          1HD       LYS  33  17.738   1.468   4.267
  991   2HD   LYS  33          2HD       LYS  33  18.324   1.912   2.662
  992   1HE   LYS  33          1HE       LYS  33  18.073   4.168   3.042
  993   2HE   LYS  33          2HE       LYS  33  16.703   3.941   4.129
  994   1HZ   LYS  33          1HZ       LYS  33  18.261   3.048   5.787
  995   2HZ   LYS  33          2HZ       LYS  33  19.557   3.399   4.745
  996   3HZ   LYS  33          3HZ       LYS  33  18.606   4.658   5.377
  997    H    GLU  34           H        GLU  34  15.967  -1.019  -0.441
  998    HA   GLU  34           HA       GLU  34  16.562   1.157  -2.266
  999   1HB   GLU  34          1HB       GLU  34  16.947  -1.779  -2.158
 1000   2HB   GLU  34          2HB       GLU  34  16.788  -1.110  -3.780
 1001   1HG   GLU  34          1HG       GLU  34  18.489   0.610  -2.234
 1002   2HG   GLU  34          2HG       GLU  34  19.070  -1.049  -2.086
 1003    H    LEU  35           H        LEU  35  14.061  -1.298  -1.966
 1004    HA   LEU  35           HA       LEU  35  12.778  -1.011  -4.481
 1005   1HB   LEU  35          1HB       LEU  35  12.324  -2.483  -2.205
 1006   2HB   LEU  35          2HB       LEU  35  10.985  -1.332  -2.157
 1007    HG   LEU  35           HG       LEU  35  10.247  -3.254  -3.420
 1008   1HD1  LEU  35          1HD1      LEU  35   9.698  -0.936  -4.274
 1009   2HD1  LEU  35          2HD1      LEU  35  11.025  -1.118  -5.424
 1010   3HD1  LEU  35          3HD1      LEU  35   9.636  -2.202  -5.502
 1011   1HD2  LEU  35          1HD2      LEU  35  12.993  -3.224  -4.326
 1012   2HD2  LEU  35          2HD2      LEU  35  11.793  -4.507  -4.480
 1013   3HD2  LEU  35          3HD2      LEU  35  11.905  -3.251  -5.713
 1014    H    ILE  36           H        ILE  36  12.463   0.868  -1.485
 1015    HA   ILE  36           HA       ILE  36  10.351   2.563  -2.588
 1016    HB   ILE  36           HB       ILE  36  11.929   3.418  -0.203
 1017   1HG1  ILE  36          1HG1      ILE  36  10.270   0.893  -0.382
 1018   2HG1  ILE  36          2HG1      ILE  36  11.892   1.086   0.282
 1019   1HG2  ILE  36          1HG2      ILE  36   9.814   4.513  -1.157
 1020   2HG2  ILE  36          2HG2      ILE  36   8.945   3.096  -0.566
 1021   3HG2  ILE  36          3HG2      ILE  36   9.797   4.145   0.568
 1022   1HD1  ILE  36          1HD1      ILE  36  10.758   2.724   1.964
 1023   2HD1  ILE  36          2HD1      ILE  36   9.259   1.935   1.471
 1024   3HD1  ILE  36          3HD1      ILE  36  10.553   0.990   2.210
 1025    H    ASN  37           H        ASN  37  13.756   3.148  -1.632
 1026    HA   ASN  37           HA       ASN  37  13.758   5.807  -2.783
 1027   1HB   ASN  37          1HB       ASN  37  15.233   5.060  -0.888
 1028   2HB   ASN  37          2HB       ASN  37  16.144   4.092  -2.049
 1029   1HD2  ASN  37          1HD2      ASN  37  16.840   8.063  -1.799
 1030   2HD2  ASN  37          2HD2      ASN  37  15.792   7.265  -0.729
 1031    H    ASN  38           H        ASN  38  13.762   2.846  -4.309
 1032    HA   ASN  38           HA       ASN  38  15.471   3.880  -6.536
 1033   1HB   ASN  38          1HB       ASN  38  15.969   1.597  -5.402
 1034   2HB   ASN  38          2HB       ASN  38  14.558   1.018  -6.289
 1035   1HD2  ASN  38          1HD2      ASN  38  16.304   0.792  -9.340
 1036   2HD2  ASN  38          2HD2      ASN  38  14.899   0.432  -8.458
 1037    H    GLU  39           H        GLU  39  12.626   1.716  -6.207
 1038    HA   GLU  39           HA       GLU  39  11.642   2.302  -8.831
 1039   1HB   GLU  39          1HB       GLU  39  10.608   0.946  -6.402
 1040   2HB   GLU  39          2HB       GLU  39   9.392   1.558  -7.523
 1041   1HG   GLU  39          1HG       GLU  39  10.200  -0.827  -7.958
 1042   2HG   GLU  39          2HG       GLU  39  10.268   0.274  -9.335
 1043    H    LEU  40           H        LEU  40  10.405   3.438  -5.649
 1044    HA   LEU  40           HA       LEU  40   8.728   5.440  -6.912
 1045   1HB   LEU  40          1HB       LEU  40   9.435   4.678  -4.109
 1046   2HB   LEU  40          2HB       LEU  40   8.790   6.297  -4.380
 1047    HG   LEU  40           HG       LEU  40   7.442   3.865  -5.550
 1048   1HD1  LEU  40          1HD1      LEU  40   7.727   4.437  -2.773
 1049   2HD1  LEU  40          2HD1      LEU  40   6.072   4.849  -3.224
 1050   3HD1  LEU  40          3HD1      LEU  40   6.690   3.225  -3.526
 1051   1HD2  LEU  40          1HD2      LEU  40   6.886   6.766  -5.209
 1052   2HD2  LEU  40          2HD2      LEU  40   6.403   5.674  -6.508
 1053   3HD2  LEU  40          3HD2      LEU  40   5.514   5.681  -4.983
 1054    H    SER  41           H        SER  41  10.616   6.666  -4.278
 1055    HA   SER  41           HA       SER  41  11.856   8.679  -4.230
 1056   1HB   SER  41          1HB       SER  41  13.481   6.784  -4.731
 1057   2HB   SER  41          2HB       SER  41  13.391   7.264  -6.424
 1058    HG   SER  41           HG       SER  41  14.959   8.548  -5.784
 1059    H    HIS  42           H        HIS  42  10.317  10.172  -5.134
 1060    HA   HIS  42           HA       HIS  42  11.194  11.387  -7.618
 1061   1HB   HIS  42          1HB       HIS  42   9.446   9.289  -7.987
 1062   2HB   HIS  42          2HB       HIS  42   8.357  10.674  -7.925
 1063    HD1  HIS  42           HD1      HIS  42   8.047  10.124 -10.570
 1064    HD2  HIS  42           HD2      HIS  42  11.772  11.605  -9.429
 1065    HE1  HIS  42           HE1      HIS  42   9.179  10.928 -12.691
 1066    H    PHE  43           H        PHE  43   8.154  11.104  -5.723
 1067    HA   PHE  43           HA       PHE  43   7.874  14.038  -5.800
 1068   1HB   PHE  43          1HB       PHE  43   5.736  13.585  -4.570
 1069   2HB   PHE  43          2HB       PHE  43   5.851  12.731  -6.109
 1070    HD1  PHE  43           HD1      PHE  43   6.163  12.364  -2.426
 1071    HD2  PHE  43           HD2      PHE  43   5.960  10.338  -6.212
 1072    HE1  PHE  43           HE1      PHE  43   5.872  10.200  -1.253
 1073    HE2  PHE  43           HE2      PHE  43   5.667   8.174  -5.039
 1074    HZ   PHE  43           HZ       PHE  43   5.624   8.105  -2.559
 1075    H    LEU  44           H        LEU  44  10.045  12.599  -4.217
 1076    HA   LEU  44           HA       LEU  44   9.309  13.237  -1.430
 1077   1HB   LEU  44          1HB       LEU  44  11.289  11.593  -2.735
 1078   2HB   LEU  44          2HB       LEU  44  12.093  12.720  -1.640
 1079    HG   LEU  44           HG       LEU  44  10.421  12.043   0.137
 1080   1HD1  LEU  44          1HD1      LEU  44   9.284  10.697  -2.115
 1081   2HD1  LEU  44          2HD1      LEU  44   9.788   9.474  -0.949
 1082   3HD1  LEU  44          3HD1      LEU  44   8.677  10.755  -0.460
 1083   1HD2  LEU  44          1HD2      LEU  44  12.359  10.069  -1.087
 1084   2HD2  LEU  44          2HD2      LEU  44  12.586  11.089   0.336
 1085   3HD2  LEU  44          3HD2      LEU  44  11.494   9.706   0.407
 1086    H    GLU  45           H        GLU  45   9.662  15.236  -0.573
 1087    HA   GLU  45           HA       GLU  45  11.763  16.940  -1.839
 1088   1HB   GLU  45          1HB       GLU  45   8.971  17.765  -0.994
 1089   2HB   GLU  45          2HB       GLU  45  10.246  18.901  -1.438
 1090   1HG   GLU  45          1HG       GLU  45  10.240  17.027  -3.515
 1091   2HG   GLU  45          2HG       GLU  45   8.533  17.297  -3.162
 1092    H    GLU  46           H        GLU  46   9.537  17.554   0.861
 1093    HA   GLU  46           HA       GLU  46  11.938  17.959   2.590
 1094   1HB   GLU  46          1HB       GLU  46  10.381  19.292   4.028
 1095   2HB   GLU  46          2HB       GLU  46  10.534  19.940   2.395
 1096   1HG   GLU  46          1HG       GLU  46   8.425  19.081   1.734
 1097   2HG   GLU  46          2HG       GLU  46   8.342  17.997   3.122
 1098    H    ILE  47           H        ILE  47   9.060  16.045   2.195
 1099    HA   ILE  47           HA       ILE  47   8.258  14.219   3.434
 1100    HB   ILE  47           HB       ILE  47  10.880  14.291   4.937
 1101   1HG1  ILE  47          1HG1      ILE  47  10.406  12.961   2.253
 1102   2HG1  ILE  47          2HG1      ILE  47  11.201  14.527   2.424
 1103   1HG2  ILE  47          1HG2      ILE  47   8.689  12.352   4.427
 1104   2HG2  ILE  47          2HG2      ILE  47  10.328  11.698   4.388
 1105   3HG2  ILE  47          3HG2      ILE  47   9.740  12.521   5.835
 1106   1HD1  ILE  47          1HD1      ILE  47  12.680  13.216   4.191
 1107   2HD1  ILE  47          2HD1      ILE  47  12.161  11.813   3.255
 1108   3HD1  ILE  47          3HD1      ILE  47  13.047  13.119   2.468
 1109    H    LYS  48           H        LYS  48   6.676  15.525   4.533
 1110    HA   LYS  48           HA       LYS  48   7.329  17.009   6.930
 1111   1HB   LYS  48          1HB       LYS  48   5.165  16.936   5.245
 1112   2HB   LYS  48          2HB       LYS  48   4.546  16.081   6.659
 1113   1HG   LYS  48          1HG       LYS  48   5.012  17.922   8.105
 1114   2HG   LYS  48          2HG       LYS  48   6.004  18.719   6.885
 1115   1HD   LYS  48          1HD       LYS  48   4.042  19.095   5.479
 1116   2HD   LYS  48          2HD       LYS  48   3.027  18.210   6.617
 1117   1HE   LYS  48          1HE       LYS  48   3.636  19.887   8.382
 1118   2HE   LYS  48          2HE       LYS  48   4.493  20.809   7.147
 1119   1HZ   LYS  48          1HZ       LYS  48   2.168  20.486   5.938
 1120   2HZ   LYS  48          2HZ       LYS  48   1.632  20.452   7.551
 1121   3HZ   LYS  48          3HZ       LYS  48   2.488  21.798   6.966
 1122    H    GLU  49           H        GLU  49   6.225  13.702   6.304
 1123    HA   GLU  49           HA       GLU  49   5.837  13.203   9.179
 1124   1HB   GLU  49          1HB       GLU  49   5.447  11.630   6.658
 1125   2HB   GLU  49          2HB       GLU  49   5.682  10.748   8.164
 1126   1HG   GLU  49          1HG       GLU  49   3.694  13.009   7.987
 1127   2HG   GLU  49          2HG       GLU  49   3.254  11.365   7.518
 1128    H    GLN  50           H        GLN  50   8.301  14.021   9.200
 1129    HA   GLN  50           HA       GLN  50  10.407  12.325   8.405
 1130   1HB   GLN  50          1HB       GLN  50  10.590  14.638   9.469
 1131   2HB   GLN  50          2HB       GLN  50  10.352  13.846  11.026
 1132   1HG   GLN  50          1HG       GLN  50  12.327  12.467  10.682
 1133   2HG   GLN  50          2HG       GLN  50  12.532  13.108   9.050
 1134   1HE2  GLN  50          1HE2      GLN  50  14.256  15.066  12.051
 1135   2HE2  GLN  50          2HE2      GLN  50  13.740  13.451  12.128
 1136    H    GLU  51           H        GLU  51   8.013  11.895  10.873
 1137    HA   GLU  51           HA       GLU  51   9.535   9.889  12.363
 1138   1HB   GLU  51          1HB       GLU  51   6.996  11.283  12.641
 1139   2HB   GLU  51          2HB       GLU  51   6.813   9.555  12.946
 1140   1HG   GLU  51          1HG       GLU  51   8.912   9.773  14.425
 1141   2HG   GLU  51          2HG       GLU  51   8.639  11.514  14.341
 1142    H    VAL  52           H        VAL  52   7.063   9.902   9.825
 1143    HA   VAL  52           HA       VAL  52   6.590   7.058   9.869
 1144    HB   VAL  52           HB       VAL  52   6.250   9.050   7.603
 1145   1HG1  VAL  52          1HG1      VAL  52   5.350   6.202   8.020
 1146   2HG1  VAL  52          2HG1      VAL  52   4.466   7.292   6.953
 1147   3HG1  VAL  52          3HG1      VAL  52   6.154   6.904   6.616
 1148   1HG2  VAL  52          1HG2      VAL  52   5.008   9.198   9.978
 1149   2HG2  VAL  52          2HG2      VAL  52   4.181   9.573   8.467
 1150   3HG2  VAL  52          3HG2      VAL  52   3.979   7.988   9.214
 1151    H    VAL  53           H        VAL  53   8.597   9.111   7.731
 1152    HA   VAL  53           HA       VAL  53   9.765   6.815   6.400
 1153    HB   VAL  53           HB       VAL  53  10.815   9.659   6.530
 1154   1HG1  VAL  53          1HG1      VAL  53  11.553   7.195   5.054
 1155   2HG1  VAL  53          2HG1      VAL  53  11.463   8.662   4.079
 1156   3HG1  VAL  53          3HG1      VAL  53  12.540   8.595   5.474
 1157   1HG2  VAL  53          1HG2      VAL  53   8.383   8.695   5.451
 1158   2HG2  VAL  53          2HG2      VAL  53   9.119  10.274   5.178
 1159   3HG2  VAL  53          3HG2      VAL  53   9.464   8.937   4.079
 1160    H    ASP  54           H        ASP  54  10.611   8.739   9.223
 1161    HA   ASP  54           HA       ASP  54  13.288   7.572   9.416
 1162   1HB   ASP  54          1HB       ASP  54  12.707   9.839  10.348
 1163   2HB   ASP  54          2HB       ASP  54  11.708   9.034  11.557
 1164    H    LYS  55           H        LYS  55  10.082   6.683  10.304
 1165    HA   LYS  55           HA       LYS  55  10.896   4.887  12.469
 1166   1HB   LYS  55          1HB       LYS  55   8.660   5.878  12.525
 1167   2HB   LYS  55          2HB       LYS  55   8.280   5.163  10.958
 1168   1HG   LYS  55          1HG       LYS  55   9.238   3.259  13.010
 1169   2HG   LYS  55          2HG       LYS  55   7.665   3.989  13.335
 1170   1HD   LYS  55          1HD       LYS  55   6.807   3.250  11.198
 1171   2HD   LYS  55          2HD       LYS  55   8.404   2.686  10.700
 1172   1HE   LYS  55          1HE       LYS  55   7.917   0.678  11.591
 1173   2HE   LYS  55          2HE       LYS  55   7.877   1.443  13.183
 1174   1HZ   LYS  55          1HZ       LYS  55   5.501   2.152  12.291
 1175   2HZ   LYS  55          2HZ       LYS  55   5.680   0.705  11.417
 1176   3HZ   LYS  55          3HZ       LYS  55   5.764   0.688  13.111
 1177    H    VAL  56           H        VAL  56   9.718   4.475   9.107
 1178    HA   VAL  56           HA       VAL  56  10.258   1.607   9.169
 1179    HB   VAL  56           HB       VAL  56   9.956   1.933   6.604
 1180   1HG1  VAL  56          1HG1      VAL  56   7.738   2.638   8.548
 1181   2HG1  VAL  56          2HG1      VAL  56   7.498   2.096   6.886
 1182   3HG1  VAL  56          3HG1      VAL  56   8.219   1.009   8.073
 1183   1HG2  VAL  56          1HG2      VAL  56  10.195   4.598   7.311
 1184   2HG2  VAL  56          2HG2      VAL  56   9.531   4.002   5.791
 1185   3HG2  VAL  56          3HG2      VAL  56   8.453   4.393   7.131
 1186    H    MET  57           H        MET  57  11.890   4.506   8.052
 1187    HA   MET  57           HA       MET  57  14.054   3.128   6.707
 1188   1HB   MET  57          1HB       MET  57  13.360   5.560   6.369
 1189   2HB   MET  57          2HB       MET  57  14.125   5.904   7.922
 1190   1HG   MET  57          1HG       MET  57  16.216   5.730   7.061
 1191   2HG   MET  57          2HG       MET  57  15.795   4.327   6.080
 1192   1HE   MET  57          1HE       MET  57  14.806   4.232   4.000
 1193   2HE   MET  57          2HE       MET  57  13.386   5.276   4.153
 1194   3HE   MET  57          3HE       MET  57  14.528   5.522   2.834
 1195    H    GLU  58           H        GLU  58  13.311   3.986  10.007
 1196    HA   GLU  58           HA       GLU  58  16.037   3.732  11.000
 1197   1HB   GLU  58          1HB       GLU  58  13.321   4.015  12.192
 1198   2HB   GLU  58          2HB       GLU  58  14.540   3.236  13.197
 1199   1HG   GLU  58          1HG       GLU  58  16.038   5.135  12.951
 1200   2HG   GLU  58          2HG       GLU  58  14.931   5.903  11.813
 1201    H    THR  59           H        THR  59  13.154   1.594  11.223
 1202    HA   THR  59           HA       THR  59  14.585  -0.646  12.281
 1203    HB   THR  59           HB       THR  59  12.191  -0.852  10.437
 1204    HG1  THR  59           HG1      THR  59  12.252  -0.231  13.205
 1205   1HG2  THR  59          1HG2      THR  59  13.670  -2.651  12.133
 1206   2HG2  THR  59          2HG2      THR  59  12.016  -2.502  12.728
 1207   3HG2  THR  59          3HG2      THR  59  12.313  -3.007  11.064
 1208    H    LEU  60           H        LEU  60  14.253   0.676   9.084
 1209    HA   LEU  60           HA       LEU  60  15.112  -1.611   7.569
 1210   1HB   LEU  60          1HB       LEU  60  14.874   1.330   7.130
 1211   2HB   LEU  60          2HB       LEU  60  15.937   0.443   6.037
 1212    HG   LEU  60           HG       LEU  60  13.082  -0.375   6.634
 1213   1HD1  LEU  60          1HD1      LEU  60  13.955   1.836   5.132
 1214   2HD1  LEU  60          2HD1      LEU  60  13.581   0.587   3.944
 1215   3HD1  LEU  60          3HD1      LEU  60  12.352   1.104   5.099
 1216   1HD2  LEU  60          1HD2      LEU  60  15.246  -1.301   4.748
 1217   2HD2  LEU  60          2HD2      LEU  60  14.245  -2.264   5.835
 1218   3HD2  LEU  60          3HD2      LEU  60  13.547  -1.578   4.367
 1219    H    ASP  61           H        ASP  61  16.894   1.276   8.675
 1220    HA   ASP  61           HA       ASP  61  19.477   0.086   8.007
 1221   1HB   ASP  61          1HB       ASP  61  18.505   2.680   8.453
 1222   2HB   ASP  61          2HB       ASP  61  19.594   2.370   9.806
 1223    H    GLU  62           H        GLU  62  17.338  -0.366  10.534
 1224    HA   GLU  62           HA       GLU  62  19.284  -0.498  12.708
 1225   1HB   GLU  62          1HB       GLU  62  16.882   0.013  13.115
 1226   2HB   GLU  62          2HB       GLU  62  16.471  -1.615  12.570
 1227   1HG   GLU  62          1HG       GLU  62  17.999  -2.516  14.360
 1228   2HG   GLU  62          2HG       GLU  62  18.165  -0.868  14.969
 1229    H    ASP  63           H        ASP  63  17.593  -2.850  10.653
 1230    HA   ASP  63           HA       ASP  63  19.196  -5.023  11.874
 1231   1HB   ASP  63          1HB       ASP  63  17.766  -6.325  10.002
 1232   2HB   ASP  63          2HB       ASP  63  17.123  -5.960  11.603
 1233    H    GLY  64           H        GLY  64  18.393  -4.018   8.539
 1234   1HA   GLY  64          1HA       GLY  64  19.646  -4.341   6.562
 1235   2HA   GLY  64          2HA       GLY  64  20.952  -3.665   7.536
 1236    H    ASP  65           H        ASP  65  19.451  -6.656   8.496
 1237    HA   ASP  65           HA       ASP  65  21.685  -8.236   7.345
 1238   1HB   ASP  65          1HB       ASP  65  22.057  -7.309   9.770
 1239   2HB   ASP  65          2HB       ASP  65  20.937  -8.589  10.226
 1240    H    GLY  66           H        GLY  66  18.374  -7.994   8.110
 1241   1HA   GLY  66          1HA       GLY  66  18.080 -10.951   7.936
 1242   2HA   GLY  66          2HA       GLY  66  16.926  -9.906   8.760
 1243    H    GLU  67           H        GLU  67  15.368 -11.022   7.282
 1244    HA   GLU  67           HA       GLU  67  15.331  -9.711   4.592
 1245   1HB   GLU  67          1HB       GLU  67  14.439 -12.475   5.442
 1246   2HB   GLU  67          2HB       GLU  67  13.928 -11.741   3.922
 1247   1HG   GLU  67          1HG       GLU  67  15.870 -12.362   2.971
 1248   2HG   GLU  67          2HG       GLU  67  16.749 -11.383   4.147
 1249    H    CYS  68           H        CYS  68  13.183  -9.118   3.815
 1250    HA   CYS  68           HA       CYS  68  11.320  -8.514   6.058
 1251   1HB   CYS  68          1HB       CYS  68  11.785  -7.346   3.323
 1252   2HB   CYS  68          2HB       CYS  68  10.252  -7.073   4.151
 1253    HG   CYS  68           HG       CYS  68  11.725  -6.079   6.185
 1254    H    ASP  69           H        ASP  69   8.933  -8.701   5.509
 1255    HA   ASP  69           HA       ASP  69   8.497 -11.240   3.999
 1256   1HB   ASP  69          1HB       ASP  69   7.620 -10.479   6.502
 1257   2HB   ASP  69          2HB       ASP  69   6.218 -10.132   5.493
 1258    H    PHE  70           H        PHE  70   5.757 -10.930   3.490
 1259    HA   PHE  70           HA       PHE  70   5.898  -8.955   1.289
 1260   1HB   PHE  70          1HB       PHE  70   4.150 -10.136   0.250
 1261   2HB   PHE  70          2HB       PHE  70   5.082 -11.407   1.035
 1262    HD1  PHE  70           HD1      PHE  70   4.327 -12.134   3.414
 1263    HD2  PHE  70           HD2      PHE  70   1.866  -9.879   0.710
 1264    HE1  PHE  70           HE1      PHE  70   2.305 -12.835   4.666
 1265    HE2  PHE  70           HE2      PHE  70  -0.155 -10.582   1.959
 1266    HZ   PHE  70           HZ       PHE  70   0.064 -12.061   3.938
 1267    H    GLN  71           H        GLN  71   4.127  -9.588   4.272
 1268    HA   GLN  71           HA       GLN  71   2.264  -7.359   3.834
 1269   1HB   GLN  71          1HB       GLN  71   2.892  -9.071   6.264
 1270   2HB   GLN  71          2HB       GLN  71   1.678  -7.791   6.261
 1271   1HG   GLN  71          1HG       GLN  71   1.168  -9.350   3.963
 1272   2HG   GLN  71          2HG       GLN  71   1.459 -10.494   5.275
 1273   1HE2  GLN  71          1HE2      GLN  71  -1.579  -7.779   5.896
 1274   2HE2  GLN  71          2HE2      GLN  71  -0.163  -7.264   5.116
 1275    H    GLU  72           H        GLU  72   5.408  -7.893   5.173
 1276    HA   GLU  72           HA       GLU  72   5.479  -5.453   6.771
 1277   1HB   GLU  72          1HB       GLU  72   7.408  -7.602   5.980
 1278   2HB   GLU  72          2HB       GLU  72   8.071  -6.061   6.521
 1279   1HG   GLU  72          1HG       GLU  72   5.914  -6.849   8.266
 1280   2HG   GLU  72          2HG       GLU  72   7.086  -8.162   8.137
 1281    H    PHE  73           H        PHE  73   7.067  -6.485   3.725
 1282    HA   PHE  73           HA       PHE  73   8.071  -3.866   3.112
 1283   1HB   PHE  73          1HB       PHE  73   9.161  -5.152   1.597
 1284   2HB   PHE  73          2HB       PHE  73   8.074  -6.497   1.911
 1285    HD1  PHE  73           HD1      PHE  73   5.805  -6.519   0.700
 1286    HD2  PHE  73           HD2      PHE  73   9.067  -3.972  -0.447
 1287    HE1  PHE  73           HE1      PHE  73   4.775  -6.210  -1.535
 1288    HE2  PHE  73           HE2      PHE  73   8.036  -3.660  -2.683
 1289    HZ   PHE  73           HZ       PHE  73   5.891  -4.780  -3.226
 1290    H    MET  74           H        MET  74   4.950  -5.295   2.921
 1291    HA   MET  74           HA       MET  74   3.896  -3.516   0.860
 1292   1HB   MET  74          1HB       MET  74   2.910  -5.722   2.533
 1293   2HB   MET  74          2HB       MET  74   1.719  -4.446   2.301
 1294   1HG   MET  74          1HG       MET  74   3.179  -5.151  -0.152
 1295   2HG   MET  74          2HG       MET  74   2.220  -6.477   0.505
 1296   1HE   MET  74          1HE       MET  74   2.696  -3.435  -1.081
 1297   2HE   MET  74          2HE       MET  74   1.510  -3.863  -2.322
 1298   3HE   MET  74          3HE       MET  74   1.199  -2.519  -1.225
 1299    H    ALA  75           H        ALA  75   3.467  -3.759   4.410
 1300    HA   ALA  75           HA       ALA  75   2.031  -1.253   4.570
 1301   1HB   ALA  75          1HB       ALA  75   1.871  -3.059   6.291
 1302   2HB   ALA  75          2HB       ALA  75   3.539  -2.723   6.757
 1303   3HB   ALA  75          3HB       ALA  75   2.292  -1.495   6.988
 1304    H    PHE  76           H        PHE  76   5.342  -2.096   4.267
 1305    HA   PHE  76           HA       PHE  76   6.396   0.330   5.516
 1306   1HB   PHE  76          1HB       PHE  76   7.473  -2.099   4.258
 1307   2HB   PHE  76          2HB       PHE  76   8.398  -0.649   3.879
 1308    HD1  PHE  76           HD1      PHE  76   6.901  -2.540   6.733
 1309    HD2  PHE  76           HD2      PHE  76   9.887   0.277   5.464
 1310    HE1  PHE  76           HE1      PHE  76   7.925  -2.607   8.992
 1311    HE2  PHE  76           HE2      PHE  76  10.908   0.210   7.725
 1312    HZ   PHE  76           HZ       PHE  76   9.928  -1.232   9.487
 1313    H    VAL  77           H        VAL  77   5.727  -0.806   2.210
 1314    HA   VAL  77           HA       VAL  77   6.852   1.526   0.910
 1315    HB   VAL  77           HB       VAL  77   4.782  -0.455  -0.087
 1316   1HG1  VAL  77          1HG1      VAL  77   6.134   1.889  -1.266
 1317   2HG1  VAL  77          2HG1      VAL  77   6.231   0.426  -2.248
 1318   3HG1  VAL  77          3HG1      VAL  77   4.657   1.069  -1.775
 1319   1HG2  VAL  77          1HG2      VAL  77   7.270  -1.102   0.705
 1320   2HG2  VAL  77          2HG2      VAL  77   6.511  -1.853  -0.700
 1321   3HG2  VAL  77          3HG2      VAL  77   7.648  -0.522  -0.916
 1322    H    SER  78           H        SER  78   3.727   0.800   2.329
 1323    HA   SER  78           HA       SER  78   2.353   2.994   0.986
 1324   1HB   SER  78          1HB       SER  78   1.459   1.661   3.542
 1325   2HB   SER  78          2HB       SER  78   0.464   2.403   2.293
 1326    HG   SER  78           HG       SER  78   0.807   0.701   0.991
 1327    H    MET  79           H        MET  79   3.710   2.519   4.260
 1328    HA   MET  79           HA       MET  79   2.898   4.986   5.369
 1329   1HB   MET  79          1HB       MET  79   5.548   3.638   5.924
 1330   2HB   MET  79          2HB       MET  79   4.594   4.636   7.017
 1331   1HG   MET  79          1HG       MET  79   3.011   2.428   6.012
 1332   2HG   MET  79          2HG       MET  79   4.488   1.844   6.780
 1333   1HE   MET  79          1HE       MET  79   5.310   2.180   8.662
 1334   2HE   MET  79          2HE       MET  79   4.841   3.315   9.937
 1335   3HE   MET  79          3HE       MET  79   4.235   1.661   9.958
 1336    H    VAL  80           H        VAL  80   5.872   4.219   3.538
 1337    HA   VAL  80           HA       VAL  80   6.945   6.880   3.766
 1338    HB   VAL  80           HB       VAL  80   8.341   6.059   1.735
 1339   1HG1  VAL  80          1HG1      VAL  80   8.272   4.855   4.497
 1340   2HG1  VAL  80          2HG1      VAL  80   9.505   4.363   3.335
 1341   3HG1  VAL  80          3HG1      VAL  80   9.392   6.048   3.844
 1342   1HG2  VAL  80          1HG2      VAL  80   6.355   4.088   1.732
 1343   2HG2  VAL  80          2HG2      VAL  80   7.875   4.036   0.840
 1344   3HG2  VAL  80          3HG2      VAL  80   7.764   3.293   2.434
 1345    H    THR  81           H        THR  81   5.001   5.276   1.228
 1346    HA   THR  81           HA       THR  81   5.137   7.493  -0.606
 1347    HB   THR  81           HB       THR  81   2.759   5.656  -0.467
 1348    HG1  THR  81           HG1      THR  81   5.427   5.013  -0.890
 1349   1HG2  THR  81          1HG2      THR  81   3.432   7.597  -2.225
 1350   2HG2  THR  81          2HG2      THR  81   4.269   6.230  -2.962
 1351   3HG2  THR  81          3HG2      THR  81   2.528   6.156  -2.690
 1352    H    THR  82           H        THR  82   3.659   7.201   2.412
 1353    HA   THR  82           HA       THR  82   1.712   9.372   1.735
 1354    HB   THR  82           HB       THR  82   0.569   8.577   3.902
 1355    HG1  THR  82           HG1      THR  82   2.347   7.304   4.591
 1356   1HG2  THR  82          1HG2      THR  82   0.491   7.569   1.205
 1357   2HG2  THR  82          2HG2      THR  82   0.121   6.264   2.332
 1358   3HG2  THR  82          3HG2      THR  82  -0.834   7.746   2.356
 1359    H    ALA  83           H        ALA  83   4.659   8.841   3.137
 1360    HA   ALA  83           HA       ALA  83   4.516  10.246   5.614
 1361   1HB   ALA  83          1HB       ALA  83   6.616   9.374   3.755
 1362   2HB   ALA  83          2HB       ALA  83   7.019  10.862   4.615
 1363   3HB   ALA  83          3HB       ALA  83   6.617   9.404   5.520
 1364    H    CYS  84           H        CYS  84   5.782  11.540   2.512
 1365    HA   CYS  84           HA       CYS  84   5.866  14.239   3.255
 1366   1HB   CYS  84          1HB       CYS  84   6.321  12.864   0.929
 1367   2HB   CYS  84          2HB       CYS  84   4.866  13.770   0.514
 1368    HG   CYS  84           HG       CYS  84   6.849  15.610   1.848
 1369    H    HIS  85           H        HIS  85   4.322  15.775   3.650
 1370    HA   HIS  85           HA       HIS  85   1.556  15.016   3.880
 1371   1HB   HIS  85          1HB       HIS  85   3.184  17.225   4.643
 1372   2HB   HIS  85          2HB       HIS  85   1.825  17.867   3.720
 1373    HD1  HIS  85           HD1      HIS  85   0.951  18.819   6.082
 1374    HD2  HIS  85           HD2      HIS  85   0.967  14.666   5.710
 1375    HE1  HIS  85           HE1      HIS  85  -0.503  17.928   7.954
 1376    H    GLU  86           H        GLU  86   3.294  17.088   1.546
 1377    HA   GLU  86           HA       GLU  86   0.912  17.514  -0.069
 1378   1HB   GLU  86          1HB       GLU  86   2.451  18.562  -1.668
 1379   2HB   GLU  86          2HB       GLU  86   2.799  19.129  -0.033
 1380   1HG   GLU  86          1HG       GLU  86   4.359  16.831  -0.295
 1381   2HG   GLU  86          2HG       GLU  86   4.498  17.621  -1.865
 1382    H    PHE  87           H        PHE  87   0.056  15.593  -0.856
 1383    HA   PHE  87           HA       PHE  87   1.910  13.927  -2.513
 1384   1HB   PHE  87          1HB       PHE  87  -0.063  12.170  -2.005
 1385   2HB   PHE  87          2HB       PHE  87   1.340  12.342  -0.952
 1386    HD1  PHE  87           HD1      PHE  87  -1.836  14.281  -1.471
 1387    HD2  PHE  87           HD2      PHE  87   0.776  12.299   1.302
 1388    HE1  PHE  87           HE1      PHE  87  -3.327  14.937   0.399
 1389    HE2  PHE  87           HE2      PHE  87  -0.715  12.953   3.174
 1390    HZ   PHE  87           HZ       PHE  87  -2.765  14.274   2.723
 1391    H    PHE  88           H        PHE  88  -0.835  15.918  -2.482
 1392    HA   PHE  88           HA       PHE  88  -1.682  14.820  -5.137
 1393   1HB   PHE  88          1HB       PHE  88  -3.383  16.441  -3.215
 1394   2HB   PHE  88          2HB       PHE  88  -3.919  15.647  -4.696
 1395    HD1  PHE  88           HD1      PHE  88  -2.178  13.111  -4.283
 1396    HD2  PHE  88           HD2      PHE  88  -4.881  15.257  -1.721
 1397    HE1  PHE  88           HE1      PHE  88  -2.618  11.032  -3.003
 1398    HE2  PHE  88           HE2      PHE  88  -5.320  13.178  -0.444
 1399    HZ   PHE  88           HZ       PHE  88  -4.189  11.067  -1.085
 1400    H    GLU  89           H        GLU  89   0.135  17.189  -3.863
 1401    HA   GLU  89           HA       GLU  89  -0.786  19.188  -5.889
 1402   1HB   GLU  89          1HB       GLU  89  -0.541  19.531  -3.109
 1403   2HB   GLU  89          2HB       GLU  89   0.872  20.329  -3.799
 1404   1HG   GLU  89          1HG       GLU  89  -0.429  21.803  -5.087
 1405   2HG   GLU  89          2HG       GLU  89  -1.860  20.777  -4.983
 1406    H    HIS  90           H        HIS  90   0.627  18.673  -7.558
 1407    HA   HIS  90           HA       HIS  90   3.538  18.807  -6.885
 1408   1HB   HIS  90          1HB       HIS  90   3.919  17.391  -8.904
 1409   2HB   HIS  90          2HB       HIS  90   2.964  16.573  -7.672
 1410    HD1  HIS  90           HD1      HIS  90   0.887  19.053  -9.326
 1411    HD2  HIS  90           HD2      HIS  90   2.053  15.139 -10.168
 1412    HE1  HIS  90           HE1      HIS  90  -0.740  18.177 -11.051
 1413    H    GLU  91           H        GLU  91   3.021  21.215  -7.175
 1414    HA   GLU  91           HA       GLU  91   2.673  22.030  -9.999
 1415   1HB   GLU  91          1HB       GLU  91   2.105  23.210  -7.456
 1416   2HB   GLU  91          2HB       GLU  91   3.256  24.252  -8.294
 1417   1HG   GLU  91          1HG       GLU  91   1.475  25.066  -9.426
 1418   2HG   GLU  91          2HG       GLU  91   1.475  23.533 -10.299
   
  No H/Q in entry =        1418
  Start of MODEL    2
    1   1H    MET   0           HT3      MET   0   8.417   5.486 -14.077
    2   2H    MET   0           HT2      MET   0   9.776   6.318 -14.669
    3   3H    MET   0           HT1      MET   0   8.259   6.527 -15.407
    4    HA   MET   0           HA       MET   0   8.285   4.448 -16.398
    5   1HB   MET   0           HB2      MET   0  10.823   5.966 -16.439
    6   2HB   MET   0           HB1      MET   0  10.946   4.301 -17.009
    7   1HG   MET   0           HG2      MET   0   8.638   5.110 -18.236
    8   2HG   MET   0           HG1      MET   0   9.566   6.611 -18.226
    9   1HE   MET   0           HE2      MET   0  10.256   7.247 -19.963
   10   2HE   MET   0           HE1      MET   0  11.971   6.845 -20.053
   11   3HE   MET   0           HE3      MET   0  10.889   6.426 -21.389
   12    H    SER   1           HN       SER   1   8.095   3.616 -13.823
   13    HA   SER   1           HA       SER   1  10.042   1.363 -13.758
   14   1HB   SER   1           HB2      SER   1  10.847   1.857 -11.688
   15   2HB   SER   1           HB1      SER   1  10.299   3.492 -12.047
   16    HG   SER   1           HG       SER   1   8.972   1.447 -10.602
   17    H    GLU   2           HN       GLU   2   9.214  -0.297 -12.025
   18    HA   GLU   2           HA       GLU   2   6.446  -0.908 -12.720
   19   1HB   GLU   2           HB2      GLU   2   8.569  -2.479 -12.158
   20   2HB   GLU   2           HB1      GLU   2   7.820  -2.427 -10.562
   21   1HG   GLU   2           HG2      GLU   2   6.963  -4.321 -11.917
   22   2HG   GLU   2           HG1      GLU   2   5.686  -3.174 -11.507
   23    H    LEU   3           HN       LEU   3   8.090  -0.570  -9.560
   24    HA   LEU   3           HA       LEU   3   5.684  -0.369  -8.036
   25   1HB   LEU   3           HB2      LEU   3   8.037  -0.812  -7.171
   26   2HB   LEU   3           HB1      LEU   3   8.328   0.916  -7.336
   27    HG   LEU   3           HG       LEU   3   6.005   1.014  -5.979
   28   1HD1  LEU   3          HD11      LEU   3   6.279  -1.636  -5.971
   29   2HD1  LEU   3          HD13      LEU   3   7.319  -1.287  -4.591
   30   3HD1  LEU   3          HD12      LEU   3   5.628  -0.781  -4.572
   31   1HD2  LEU   3          HD23      LEU   3   8.879   0.954  -5.197
   32   2HD2  LEU   3          HD22      LEU   3   7.674   2.222  -4.969
   33   3HD2  LEU   3          HD21      LEU   3   7.710   0.837  -3.881
   34    H    GLU   4           HN       GLU   4   7.921   2.211  -9.078
   35    HA   GLU   4           HA       GLU   4   6.544   4.416  -8.076
   36   1HB   GLU   4           HB2      GLU   4   8.690   4.665  -9.208
   37   2HB   GLU   4           HB1      GLU   4   7.973   4.178 -10.744
   38   1HG   GLU   4           HG2      GLU   4   6.509   6.376  -9.489
   39   2HG   GLU   4           HG1      GLU   4   8.194   6.790  -9.810
   40    H    LYS   5           HN       LYS   5   5.763   2.549 -10.992
   41    HA   LYS   5           HA       LYS   5   3.642   4.411 -11.765
   42   1HB   LYS   5           HB2      LYS   5   5.058   2.368 -13.048
   43   2HB   LYS   5           HB1      LYS   5   3.415   1.740 -12.906
   44   1HG   LYS   5           HG2      LYS   5   3.512   2.975 -14.967
   45   2HG   LYS   5           HG1      LYS   5   2.597   3.959 -13.821
   46   1HD   LYS   5           HD2      LYS   5   4.073   5.553 -14.630
   47   2HD   LYS   5           HD1      LYS   5   5.003   4.938 -13.264
   48   1HE   LYS   5           HE2      LYS   5   6.582   4.827 -14.980
   49   2HE   LYS   5           HE1      LYS   5   5.902   3.200 -15.026
   50   1HZ   LYS   5           HZ3      LYS   5   4.250   4.731 -16.598
   51   2HZ   LYS   5           HZ2      LYS   5   5.820   5.238 -17.003
   52   3HZ   LYS   5           HZ1      LYS   5   5.395   3.597 -17.132
   53    H    ALA   6           HN       ALA   6   3.877   1.379  -9.977
   54    HA   ALA   6           HA       ALA   6   0.976   1.028  -9.836
   55   1HB   ALA   6           HB2      ALA   6   2.789  -0.812  -9.722
   56   2HB   ALA   6           HB1      ALA   6   3.001  -0.312  -8.046
   57   3HB   ALA   6           HB3      ALA   6   1.441  -0.929  -8.589
   58    H    MET   7           HN       MET   7   3.369   1.389  -7.210
   59    HA   MET   7           HA       MET   7   1.668   2.079  -5.142
   60   1HB   MET   7           HB2      MET   7   3.961   1.814  -4.600
   61   2HB   MET   7           HB1      MET   7   4.471   3.001  -5.803
   62   1HG   MET   7           HG2      MET   7   4.484   3.743  -3.326
   63   2HG   MET   7           HG1      MET   7   3.722   4.824  -4.489
   64   1HE   MET   7           HE2      MET   7   3.744   2.743  -1.667
   65   2HE   MET   7           HE1      MET   7   2.199   2.919  -0.836
   66   3HE   MET   7           HE3      MET   7   2.425   1.633  -2.030
   67    H    VAL   8           HN       VAL   8   3.210   4.381  -7.397
   68    HA   VAL   8           HA       VAL   8   1.877   6.686  -6.342
   69    HB   VAL   8           HB       VAL   8   2.840   6.295  -9.189
   70   1HG1  VAL   8          HG12      VAL   8   2.175   8.648  -7.432
   71   2HG1  VAL   8          HG11      VAL   8   3.347   8.820  -8.738
   72   3HG1  VAL   8          HG13      VAL   8   1.690   8.340  -9.099
   73   1HG2  VAL   8          HG23      VAL   8   4.557   5.672  -7.461
   74   2HG2  VAL   8          HG22      VAL   8   5.009   7.085  -8.414
   75   3HG2  VAL   8          HG21      VAL   8   4.388   7.288  -6.775
   76    H    ALA   9           HN       ALA   9   0.919   4.287  -8.737
   77    HA   ALA   9           HA       ALA   9  -1.312   5.736  -9.817
   78   1HB   ALA   9           HB3      ALA   9  -0.623   2.803  -9.630
   79   2HB   ALA   9           HB2      ALA   9  -2.154   3.340 -10.321
   80   3HB   ALA   9           HB1      ALA   9  -0.631   3.839 -11.057
   81    H    LEU  10           HN       LEU  10  -0.920   3.690  -6.969
   82    HA   LEU  10           HA       LEU  10  -3.691   3.402  -6.312
   83   1HB   LEU  10           HB2      LEU  10  -1.334   2.480  -5.251
   84   2HB   LEU  10           HB1      LEU  10  -1.818   3.675  -4.046
   85    HG   LEU  10           HG       LEU  10  -3.835   1.713  -5.093
   86   1HD1  LEU  10          HD13      LEU  10  -1.702   0.527  -4.302
   87   2HD1  LEU  10          HD12      LEU  10  -2.075   1.164  -2.700
   88   3HD1  LEU  10          HD11      LEU  10  -3.203   0.067  -3.496
   89   1HD2  LEU  10          HD21      LEU  10  -3.550   3.668  -2.907
   90   2HD2  LEU  10          HD23      LEU  10  -5.013   3.040  -3.667
   91   3HD2  LEU  10          HD22      LEU  10  -4.215   2.116  -2.394
   92    H    ILE  11           HN       ILE  11  -1.293   5.593  -4.804
   93    HA   ILE  11           HA       ILE  11  -3.031   7.200  -3.343
   94    HB   ILE  11           HB       ILE  11  -0.529   7.918  -4.888
   95   1HG1  ILE  11          HG12      ILE  11  -1.084   7.630  -1.918
   96   2HG1  ILE  11          HG11      ILE  11  -0.383   6.362  -2.928
   97   1HG2  ILE  11          HG23      ILE  11  -2.257   9.626  -3.081
   98   2HG2  ILE  11          HG22      ILE  11  -0.553   9.980  -3.373
   99   3HG2  ILE  11          HG21      ILE  11  -1.698   9.995  -4.714
  100   1HD1  ILE  11          HD11      ILE  11   1.257   8.405  -3.582
  101   2HD1  ILE  11          HD13      ILE  11   0.837   8.886  -1.937
  102   3HD1  ILE  11          HD12      ILE  11   1.583   7.314  -2.235
  103    H    ASP  12           HN       ASP  12  -2.556   7.082  -6.805
  104    HA   ASP  12           HA       ASP  12  -3.819   9.552  -7.506
  105   1HB   ASP  12           HB2      ASP  12  -2.522   7.791  -8.978
  106   2HB   ASP  12           HB1      ASP  12  -4.123   7.082  -9.193
  107    H    VAL  13           HN       VAL  13  -5.159   6.234  -7.299
  108    HA   VAL  13           HA       VAL  13  -7.819   6.736  -7.915
  109    HB   VAL  13           HB       VAL  13  -6.616   4.927  -5.809
  110   1HG1  VAL  13          HG13      VAL  13  -8.943   5.553  -5.158
  111   2HG1  VAL  13          HG12      VAL  13  -9.504   5.019  -6.743
  112   3HG1  VAL  13          HG11      VAL  13  -8.811   3.854  -5.615
  113   1HG2  VAL  13          HG21      VAL  13  -7.012   4.825  -8.648
  114   2HG2  VAL  13          HG23      VAL  13  -6.278   3.611  -7.602
  115   3HG2  VAL  13          HG22      VAL  13  -8.018   3.589  -7.894
  116    H    PHE  14           HN       PHE  14  -6.094   7.554  -4.951
  117    HA   PHE  14           HA       PHE  14  -8.356   8.311  -3.373
  118   1HB   PHE  14           HB2      PHE  14  -5.863   8.054  -2.681
  119   2HB   PHE  14           HB1      PHE  14  -5.692   9.721  -3.231
  120    HD1  PHE  14           HD1      PHE  14  -8.130   7.694  -1.207
  121    HD2  PHE  14           HD2      PHE  14  -5.933  11.363  -1.608
  122    HE1  PHE  14           HE1      PHE  14  -9.094   8.505   0.931
  123    HE2  PHE  14           HE2      PHE  14  -6.896  12.174   0.529
  124    HZ   PHE  14           HZ       PHE  14  -8.477  10.745   1.800
  125    H    HIS  15           HN       HIS  15  -6.214  10.270  -5.464
  126    HA   HIS  15           HA       HIS  15  -7.869  12.650  -5.161
  127   1HB   HIS  15           HB2      HIS  15  -5.635  13.167  -5.653
  128   2HB   HIS  15           HB1      HIS  15  -5.491  11.874  -6.841
  129    HD1  HIS  15           HD1      HIS  15  -5.559  12.656  -9.202
  130    HD2  HIS  15           HD2      HIS  15  -7.621  15.259  -6.675
  131    HE1  HIS  15           HE1      HIS  15  -6.378  14.565 -10.651
  132    H    GLN  16           HN       GLN  16  -8.306   9.785  -6.832
  133    HA   GLN  16           HA       GLN  16  -9.437  10.822  -9.294
  134   1HB   GLN  16           HB2      GLN  16  -8.755   8.298  -8.264
  135   2HB   GLN  16           HB1      GLN  16 -10.500   8.242  -8.513
  136   1HG   GLN  16           HG2      GLN  16  -9.960   7.776 -10.668
  137   2HG   GLN  16           HG1      GLN  16  -9.660   9.510 -10.795
  138   1HE2  GLN  16          HE22      GLN  16  -6.564   7.800 -11.963
  139   2HE2  GLN  16          HE21      GLN  16  -8.173   7.893 -12.492
  140    H    TYR  17           HN       TYR  17 -10.737   9.879  -6.141
  141    HA   TYR  17           HA       TYR  17 -13.127  11.489  -6.624
  142   1HB   TYR  17           HB2      TYR  17 -14.641   9.491  -6.101
  143   2HB   TYR  17           HB1      TYR  17 -13.926   9.517  -7.712
  144    HD1  TYR  17           HD1      TYR  17 -13.342   8.193  -4.262
  145    HD2  TYR  17           HD2      TYR  17 -12.654   7.682  -8.473
  146    HE1  TYR  17           HE1      TYR  17 -12.304   5.988  -3.826
  147    HE2  TYR  17           HE2      TYR  17 -11.613   5.475  -8.034
  148    HH   TYR  17           HH       TYR  17 -11.481   3.799  -6.425
  149    H    SER  18           HN       SER  18 -10.905  11.396  -4.709
  150    HA   SER  18           HA       SER  18 -11.644  10.231  -2.226
  151   1HB   SER  18           HB2      SER  18  -9.505  11.022  -2.045
  152   2HB   SER  18           HB1      SER  18  -9.809  12.382  -3.121
  153    HG   SER  18           HG       SER  18  -9.695  12.407  -0.503
  154    H    GLY  19           HN       GLY  19 -12.488  13.358  -3.674
  155   1HA   GLY  19           HA2      GLY  19 -15.006  13.568  -2.432
  156   2HA   GLY  19           HA1      GLY  19 -13.863  14.393  -1.371
  157    H    ARG  20           HN       ARG  20 -14.759  14.246  -4.832
  158    HA   ARG  20           HA       ARG  20 -13.599  16.455  -5.918
  159   1HB   ARG  20           HB2      ARG  20 -16.584  15.988  -6.152
  160   2HB   ARG  20           HB1      ARG  20 -15.536  16.776  -7.331
  161   1HG   ARG  20           HG2      ARG  20 -14.245  14.598  -7.492
  162   2HG   ARG  20           HG1      ARG  20 -15.520  13.857  -6.524
  163   1HD   ARG  20           HD2      ARG  20 -15.632  14.893  -9.329
  164   2HD   ARG  20           HD1      ARG  20 -16.330  13.423  -8.650
  165    HE   ARG  20           HE       ARG  20 -17.469  16.136  -8.088
  166   1HH1  ARG  20          HH11      ARG  20 -18.010  13.571 -10.088
  167   2HH1  ARG  20          HH12      ARG  20 -19.595  13.185  -9.505
  168   1HH2  ARG  20          HH21      ARG  20 -19.396  15.305  -6.767
  169   2HH2  ARG  20          HH22      ARG  20 -20.379  14.165  -7.624
  170    H    GLU  21           HN       GLU  21 -16.383  16.581  -3.716
  171    HA   GLU  21           HA       GLU  21 -15.812  19.495  -3.340
  172   1HB   GLU  21           HB2      GLU  21 -18.170  18.342  -4.352
  173   2HB   GLU  21           HB1      GLU  21 -18.544  18.772  -2.682
  174   1HG   GLU  21           HG2      GLU  21 -18.240  21.030  -3.044
  175   2HG   GLU  21           HG1      GLU  21 -17.055  20.772  -4.327
  176    H    GLY  22           HN       GLY  22 -17.728  19.778  -1.217
  177   1HA   GLY  22           HA2      GLY  22 -17.789  19.578   1.119
  178   2HA   GLY  22           HA1      GLY  22 -17.514  17.857   0.846
  179    H    ASP  23           HN       ASP  23 -15.816  17.232   2.099
  180    HA   ASP  23           HA       ASP  23 -13.735  19.058   2.936
  181   1HB   ASP  23           HB2      ASP  23 -14.349  16.172   3.288
  182   2HB   ASP  23           HB1      ASP  23 -12.649  16.625   3.428
  183    H    LYS  24           HN       LYS  24 -11.335  17.879   2.588
  184    HA   LYS  24           HA       LYS  24 -11.062  17.451  -0.355
  185   1HB   LYS  24           HB2      LYS  24 -10.431  19.746  -0.012
  186   2HB   LYS  24           HB1      LYS  24  -9.465  19.331   1.404
  187   1HG   LYS  24           HG2      LYS  24  -7.690  18.676   0.148
  188   2HG   LYS  24           HG1      LYS  24  -8.712  17.854  -1.033
  189   1HD   LYS  24           HD2      LYS  24  -9.341  20.501  -1.468
  190   2HD   LYS  24           HD1      LYS  24  -7.623  20.588  -1.077
  191   1HE   LYS  24           HE2      LYS  24  -7.043  19.077  -2.834
  192   2HE   LYS  24           HE1      LYS  24  -8.724  18.601  -3.075
  193   1HZ   LYS  24           HZ1      LYS  24  -7.787  21.383  -3.460
  194   2HZ   LYS  24           HZ3      LYS  24  -7.782  20.241  -4.715
  195   3HZ   LYS  24           HZ2      LYS  24  -9.248  20.688  -3.979
  196    H    HIS  25           HN       HIS  25  -9.846  15.686  -0.815
  197    HA   HIS  25           HA       HIS  25  -8.403  13.866  -0.538
  198   1HB   HIS  25           HB2      HIS  25  -7.202  15.919   1.305
  199   2HB   HIS  25           HB1      HIS  25  -6.494  14.311   1.147
  200    HD1  HIS  25           HD1      HIS  25  -6.900  13.854  -1.872
  201    HD2  HIS  25           HD2      HIS  25  -5.461  17.422  -0.264
  202    HE1  HIS  25           HE1      HIS  25  -5.632  15.017  -3.731
  203    H    LYS  26           HN       LYS  26 -10.878  14.177   1.145
  204    HA   LYS  26           HA       LYS  26 -10.045  12.350   3.368
  205   1HB   LYS  26           HB2      LYS  26 -12.508  14.091   3.484
  206   2HB   LYS  26           HB1      LYS  26 -11.632  13.333   4.814
  207   1HG   LYS  26           HG2      LYS  26 -10.633  15.614   3.084
  208   2HG   LYS  26           HG1      LYS  26 -11.144  15.730   4.769
  209   1HD   LYS  26           HD2      LYS  26  -9.211  13.634   4.584
  210   2HD   LYS  26           HD1      LYS  26  -8.558  15.047   3.755
  211   1HE   LYS  26           HE2      LYS  26  -9.064  16.439   5.735
  212   2HE   LYS  26           HE1      LYS  26  -9.697  15.019   6.565
  213   1HZ   LYS  26           HZ3      LYS  26  -6.962  15.030   5.454
  214   2HZ   LYS  26           HZ2      LYS  26  -7.283  15.690   6.987
  215   3HZ   LYS  26           HZ1      LYS  26  -7.609  14.052   6.680
  216    H    LEU  27           HN       LEU  27 -10.940  10.346   3.199
  217    HA   LEU  27           HA       LEU  27 -13.160   9.965   1.261
  218   1HB   LEU  27           HB2      LEU  27 -10.860   8.522   1.678
  219   2HB   LEU  27           HB1      LEU  27 -12.039   7.588   2.599
  220    HG   LEU  27           HG       LEU  27 -13.544   7.798   0.502
  221   1HD1  LEU  27          HD11      LEU  27 -11.028   9.048  -0.375
  222   2HD1  LEU  27          HD13      LEU  27 -11.618   7.798  -1.469
  223   3HD1  LEU  27          HD12      LEU  27 -12.647   9.173  -1.063
  224   1HD2  LEU  27          HD22      LEU  27 -10.981   6.169   0.405
  225   2HD2  LEU  27          HD21      LEU  27 -12.472   5.695   1.220
  226   3HD2  LEU  27          HD23      LEU  27 -12.435   5.838  -0.536
  227    H    LYS  28           HN       LYS  28 -14.153   7.534   2.443
  228    HA   LYS  28           HA       LYS  28 -15.103   8.301   5.131
  229   1HB   LYS  28           HB2      LYS  28 -16.639   8.786   2.752
  230   2HB   LYS  28           HB1      LYS  28 -17.441   7.543   3.715
  231   1HG   LYS  28           HG2      LYS  28 -17.819   8.961   5.487
  232   2HG   LYS  28           HG1      LYS  28 -16.366   9.911   5.171
  233   1HD   LYS  28           HD2      LYS  28 -18.044  11.396   4.518
  234   2HD   LYS  28           HD1      LYS  28 -17.642  10.618   2.986
  235   1HE   LYS  28           HE2      LYS  28 -19.586   9.346   2.966
  236   2HE   LYS  28           HE1      LYS  28 -19.754   9.386   4.721
  237   1HZ   LYS  28           HZ2      LYS  28 -19.897  11.947   3.351
  238   2HZ   LYS  28           HZ1      LYS  28 -21.202  10.889   3.094
  239   3HZ   LYS  28           HZ3      LYS  28 -20.796  11.367   4.671
  240    H    LYS  29           HN       LYS  29 -17.018   6.464   5.585
  241    HA   LYS  29           HA       LYS  29 -15.517   3.951   5.479
  242   1HB   LYS  29           HB2      LYS  29 -18.337   4.368   6.503
  243   2HB   LYS  29           HB1      LYS  29 -17.211   3.082   6.939
  244   1HG   LYS  29           HG2      LYS  29 -16.800   6.033   7.513
  245   2HG   LYS  29           HG1      LYS  29 -17.319   4.830   8.694
  246   1HD   LYS  29           HD2      LYS  29 -15.191   3.538   8.102
  247   2HD   LYS  29           HD1      LYS  29 -14.662   4.995   7.261
  248   1HE   LYS  29           HE2      LYS  29 -14.189   6.070   9.198
  249   2HE   LYS  29           HE1      LYS  29 -15.696   5.543   9.951
  250   1HZ   LYS  29           HZ3      LYS  29 -14.383   3.248   9.879
  251   2HZ   LYS  29           HZ2      LYS  29 -13.060   4.307   9.995
  252   3HZ   LYS  29           HZ1      LYS  29 -14.275   4.326  11.183
  253    H    SER  30           HN       SER  30 -18.269   5.382   3.822
  254    HA   SER  30           HA       SER  30 -19.070   2.840   2.612
  255   1HB   SER  30           HB2      SER  30 -20.555   4.324   1.210
  256   2HB   SER  30           HB1      SER  30 -20.801   4.496   2.945
  257    HG   SER  30           HG       SER  30 -20.165   6.366   1.200
  258    H    GLU  31           HN       GLU  31 -17.148   5.664   1.670
  259    HA   GLU  31           HA       GLU  31 -16.777   4.663  -1.058
  260   1HB   GLU  31           HB2      GLU  31 -16.720   7.129  -0.340
  261   2HB   GLU  31           HB1      GLU  31 -15.123   6.786   0.328
  262   1HG   GLU  31           HG2      GLU  31 -14.160   6.739  -1.719
  263   2HG   GLU  31           HG1      GLU  31 -15.459   5.758  -2.396
  264    H    LEU  32           HN       LEU  32 -15.223   4.359   2.037
  265    HA   LEU  32           HA       LEU  32 -12.699   3.362   0.926
  266   1HB   LEU  32           HB2      LEU  32 -12.636   4.447   3.103
  267   2HB   LEU  32           HB1      LEU  32 -13.845   3.329   3.737
  268    HG   LEU  32           HG       LEU  32 -12.295   1.441   3.372
  269   1HD1  LEU  32          HD11      LEU  32 -10.686   3.620   2.111
  270   2HD1  LEU  32          HD13      LEU  32  -9.817   2.345   2.966
  271   3HD1  LEU  32          HD12      LEU  32 -10.877   1.936   1.618
  272   1HD2  LEU  32          HD22      LEU  32 -11.108   3.768   4.921
  273   2HD2  LEU  32          HD21      LEU  32 -12.251   2.579   5.546
  274   3HD2  LEU  32          HD23      LEU  32 -10.616   2.084   5.102
  275    H    LYS  33           HN       LYS  33 -15.622   2.008   2.431
  276    HA   LYS  33           HA       LYS  33 -14.805  -0.725   2.432
  277   1HB   LYS  33           HB2      LYS  33 -16.976   0.533   3.359
  278   2HB   LYS  33           HB1      LYS  33 -17.645  -0.025   1.830
  279   1HG   LYS  33           HG2      LYS  33 -16.087  -2.095   3.191
  280   2HG   LYS  33           HG1      LYS  33 -17.465  -1.540   4.146
  281   1HD   LYS  33           HD2      LYS  33 -17.871  -2.106   1.231
  282   2HD   LYS  33           HD1      LYS  33 -17.770  -3.465   2.351
  283   1HE   LYS  33           HE2      LYS  33 -19.595  -2.571   3.685
  284   2HE   LYS  33           HE1      LYS  33 -19.636  -1.102   2.710
  285   1HZ   LYS  33           HZ2      LYS  33 -20.222  -2.438   0.785
  286   2HZ   LYS  33           HZ1      LYS  33 -20.186  -3.851   1.727
  287   3HZ   LYS  33           HZ3      LYS  33 -21.353  -2.658   2.034
  288    H    GLU  34           HN       GLU  34 -16.208   1.357  -0.038
  289    HA   GLU  34           HA       GLU  34 -16.478  -0.839  -1.956
  290   1HB   GLU  34           HB2      GLU  34 -17.599   0.697  -3.264
  291   2HB   GLU  34           HB1      GLU  34 -17.748   1.530  -1.720
  292   1HG   GLU  34           HG2      GLU  34 -16.915   3.256  -2.983
  293   2HG   GLU  34           HG1      GLU  34 -15.396   2.549  -2.450
  294    H    LEU  35           HN       LEU  35 -14.212   1.671  -1.120
  295    HA   LEU  35           HA       LEU  35 -12.514   1.683  -3.370
  296   1HB   LEU  35           HB2      LEU  35 -12.438   2.945  -1.009
  297   2HB   LEU  35           HB1      LEU  35 -11.284   1.659  -0.642
  298    HG   LEU  35           HG       LEU  35  -9.998   3.471  -1.533
  299   1HD1  LEU  35          HD12      LEU  35 -10.537   1.458  -3.740
  300   2HD1  LEU  35          HD11      LEU  35  -9.119   2.501  -3.638
  301   3HD1  LEU  35          HD13      LEU  35  -9.386   1.255  -2.420
  302   1HD2  LEU  35          HD22      LEU  35 -11.950   4.655  -2.545
  303   2HD2  LEU  35          HD21      LEU  35 -10.563   4.579  -3.633
  304   3HD2  LEU  35          HD23      LEU  35 -11.929   3.489  -3.869
  305    H    ILE  36           HN       ILE  36 -12.431  -0.436  -0.513
  306    HA   ILE  36           HA       ILE  36 -10.311  -2.086  -1.643
  307    HB   ILE  36           HB       ILE  36 -11.950  -3.120   0.603
  308   1HG1  ILE  36          HG12      ILE  36 -10.483  -0.483   0.660
  309   2HG1  ILE  36          HG11      ILE  36 -12.062  -0.881   1.330
  310   1HG2  ILE  36          HG23      ILE  36  -9.859  -4.195  -0.160
  311   2HG2  ILE  36          HG22      ILE  36  -8.978  -2.701   0.155
  312   3HG2  ILE  36          HG21      ILE  36  -9.698  -3.598   1.492
  313   1HD1  ILE  36          HD12      ILE  36 -10.967  -2.347   3.007
  314   2HD1  ILE  36          HD11      ILE  36  -9.392  -1.881   2.364
  315   3HD1  ILE  36          HD13      ILE  36 -10.423  -0.675   3.138
  316    H    ASN  37           HN       ASN  37 -13.729  -2.717  -0.806
  317    HA   ASN  37           HA       ASN  37 -13.730  -5.303  -2.059
  318   1HB   ASN  37           HB2      ASN  37 -15.349  -4.225  -0.276
  319   2HB   ASN  37           HB1      ASN  37 -16.254  -3.736  -1.709
  320   1HD2  ASN  37          HD22      ASN  37 -17.791  -6.920  -1.606
  321   2HD2  ASN  37          HD21      ASN  37 -18.004  -5.237  -1.525
  322    H    ASN  38           HN       ASN  38 -13.554  -2.349  -3.589
  323    HA   ASN  38           HA       ASN  38 -15.275  -3.258  -5.850
  324   1HB   ASN  38           HB2      ASN  38 -15.642  -0.947  -5.057
  325   2HB   ASN  38           HB1      ASN  38 -13.952  -0.568  -5.399
  326   1HD2  ASN  38          HD22      ASN  38 -14.409  -0.534  -8.957
  327   2HD2  ASN  38          HD21      ASN  38 -13.257  -0.788  -7.738
  328    H    GLU  39           HN       GLU  39 -11.917  -2.467  -5.047
  329    HA   GLU  39           HA       GLU  39 -11.185  -3.295  -7.831
  330   1HB   GLU  39           HB2      GLU  39  -9.417  -1.756  -5.934
  331   2HB   GLU  39           HB1      GLU  39  -9.263  -1.914  -7.681
  332   1HG   GLU  39           HG2      GLU  39 -11.783  -0.721  -6.585
  333   2HG   GLU  39           HG1      GLU  39 -10.328   0.273  -6.601
  334    H    LEU  40           HN       LEU  40 -10.686  -3.928  -4.444
  335    HA   LEU  40           HA       LEU  40  -8.384  -5.677  -4.838
  336   1HB   LEU  40           HB2      LEU  40 -10.252  -5.326  -2.465
  337   2HB   LEU  40           HB1      LEU  40  -8.802  -6.303  -2.460
  338    HG   LEU  40           HG       LEU  40  -8.522  -3.998  -1.462
  339   1HD1  LEU  40          HD11      LEU  40  -6.643  -5.363  -2.358
  340   2HD1  LEU  40          HD13      LEU  40  -6.844  -4.560  -3.915
  341   3HD1  LEU  40          HD12      LEU  40  -6.365  -3.626  -2.497
  342   1HD2  LEU  40          HD21      LEU  40  -9.959  -2.864  -3.217
  343   2HD2  LEU  40          HD23      LEU  40  -8.413  -2.082  -2.908
  344   3HD2  LEU  40          HD22      LEU  40  -8.624  -3.084  -4.343
  345    H    SER  41           HN       SER  41 -11.788  -6.114  -3.921
  346    HA   SER  41           HA       SER  41 -12.083  -8.832  -3.786
  347   1HB   SER  41           HB2      SER  41 -13.936  -7.155  -3.654
  348   2HB   SER  41           HB1      SER  41 -13.895  -7.022  -5.409
  349    HG   SER  41           HG       SER  41 -15.456  -8.548  -4.550
  350    H    HIS  42           HN       HIS  42 -10.703 -10.074  -5.077
  351    HA   HIS  42           HA       HIS  42 -11.577 -10.796  -7.687
  352   1HB   HIS  42           HB2      HIS  42 -10.629  -8.512  -8.207
  353   2HB   HIS  42           HB1      HIS  42  -9.050  -9.122  -7.708
  354    HD1  HIS  42           HD1      HIS  42 -11.104  -8.782 -10.635
  355    HD2  HIS  42           HD2      HIS  42  -8.388 -11.648  -9.291
  356    HE1  HIS  42           HE1      HIS  42 -10.435 -10.148 -12.663
  357    H    PHE  43           HN       PHE  43  -8.912 -10.573  -5.392
  358    HA   PHE  43           HA       PHE  43  -8.042 -13.300  -6.270
  359   1HB   PHE  43           HB2      PHE  43  -6.014 -12.161  -4.656
  360   2HB   PHE  43           HB1      PHE  43  -5.947 -12.474  -6.388
  361    HD1  PHE  43           HD1      PHE  43  -6.729  -9.934  -3.800
  362    HD2  PHE  43           HD2      PHE  43  -6.204 -10.698  -7.996
  363    HE1  PHE  43           HE1      PHE  43  -6.690  -7.493  -4.239
  364    HE2  PHE  43           HE2      PHE  43  -6.167  -8.256  -8.435
  365    HZ   PHE  43           HZ       PHE  43  -6.409  -6.654  -6.555
  366    H    LEU  44           HN       LEU  44 -10.145 -12.415  -4.294
  367    HA   LEU  44           HA       LEU  44  -8.961 -13.384  -1.748
  368   1HB   LEU  44           HB2      LEU  44 -11.471 -11.914  -2.496
  369   2HB   LEU  44           HB1      LEU  44 -11.428 -12.829  -0.989
  370    HG   LEU  44           HG       LEU  44  -9.237 -11.602  -0.483
  371   1HD1  LEU  44          HD11      LEU  44 -10.221 -10.121  -2.914
  372   2HD1  LEU  44          HD13      LEU  44  -9.262  -9.292  -1.688
  373   3HD1  LEU  44          HD12      LEU  44  -8.588 -10.678  -2.548
  374   1HD2  LEU  44          HD21      LEU  44 -11.984 -10.399  -0.552
  375   2HD2  LEU  44          HD23      LEU  44 -11.006 -10.868   0.838
  376   3HD2  LEU  44          HD22      LEU  44 -10.634  -9.387  -0.044
  377    H    GLU  45           HN       GLU  45  -9.037 -15.553  -1.448
  378    HA   GLU  45           HA       GLU  45 -11.464 -17.009  -2.411
  379   1HB   GLU  45           HB2      GLU  45  -8.569 -17.908  -2.447
  380   2HB   GLU  45           HB1      GLU  45  -9.934 -18.988  -2.740
  381   1HG   GLU  45           HG2      GLU  45 -10.452 -16.822  -4.403
  382   2HG   GLU  45           HG1      GLU  45  -8.705 -17.030  -4.528
  383    H    GLU  46           HN       GLU  46  -8.650 -17.977  -0.464
  384    HA   GLU  46           HA       GLU  46 -10.502 -19.063   1.570
  385   1HB   GLU  46           HB2      GLU  46  -7.494 -19.233   1.224
  386   2HB   GLU  46           HB1      GLU  46  -8.362 -19.947   2.585
  387   1HG   GLU  46           HG2      GLU  46  -9.283 -21.610   1.304
  388   2HG   GLU  46           HG1      GLU  46  -9.413 -20.580  -0.122
  389    H    ILE  47           HN       ILE  47  -7.806 -16.729   1.377
  390    HA   ILE  47           HA       ILE  47  -7.348 -14.858   2.723
  391    HB   ILE  47           HB       ILE  47 -10.055 -15.294   3.999
  392   1HG1  ILE  47          HG12      ILE  47 -10.134 -15.397   1.458
  393   2HG1  ILE  47          HG11      ILE  47 -11.075 -14.091   2.182
  394   1HG2  ILE  47          HG21      ILE  47  -8.006 -13.209   3.976
  395   2HG2  ILE  47          HG23      ILE  47  -9.593 -12.592   3.514
  396   3HG2  ILE  47          HG22      ILE  47  -9.383 -13.414   5.061
  397   1HD1  ILE  47          HD13      ILE  47  -8.220 -13.572   1.426
  398   2HD1  ILE  47          HD12      ILE  47  -9.448 -13.590   0.161
  399   3HD1  ILE  47          HD11      ILE  47  -9.578 -12.449   1.500
  400    H    LYS  48           HN       LYS  48  -5.747 -16.250   3.797
  401    HA   LYS  48           HA       LYS  48  -6.438 -17.765   6.158
  402   1HB   LYS  48           HB2      LYS  48  -4.110 -17.322   4.573
  403   2HB   LYS  48           HB1      LYS  48  -3.701 -16.914   6.240
  404   1HG   LYS  48           HG2      LYS  48  -4.646 -19.094   6.980
  405   2HG   LYS  48           HG1      LYS  48  -4.959 -19.505   5.293
  406   1HD   LYS  48           HD2      LYS  48  -2.870 -20.356   5.222
  407   2HD   LYS  48           HD1      LYS  48  -2.285 -18.694   5.315
  408   1HE   LYS  48           HE2      LYS  48  -3.082 -19.746   7.927
  409   2HE   LYS  48           HE1      LYS  48  -1.788 -20.688   7.183
  410   1HZ   LYS  48           HZ3      LYS  48  -1.441 -17.850   6.910
  411   2HZ   LYS  48           HZ2      LYS  48  -1.462 -18.364   8.529
  412   3HZ   LYS  48           HZ1      LYS  48  -0.343 -19.031   7.436
  413    H    GLU  49           HN       GLU  49  -5.394 -14.433   5.587
  414    HA   GLU  49           HA       GLU  49  -5.157 -13.912   8.475
  415   1HB   GLU  49           HB2      GLU  49  -4.684 -12.351   5.966
  416   2HB   GLU  49           HB1      GLU  49  -5.026 -11.460   7.446
  417   1HG   GLU  49           HG2      GLU  49  -2.961 -13.656   7.399
  418   2HG   GLU  49           HG1      GLU  49  -2.550 -12.004   6.931
  419    H    GLN  50           HN       GLN  50  -7.595 -14.788   8.405
  420    HA   GLN  50           HA       GLN  50  -9.699 -13.148   7.477
  421   1HB   GLN  50           HB2      GLN  50  -9.717 -15.502   8.664
  422   2HB   GLN  50           HB1      GLN  50  -9.928 -14.538  10.128
  423   1HG   GLN  50           HG2      GLN  50 -12.012 -13.765   9.491
  424   2HG   GLN  50           HG1      GLN  50 -11.644 -13.888   7.770
  425   1HE2  GLN  50          HE22      GLN  50 -13.100 -17.073   7.490
  426   2HE2  GLN  50          HE21      GLN  50 -12.550 -15.664   6.719
  427    H    GLU  51           HN       GLU  51  -7.528 -12.707  10.168
  428    HA   GLU  51           HA       GLU  51  -9.201 -10.749  11.536
  429   1HB   GLU  51           HB2      GLU  51  -6.730 -12.115  12.039
  430   2HB   GLU  51           HB1      GLU  51  -6.457 -10.379  12.207
  431   1HG   GLU  51           HG2      GLU  51  -8.295 -10.183  13.781
  432   2HG   GLU  51           HG1      GLU  51  -8.743 -11.871  13.527
  433    H    VAL  52           HN       VAL  52  -6.665 -10.658   9.089
  434    HA   VAL  52           HA       VAL  52  -6.223  -7.811   9.218
  435    HB   VAL  52           HB       VAL  52  -5.755  -9.830   7.005
  436   1HG1  VAL  52          HG11      VAL  52  -5.083  -6.895   7.220
  437   2HG1  VAL  52          HG13      VAL  52  -4.161  -7.988   6.185
  438   3HG1  VAL  52          HG12      VAL  52  -5.883  -7.740   5.894
  439   1HG2  VAL  52          HG23      VAL  52  -4.486  -9.582   9.412
  440   2HG2  VAL  52          HG22      VAL  52  -3.709 -10.189   7.948
  441   3HG2  VAL  52          HG21      VAL  52  -3.521  -8.497   8.411
  442    H    VAL  53           HN       VAL  53  -8.177  -9.829   7.001
  443    HA   VAL  53           HA       VAL  53  -9.314  -7.493   5.693
  444    HB   VAL  53           HB       VAL  53 -10.116 -10.419   5.676
  445   1HG1  VAL  53          HG11      VAL  53 -11.707  -8.254   4.974
  446   2HG1  VAL  53          HG13      VAL  53 -10.982  -8.739   3.440
  447   3HG1  VAL  53          HG12      VAL  53 -11.905  -9.907   4.388
  448   1HG2  VAL  53          HG21      VAL  53  -8.426  -8.651   3.908
  449   2HG2  VAL  53          HG23      VAL  53  -8.023 -10.225   4.597
  450   3HG2  VAL  53          HG22      VAL  53  -9.181 -10.113   3.271
  451    H    ASP  54           HN       ASP  54 -10.211  -9.542   8.403
  452    HA   ASP  54           HA       ASP  54 -12.917  -8.433   8.576
  453   1HB   ASP  54           HB2      ASP  54 -11.284 -10.102  10.513
  454   2HB   ASP  54           HB1      ASP  54 -12.955  -9.614  10.795
  455    H    LYS  55           HN       LYS  55  -9.751  -7.522   9.578
  456    HA   LYS  55           HA       LYS  55 -10.621  -5.878  11.828
  457   1HB   LYS  55           HB2      LYS  55  -8.341  -6.772  11.786
  458   2HB   LYS  55           HB1      LYS  55  -8.019  -5.940  10.264
  459   1HG   LYS  55           HG2      LYS  55  -9.037  -4.191  12.411
  460   2HG   LYS  55           HG1      LYS  55  -7.456  -4.904  12.739
  461   1HD   LYS  55           HD2      LYS  55  -6.940  -4.182  10.259
  462   2HD   LYS  55           HD1      LYS  55  -8.275  -3.057  10.521
  463   1HE   LYS  55           HE2      LYS  55  -7.039  -2.450  12.728
  464   2HE   LYS  55           HE1      LYS  55  -5.641  -3.219  11.974
  465   1HZ   LYS  55           HZ3      LYS  55  -6.692  -1.604  10.028
  466   2HZ   LYS  55           HZ2      LYS  55  -6.808  -0.672  11.445
  467   3HZ   LYS  55           HZ1      LYS  55  -5.304  -1.293  10.951
  468    H    VAL  56           HN       VAL  56  -9.617  -5.261   8.448
  469    HA   VAL  56           HA       VAL  56 -10.187  -2.414   8.692
  470    HB   VAL  56           HB       VAL  56 -10.008  -2.544   6.135
  471   1HG1  VAL  56          HG13      VAL  56  -8.143  -2.113   7.921
  472   2HG1  VAL  56          HG12      VAL  56  -7.585  -3.723   7.460
  473   3HG1  VAL  56          HG11      VAL  56  -7.674  -2.442   6.252
  474   1HG2  VAL  56          HG22      VAL  56 -10.199  -5.316   6.714
  475   2HG2  VAL  56          HG21      VAL  56  -9.953  -4.560   5.143
  476   3HG2  VAL  56          HG23      VAL  56  -8.565  -5.027   6.123
  477    H    MET  57           HN       MET  57 -11.865  -5.263   7.435
  478    HA   MET  57           HA       MET  57 -14.127  -3.813   6.374
  479   1HB   MET  57           HB2      MET  57 -13.497  -6.192   5.782
  480   2HB   MET  57           HB1      MET  57 -14.051  -6.671   7.389
  481   1HG   MET  57           HG2      MET  57 -15.880  -7.026   5.847
  482   2HG   MET  57           HG1      MET  57 -16.283  -5.630   6.847
  483   1HE   MET  57           HE3      MET  57 -14.215  -6.747   4.119
  484   2HE   MET  57           HE2      MET  57 -15.035  -6.197   2.661
  485   3HE   MET  57           HE1      MET  57 -13.736  -5.227   3.351
  486    H    GLU  58           HN       GLU  58 -13.142  -4.853   9.540
  487    HA   GLU  58           HA       GLU  58 -15.790  -4.718  10.746
  488   1HB   GLU  58           HB2      GLU  58 -12.995  -5.068  11.689
  489   2HB   GLU  58           HB1      GLU  58 -14.105  -4.326  12.842
  490   1HG   GLU  58           HG2      GLU  58 -15.696  -6.207  12.482
  491   2HG   GLU  58           HG1      GLU  58 -14.516  -6.969  11.414
  492    H    THR  59           HN       THR  59 -12.923  -2.555  10.969
  493    HA   THR  59           HA       THR  59 -14.321  -0.428  12.269
  494    HB   THR  59           HB       THR  59 -11.947  -0.263  10.378
  495    HG1  THR  59           HG1      THR  59 -11.923  -1.598  12.415
  496   1HG2  THR  59          HG23      THR  59 -13.231   1.673  12.299
  497   2HG2  THR  59          HG22      THR  59 -11.518   1.799  11.897
  498   3HG2  THR  59          HG21      THR  59 -12.733   1.942  10.628
  499    H    LEU  60           HN       LEU  60 -14.155  -1.484   8.963
  500    HA   LEU  60           HA       LEU  60 -15.124   0.911   7.706
  501   1HB   LEU  60           HB2      LEU  60 -14.818  -1.964   6.985
  502   2HB   LEU  60           HB1      LEU  60 -15.966  -1.030   6.032
  503    HG   LEU  60           HG       LEU  60 -13.097  -0.208   6.552
  504   1HD1  LEU  60          HD13      LEU  60 -14.400  -1.828   4.409
  505   2HD1  LEU  60          HD12      LEU  60 -13.171  -0.665   3.911
  506   3HD1  LEU  60          HD11      LEU  60 -12.764  -1.938   5.061
  507   1HD2  LEU  60          HD22      LEU  60 -15.322   0.907   4.824
  508   2HD2  LEU  60          HD21      LEU  60 -14.488   1.718   6.149
  509   3HD2  LEU  60          HD23      LEU  60 -13.633   1.377   4.644
  510    H    ASP  61           HN       ASP  61 -16.798  -2.108   8.624
  511    HA   ASP  61           HA       ASP  61 -19.426  -0.950   8.130
  512   1HB   ASP  61           HB2      ASP  61 -18.478  -3.509   8.238
  513   2HB   ASP  61           HB1      ASP  61 -19.230  -3.364   9.829
  514    H    GLU  62           HN       GLU  62 -17.212  -0.598  10.619
  515    HA   GLU  62           HA       GLU  62 -19.034  -0.622  12.875
  516   1HB   GLU  62           HB2      GLU  62 -16.262  -0.446  12.533
  517   2HB   GLU  62           HB1      GLU  62 -16.727   1.112  13.220
  518   1HG   GLU  62           HG2      GLU  62 -18.127  -0.265  14.904
  519   2HG   GLU  62           HG1      GLU  62 -17.167  -1.644  14.365
  520    H    ASP  63           HN       ASP  63 -17.416   2.070  11.170
  521    HA   ASP  63           HA       ASP  63 -19.241   4.011  12.372
  522   1HB   ASP  63           HB2      ASP  63 -16.973   4.142  10.405
  523   2HB   ASP  63           HB1      ASP  63 -18.063   5.520  10.573
  524    H    GLY  64           HN       GLY  64 -18.542   3.246   8.955
  525   1HA   GLY  64           HA2      GLY  64 -20.194   2.716   7.287
  526   2HA   GLY  64           HA1      GLY  64 -21.454   3.254   8.401
  527    H    ASP  65           HN       ASP  65 -20.727   5.765   9.093
  528    HA   ASP  65           HA       ASP  65 -20.411   7.201   6.487
  529   1HB   ASP  65           HB2      ASP  65 -22.782   7.133   7.582
  530   2HB   ASP  65           HB1      ASP  65 -22.102   8.275   8.741
  531    H    GLY  66           HN       GLY  66 -18.393   6.558   8.539
  532   1HA   GLY  66           HA2      GLY  66 -17.899   9.134   9.883
  533   2HA   GLY  66           HA1      GLY  66 -16.933   7.669  10.070
  534    H    GLU  67           HN       GLU  67 -15.718  10.166   9.608
  535    HA   GLU  67           HA       GLU  67 -15.035  10.264   6.737
  536   1HB   GLU  67           HB2      GLU  67 -14.352  11.959   9.138
  537   2HB   GLU  67           HB1      GLU  67 -13.468  12.138   7.620
  538   1HG   GLU  67           HG2      GLU  67 -15.380  12.834   6.444
  539   2HG   GLU  67           HG1      GLU  67 -16.480  12.158   7.647
  540    H    CYS  68           HN       CYS  68 -12.922   9.835   5.940
  541    HA   CYS  68           HA       CYS  68 -11.110   8.427   7.859
  542   1HB   CYS  68           HB2      CYS  68 -11.331   7.636   4.960
  543   2HB   CYS  68           HB1      CYS  68 -10.717   6.693   6.318
  544    HG   CYS  68           HG       CYS  68 -13.763   7.380   6.088
  545    H    ASP  69           HN       ASP  69  -8.833   8.599   7.334
  546    HA   ASP  69           HA       ASP  69  -8.223  11.083   5.838
  547   1HB   ASP  69           HB2      ASP  69  -6.205   9.380   7.300
  548   2HB   ASP  69           HB1      ASP  69  -6.161  11.116   6.988
  549    H    PHE  70           HN       PHE  70  -5.852  10.772   4.713
  550    HA   PHE  70           HA       PHE  70  -6.364   8.820   2.583
  551   1HB   PHE  70           HB2      PHE  70  -4.489   9.860   1.442
  552   2HB   PHE  70           HB1      PHE  70  -5.510  11.130   2.118
  553    HD1  PHE  70           HD1      PHE  70  -4.833  12.263   4.266
  554    HD2  PHE  70           HD2      PHE  70  -2.242   9.549   2.172
  555    HE1  PHE  70           HE1      PHE  70  -2.893  13.132   5.542
  556    HE2  PHE  70           HE2      PHE  70  -0.299  10.416   3.447
  557    HZ   PHE  70           HZ       PHE  70  -0.625  12.209   5.133
  558    H    GLN  71           HN       GLN  71  -4.246   9.125   5.362
  559    HA   GLN  71           HA       GLN  71  -2.468   6.958   4.497
  560   1HB   GLN  71           HB2      GLN  71  -2.807   8.539   7.050
  561   2HB   GLN  71           HB1      GLN  71  -1.772   7.111   6.999
  562   1HG   GLN  71           HG2      GLN  71  -0.874   8.354   4.790
  563   2HG   GLN  71           HG1      GLN  71  -1.402   9.766   5.707
  564   1HE2  GLN  71          HE22      GLN  71   1.545   7.418   7.382
  565   2HE2  GLN  71          HE21      GLN  71   0.358   6.681   6.419
  566    H    GLU  72           HN       GLU  72  -5.505   7.210   6.209
  567    HA   GLU  72           HA       GLU  72  -5.224   4.598   7.476
  568   1HB   GLU  72           HB2      GLU  72  -7.199   5.116   8.550
  569   2HB   GLU  72           HB1      GLU  72  -6.708   6.741   8.097
  570   1HG   GLU  72           HG2      GLU  72  -8.893   6.729   7.345
  571   2HG   GLU  72           HG1      GLU  72  -8.050   6.214   5.893
  572    H    PHE  73           HN       PHE  73  -6.770   5.927   4.599
  573    HA   PHE  73           HA       PHE  73  -7.966   3.355   3.871
  574   1HB   PHE  73           HB2      PHE  73  -9.211   4.687   2.535
  575   2HB   PHE  73           HB1      PHE  73  -8.277   6.072   3.078
  576    HD1  PHE  73           HD2      PHE  73  -6.414   6.942   1.742
  577    HD2  PHE  73           HD1      PHE  73  -8.726   3.576   0.412
  578    HE1  PHE  73           HE2      PHE  73  -5.454   7.182  -0.533
  579    HE2  PHE  73           HE1      PHE  73  -7.767   3.813  -1.863
  580    HZ   PHE  73           HZ       PHE  73  -6.130   5.617  -2.337
  581    H    MET  74           HN       MET  74  -4.970   5.051   3.335
  582    HA   MET  74           HA       MET  74  -4.133   3.392   1.094
  583   1HB   MET  74           HB2      MET  74  -3.069   5.643   2.614
  584   2HB   MET  74           HB1      MET  74  -1.828   4.438   2.308
  585   1HG   MET  74           HG2      MET  74  -3.522   5.913   0.280
  586   2HG   MET  74           HG1      MET  74  -1.769   5.940   0.444
  587   1HE   MET  74           HE1      MET  74  -0.304   4.431   0.121
  588   2HE   MET  74           HE3      MET  74  -0.579   2.686   0.015
  589   3HE   MET  74           HE2      MET  74  -0.293   3.625  -1.448
  590    H    ALA  75           HN       ALA  75  -3.415   3.514   4.581
  591    HA   ALA  75           HA       ALA  75  -1.699   1.178   4.516
  592   1HB   ALA  75           HB2      ALA  75  -3.192   2.548   6.779
  593   2HB   ALA  75           HB1      ALA  75  -2.071   1.204   7.015
  594   3HB   ALA  75           HB3      ALA  75  -1.487   2.736   6.364
  595    H    PHE  76           HN       PHE  76  -5.103   1.736   4.579
  596    HA   PHE  76           HA       PHE  76  -5.834  -0.902   5.601
  597   1HB   PHE  76           HB2      PHE  76  -7.211   1.536   4.652
  598   2HB   PHE  76           HB1      PHE  76  -8.054   0.033   4.292
  599    HD1  PHE  76           HD1      PHE  76  -5.822   0.767   7.184
  600    HD2  PHE  76           HD2      PHE  76  -9.842   0.046   5.855
  601    HE1  PHE  76           HE1      PHE  76  -6.579   0.633   9.543
  602    HE2  PHE  76           HE2      PHE  76 -10.600  -0.088   8.213
  603    HZ   PHE  76           HZ       PHE  76  -8.968   0.206  10.057
  604    H    VAL  77           HN       VAL  77  -5.466   0.664   2.464
  605    HA   VAL  77           HA       VAL  77  -6.542  -1.436   0.838
  606    HB   VAL  77           HB       VAL  77  -4.478   0.717   0.312
  607   1HG1  VAL  77          HG13      VAL  77  -5.248  -1.597  -1.292
  608   2HG1  VAL  77          HG12      VAL  77  -5.555  -0.075  -2.126
  609   3HG1  VAL  77          HG11      VAL  77  -3.934  -0.448  -1.541
  610   1HG2  VAL  77          HG23      VAL  77  -7.215   0.867   0.669
  611   2HG2  VAL  77          HG22      VAL  77  -6.244   2.042  -0.219
  612   3HG2  VAL  77          HG21      VAL  77  -7.066   0.743  -1.084
  613    H    SER  78           HN       SER  78  -3.473  -1.015   2.447
  614    HA   SER  78           HA       SER  78  -2.096  -3.055   0.873
  615   1HB   SER  78           HB2      SER  78  -0.589  -2.804   3.120
  616   2HB   SER  78           HB1      SER  78  -0.475  -1.712   1.743
  617    HG   SER  78           HG       SER  78  -1.291  -1.209   4.250
  618    H    MET  79           HN       MET  79  -2.830  -2.971   4.379
  619    HA   MET  79           HA       MET  79  -2.375  -5.628   4.983
  620   1HB   MET  79           HB2      MET  79  -4.726  -5.175   6.400
  621   2HB   MET  79           HB1      MET  79  -3.098  -4.800   6.952
  622   1HG   MET  79           HG2      MET  79  -3.268  -2.537   6.234
  623   2HG   MET  79           HG1      MET  79  -4.713  -2.869   5.280
  624   1HE   MET  79           HE3      MET  79  -2.943  -2.456   8.339
  625   2HE   MET  79           HE2      MET  79  -4.080  -1.826   9.530
  626   3HE   MET  79           HE1      MET  79  -3.832  -3.566   9.392
  627    H    VAL  80           HN       VAL  80  -5.157  -4.357   3.224
  628    HA   VAL  80           HA       VAL  80  -6.555  -6.917   3.303
  629    HB   VAL  80           HB       VAL  80  -8.086  -5.829   1.669
  630   1HG1  VAL  80          HG12      VAL  80  -8.342  -5.597   4.145
  631   2HG1  VAL  80          HG11      VAL  80  -7.420  -4.096   4.062
  632   3HG1  VAL  80          HG13      VAL  80  -8.984  -4.216   3.256
  633   1HG2  VAL  80          HG22      VAL  80  -5.861  -3.882   1.608
  634   2HG2  VAL  80          HG21      VAL  80  -7.060  -4.259   0.374
  635   3HG2  VAL  80          HG23      VAL  80  -7.472  -3.176   1.703
  636    H    THR  81           HN       THR  81  -4.733  -5.105   0.811
  637    HA   THR  81           HA       THR  81  -4.985  -7.296  -1.106
  638    HB   THR  81           HB       THR  81  -2.849  -5.218  -1.379
  639    HG1  THR  81           HG1      THR  81  -5.534  -4.728  -1.014
  640   1HG2  THR  81          HG23      THR  81  -3.845  -7.133  -3.029
  641   2HG2  THR  81          HG22      THR  81  -4.855  -5.761  -3.484
  642   3HG2  THR  81          HG21      THR  81  -3.100  -5.642  -3.605
  643    H    THR  82           HN       THR  82  -3.321  -7.086   1.702
  644    HA   THR  82           HA       THR  82  -1.209  -8.939   0.701
  645    HB   THR  82           HB       THR  82  -0.339  -7.318   2.969
  646    HG1  THR  82           HG1      THR  82   0.026  -5.561   1.223
  647   1HG2  THR  82          HG23      THR  82   0.686  -8.095   0.247
  648   2HG2  THR  82          HG22      THR  82   1.552  -6.921   1.239
  649   3HG2  THR  82          HG21      THR  82   1.298  -8.561   1.833
  650    H    ALA  83           HN       ALA  83  -3.855  -8.663   2.565
  651    HA   ALA  83           HA       ALA  83  -3.252  -9.532   5.149
  652   1HB   ALA  83           HB1      ALA  83  -5.553  -9.067   4.368
  653   2HB   ALA  83           HB3      ALA  83  -5.512 -10.535   3.389
  654   3HB   ALA  83           HB2      ALA  83  -5.453 -10.645   5.148
  655    H    CYS  84           HN       CYS  84  -4.276 -11.870   2.637
  656    HA   CYS  84           HA       CYS  84  -2.001 -13.537   2.707
  657   1HB   CYS  84           HB2      CYS  84  -3.498 -13.642   5.143
  658   2HB   CYS  84           HB1      CYS  84  -3.708 -15.180   4.304
  659    HG   CYS  84           HG       CYS  84  -1.189 -14.329   5.689
  660    H    HIS  85           HN       HIS  85  -3.923 -12.778   0.793
  661    HA   HIS  85           HA       HIS  85  -5.821 -14.958   0.390
  662   1HB   HIS  85           HB2      HIS  85  -5.952 -13.860  -1.964
  663   2HB   HIS  85           HB1      HIS  85  -6.531 -12.932  -0.579
  664    HD1  HIS  85           HD1      HIS  85  -5.934 -10.592  -1.375
  665    HD2  HIS  85           HD2      HIS  85  -2.695 -13.215  -1.555
  666    HE1  HIS  85           HE1      HIS  85  -3.897  -9.182  -1.896
  667    H    GLU  86           HN       GLU  86  -5.582 -15.708  -2.220
  668    HA   GLU  86           HA       GLU  86  -3.074 -17.295  -2.155
  669   1HB   GLU  86           HB2      GLU  86  -5.284 -18.428  -2.508
  670   2HB   GLU  86           HB1      GLU  86  -5.453 -17.538  -4.021
  671   1HG   GLU  86           HG2      GLU  86  -3.505 -18.598  -4.957
  672   2HG   GLU  86           HG1      GLU  86  -3.074 -19.309  -3.401
  673    H    PHE  87           HN       PHE  87  -2.356 -14.787  -2.708
  674    HA   PHE  87           HA       PHE  87  -2.481 -14.225  -5.577
  675   1HB   PHE  87           HB2      PHE  87  -1.180 -12.255  -5.064
  676   2HB   PHE  87           HB1      PHE  87  -2.427 -12.425  -3.834
  677    HD1  PHE  87           HD2      PHE  87  -0.480 -15.000  -2.848
  678    HD2  PHE  87           HD1      PHE  87  -0.188 -10.727  -3.219
  679    HE1  PHE  87           HE2      PHE  87   1.257 -14.965  -1.090
  680    HE2  PHE  87           HE1      PHE  87   1.551 -10.697  -1.455
  681    HZ   PHE  87           HZ       PHE  87   2.275 -12.816  -0.392
  682    H    PHE  88           HN       PHE  88  -0.007 -13.433  -6.323
  683    HA   PHE  88           HA       PHE  88   1.989 -14.298  -7.210
  684   1HB   PHE  88           HB2      PHE  88   2.014 -15.653  -4.497
  685   2HB   PHE  88           HB1      PHE  88   3.391 -15.586  -5.598
  686    HD1  PHE  88           HD1      PHE  88   2.395 -12.658  -6.551
  687    HD2  PHE  88           HD2      PHE  88   3.409 -14.467  -2.789
  688    HE1  PHE  88           HE1      PHE  88   3.006 -10.434  -5.648
  689    HE2  PHE  88           HE2      PHE  88   4.017 -12.238  -1.886
  690    HZ   PHE  88           HZ       PHE  88   3.816 -10.224  -3.315
  691    H    GLU  89           HN       GLU  89  -0.576 -15.779  -7.603
  692    HA   GLU  89           HA       GLU  89   0.542 -18.525  -7.986
  693   1HB   GLU  89           HB2      GLU  89  -1.658 -18.030  -6.609
  694   2HB   GLU  89           HB1      GLU  89  -2.387 -17.918  -8.211
  695   1HG   GLU  89           HG2      GLU  89  -2.556 -20.219  -7.369
  696   2HG   GLU  89           HG1      GLU  89  -1.479 -20.160  -8.766
  697    H    HIS  90           HN       HIS  90  -2.056 -16.649  -9.542
  698    HA   HIS  90           HA       HIS  90  -0.613 -16.671 -12.102
  699   1HB   HIS  90           HB2      HIS  90  -2.198 -17.993 -13.315
  700   2HB   HIS  90           HB1      HIS  90  -1.785 -18.931 -11.881
  701    HD1  HIS  90           HD1      HIS  90  -4.638 -18.332 -13.718
  702    HD2  HIS  90           HD2      HIS  90  -3.816 -17.778  -9.669
  703    HE1  HIS  90           HE1      HIS  90  -6.877 -18.274 -12.532
  704    H    GLU  91           HN       GLU  91  -1.921 -14.780 -10.122
  705    HA   GLU  91           HA       GLU  91  -3.972 -13.557 -11.910
  706   1HB   GLU  91           HB2      GLU  91  -3.448 -13.481  -8.967
  707   2HB   GLU  91           HB1      GLU  91  -4.187 -12.063  -9.712
  708   1HG   GLU  91           HG2      GLU  91  -6.171 -13.123  -9.688
  709   2HG   GLU  91           HG1      GLU  91  -5.507 -14.334 -10.787
  710   1H    MET   0           HT3      MET   0  -8.951  -3.706 -14.226
  711   2H    MET   0           HT2      MET   0 -10.337  -4.466 -14.850
  712   3H    MET   0           HT1      MET   0  -8.857  -4.577 -15.679
  713    HA   MET   0           HA       MET   0  -8.925  -2.395 -16.407
  714   1HB   MET   0           HB2      MET   0 -11.464  -3.905 -16.512
  715   2HB   MET   0           HB1      MET   0 -11.611  -2.185 -16.868
  716   1HG   MET   0           HG2      MET   0  -9.365  -2.829 -18.293
  717   2HG   MET   0           HG1      MET   0 -10.293  -4.324 -18.424
  718   1HE   MET   0           HE2      MET   0 -11.065  -4.747 -20.189
  719   2HE   MET   0           HE1      MET   0 -12.781  -4.345 -20.148
  720   3HE   MET   0           HE3      MET   0 -11.762  -3.762 -21.472
  721    H    SER   1           HN       SER   1  -8.614  -1.879 -13.761
  722    HA   SER   1           HA       SER   1 -10.552   0.341 -13.328
  723   1HB   SER   1           HB2      SER   1 -11.261  -0.405 -11.298
  724   2HB   SER   1           HB1      SER   1 -10.732  -1.981 -11.880
  725    HG   SER   1           HG       SER   1  -9.336  -0.123 -10.260
  726    H    GLU   2           HN       GLU   2  -9.642   1.782 -11.447
  727    HA   GLU   2           HA       GLU   2  -6.910   2.483 -12.193
  728   1HB   GLU   2           HB2      GLU   2  -9.000   3.965 -11.342
  729   2HB   GLU   2           HB1      GLU   2  -8.178   3.723  -9.801
  730   1HG   GLU   2           HG2      GLU   2  -7.383   5.771 -10.954
  731   2HG   GLU   2           HG1      GLU   2  -6.089   4.588 -10.750
  732    H    LEU   3           HN       LEU   3  -8.406   1.757  -9.022
  733    HA   LEU   3           HA       LEU   3  -5.931   1.383  -7.652
  734   1HB   LEU   3           HB2      LEU   3  -8.239   1.708  -6.628
  735   2HB   LEU   3           HB1      LEU   3  -8.542   0.012  -6.989
  736    HG   LEU   3           HG       LEU   3  -6.158  -0.240  -5.767
  737   1HD1  LEU   3          HD11      LEU   3  -6.427   2.389  -5.421
  738   2HD1  LEU   3          HD13      LEU   3  -7.401   1.869  -4.046
  739   3HD1  LEU   3          HD12      LEU   3  -5.713   1.372  -4.169
  740   1HD2  LEU   3          HD23      LEU   3  -8.992  -0.288  -4.846
  741   2HD2  LEU   3          HD22      LEU   3  -7.780  -1.568  -4.832
  742   3HD2  LEU   3          HD21      LEU   3  -7.762  -0.326  -3.582
  743    H    GLU   4           HN       GLU   4  -8.217  -1.060  -8.893
  744    HA   GLU   4           HA       GLU   4  -6.800  -3.366  -8.236
  745   1HB   GLU   4           HB2      GLU   4  -8.995  -3.484  -9.286
  746   2HB   GLU   4           HB1      GLU   4  -8.351  -2.811 -10.783
  747   1HG   GLU   4           HG2      GLU   4  -6.833  -5.139  -9.878
  748   2HG   GLU   4           HG1      GLU   4  -8.532  -5.518 -10.166
  749    H    LYS   5           HN       LYS   5  -6.152  -1.155 -10.935
  750    HA   LYS   5           HA       LYS   5  -4.072  -2.899 -12.030
  751   1HB   LYS   5           HB2      LYS   5  -5.543  -0.722 -12.985
  752   2HB   LYS   5           HB1      LYS   5  -3.894  -0.109 -12.846
  753   1HG   LYS   5           HG2      LYS   5  -4.089  -1.086 -15.036
  754   2HG   LYS   5           HG1      LYS   5  -3.123  -2.198 -14.064
  755   1HD   LYS   5           HD2      LYS   5  -4.638  -3.688 -14.991
  756   2HD   LYS   5           HD1      LYS   5  -5.502  -3.247 -13.516
  757   1HE   LYS   5           HE2      LYS   5  -7.158  -2.935 -15.128
  758   2HE   LYS   5           HE1      LYS   5  -6.479  -1.311 -15.007
  759   1HZ   LYS   5           HZ3      LYS   5  -4.904  -2.633 -16.833
  760   2HZ   LYS   5           HZ2      LYS   5  -6.492  -3.094 -17.222
  761   3HZ   LYS   5           HZ1      LYS   5  -6.071  -1.449 -17.168
  762    H    ALA   6           HN       ALA   6  -4.219  -0.108  -9.877
  763    HA   ALA   6           HA       ALA   6  -1.314   0.233  -9.831
  764   1HB   ALA   6           HB2      ALA   6  -3.115   2.040  -9.407
  765   2HB   ALA   6           HB1      ALA   6  -3.251   1.338  -7.796
  766   3HB   ALA   6           HB3      ALA   6  -1.717   2.023  -8.334
  767    H    MET   7           HN       MET   7  -3.583  -0.453  -7.159
  768    HA   MET   7           HA       MET   7  -1.789  -1.382  -5.274
  769   1HB   MET   7           HB2      MET   7  -4.054  -1.193  -4.595
  770   2HB   MET   7           HB1      MET   7  -4.620  -2.228  -5.909
  771   1HG   MET   7           HG2      MET   7  -4.520  -3.265  -3.543
  772   2HG   MET   7           HG1      MET   7  -3.815  -4.194  -4.864
  773   1HE   MET   7           HE2      MET   7  -3.701  -2.471  -1.810
  774   2HE   MET   7           HE1      MET   7  -2.121  -2.740  -1.082
  775   3HE   MET   7           HE3      MET   7  -2.400  -1.319  -2.098
  776    H    VAL   8           HN       VAL   8  -3.438  -3.399  -7.717
  777    HA   VAL   8           HA       VAL   8  -2.061  -5.809  -7.016
  778    HB   VAL   8           HB       VAL   8  -3.154  -5.079  -9.745
  779   1HG1  VAL   8          HG12      VAL   8  -2.412  -7.626  -8.323
  780   2HG1  VAL   8          HG11      VAL   8  -3.645  -7.643  -9.584
  781   3HG1  VAL   8          HG13      VAL   8  -2.005  -7.115  -9.962
  782   1HG2  VAL   8          HG23      VAL   8  -4.787  -4.678  -7.875
  783   2HG2  VAL   8          HG22      VAL   8  -5.286  -5.967  -8.970
  784   3HG2  VAL   8          HG21      VAL   8  -4.590  -6.365  -7.400
  785    H    ALA   9           HN       ALA   9  -1.211  -3.134  -9.144
  786    HA   ALA   9           HA       ALA   9   0.964  -4.431 -10.499
  787   1HB   ALA   9           HB3      ALA   9   0.289  -1.546  -9.922
  788   2HB   ALA   9           HB2      ALA   9   1.786  -1.989 -10.745
  789   3HB   ALA   9           HB1      ALA   9   0.230  -2.401 -11.464
  790    H    LEU  10           HN       LEU  10   0.708  -2.748  -7.405
  791    HA   LEU  10           HA       LEU  10   3.508  -2.531  -6.852
  792   1HB   LEU  10           HB2      LEU  10   1.204  -1.755  -5.575
  793   2HB   LEU  10           HB1      LEU  10   1.741  -3.085  -4.549
  794    HG   LEU  10           HG       LEU  10   3.711  -1.002  -5.444
  795   1HD1  LEU  10          HD13      LEU  10   1.620   0.071  -4.413
  796   2HD1  LEU  10          HD12      LEU  10   2.066  -0.755  -2.920
  797   3HD1  LEU  10          HD11      LEU  10   3.156   0.436  -3.628
  798   1HD2  LEU  10          HD21      LEU  10   3.524  -3.208  -3.501
  799   2HD2  LEU  10          HD23      LEU  10   4.952  -2.489  -4.248
  800   3HD2  LEU  10          HD22      LEU  10   4.216  -1.728  -2.835
  801    H    ILE  11           HN       ILE  11   1.179  -4.898  -5.510
  802    HA   ILE  11           HA       ILE  11   2.981  -6.664  -4.341
  803    HB   ILE  11           HB       ILE  11   0.408  -7.199  -5.841
  804   1HG1  ILE  11          HG12      ILE  11   1.101  -7.271  -2.887
  805   2HG1  ILE  11          HG11      ILE  11   0.356  -5.893  -3.700
  806   1HG2  ILE  11          HG23      ILE  11   2.214  -9.106  -4.342
  807   2HG2  ILE  11          HG22      ILE  11   0.499  -9.429  -4.592
  808   3HG2  ILE  11          HG21      ILE  11   1.579  -9.276  -5.978
  809   1HD1  ILE  11          HD11      ILE  11  -1.317  -7.848  -4.520
  810   2HD1  ILE  11          HD13      ILE  11  -0.820  -8.523  -2.969
  811   3HD1  ILE  11          HD12      ILE  11  -1.577  -6.931  -3.036
  812    H    ASP  12           HN       ASP  12   2.345  -6.129  -7.737
  813    HA   ASP  12           HA       ASP  12   3.570  -8.490  -8.794
  814   1HB   ASP  12           HB2      ASP  12   2.209  -6.568  -9.976
  815   2HB   ASP  12           HB1      ASP  12   3.799  -5.831 -10.180
  816    H    VAL  13           HN       VAL  13   4.923  -5.216  -8.246
  817    HA   VAL  13           HA       VAL  13   7.552  -5.628  -9.046
  818    HB   VAL  13           HB       VAL  13   6.450  -4.094  -6.680
  819   1HG1  VAL  13          HG13      VAL  13   8.803  -4.784  -6.222
  820   2HG1  VAL  13          HG12      VAL  13   9.292  -4.060  -7.755
  821   3HG1  VAL  13          HG11      VAL  13   8.653  -3.043  -6.461
  822   1HG2  VAL  13          HG21      VAL  13   6.714  -3.647  -9.501
  823   2HG2  VAL  13          HG23      VAL  13   6.032  -2.571  -8.280
  824   3HG2  VAL  13          HG22      VAL  13   7.756  -2.507  -8.650
  825    H    PHE  14           HN       PHE  14   5.963  -6.807  -6.125
  826    HA   PHE  14           HA       PHE  14   8.296  -7.742  -4.762
  827   1HB   PHE  14           HB2      PHE  14   5.839  -7.580  -3.926
  828   2HB   PHE  14           HB1      PHE  14   5.640  -9.168  -4.665
  829    HD1  PHE  14           HD1      PHE  14   8.173  -7.392  -2.529
  830    HD2  PHE  14           HD2      PHE  14   5.953 -10.995  -3.270
  831    HE1  PHE  14           HE1      PHE  14   9.233  -8.453  -0.553
  832    HE2  PHE  14           HE2      PHE  14   7.013 -12.055  -1.295
  833    HZ   PHE  14           HZ       PHE  14   8.652 -10.784   0.064
  834    H    HIS  15           HN       HIS  15   6.056  -9.440  -6.972
  835    HA   HIS  15           HA       HIS  15   7.719 -11.832  -7.042
  836   1HB   HIS  15           HB2      HIS  15   5.464 -12.295  -7.485
  837   2HB   HIS  15           HB1      HIS  15   5.267 -10.867  -8.499
  838    HD1  HIS  15           HD1      HIS  15   5.224 -11.359 -10.938
  839    HD2  HIS  15           HD2      HIS  15   7.397 -14.240  -8.850
  840    HE1  HIS  15           HE1      HIS  15   5.971 -13.073 -12.648
  841    H    GLN  16           HN       GLN  16   8.083  -8.785  -8.370
  842    HA   GLN  16           HA       GLN  16   9.096  -9.510 -10.991
  843   1HB   GLN  16           HB2      GLN  16   8.467  -7.132  -9.628
  844   2HB   GLN  16           HB1      GLN  16  10.199  -7.040  -9.951
  845   1HG   GLN  16           HG2      GLN  16   9.560  -6.319 -12.006
  846   2HG   GLN  16           HG1      GLN  16   9.251  -8.025 -12.328
  847   1HE2  GLN  16          HE22      GLN  16   6.106  -6.199 -13.130
  848   2HE2  GLN  16          HE21      GLN  16   7.690  -6.220 -13.743
  849    H    TYR  17           HN       TYR  17  10.543  -8.951  -7.812
  850    HA   TYR  17           HA       TYR  17  12.907 -10.481  -8.601
  851   1HB   TYR  17           HB2      TYR  17  14.446  -8.556  -7.911
  852   2HB   TYR  17           HB1      TYR  17  13.656  -8.389  -9.479
  853    HD1  TYR  17           HD1      TYR  17  13.236  -7.496  -5.866
  854    HD2  TYR  17           HD2      TYR  17  12.355  -6.479  -9.948
  855    HE1  TYR  17           HE1      TYR  17  12.222  -5.365  -5.115
  856    HE2  TYR  17           HE2      TYR  17  11.338  -4.347  -9.191
  857    HH   TYR  17           HH       TYR  17  11.284  -2.879  -7.385
  858    H    SER  18           HN       SER  18  10.774 -10.630  -6.586
  859    HA   SER  18           HA       SER  18  11.631  -9.774  -4.017
  860   1HB   SER  18           HB2      SER  18   9.500 -10.588  -3.832
  861   2HB   SER  18           HB1      SER  18   9.752 -11.807  -5.078
  862    HG   SER  18           HG       SER  18   9.759 -12.150  -2.481
  863    H    GLY  19           HN       GLY  19  12.402 -12.698  -5.875
  864   1HA   GLY  19           HA2      GLY  19  14.974 -13.046  -4.790
  865   2HA   GLY  19           HA1      GLY  19  13.879 -13.998  -3.784
  866    H    ARG  20           HN       ARG  20  14.614 -13.428  -7.239
  867    HA   ARG  20           HA       ARG  20  13.400 -15.494  -8.532
  868   1HB   ARG  20           HB2      ARG  20  16.373 -14.990  -8.849
  869   2HB   ARG  20           HB1      ARG  20  15.270 -15.632 -10.065
  870   1HG   ARG  20           HG2      ARG  20  13.976 -13.458  -9.896
  871   2HG   ARG  20           HG1      ARG  20  15.297 -12.835  -8.905
  872   1HD   ARG  20           HD2      ARG  20  15.276 -13.521 -11.821
  873   2HD   ARG  20           HD1      ARG  20  16.008 -12.142 -10.999
  874    HE   ARG  20           HE       ARG  20  17.166 -14.898 -10.829
  875   1HH1  ARG  20          HH11      ARG  20  17.619 -12.106 -12.524
  876   2HH1  ARG  20          HH12      ARG  20  19.230 -11.789 -11.975
  877   1HH2  ARG  20          HH21      ARG  20  19.153 -14.225  -9.509
  878   2HH2  ARG  20          HH22      ARG  20  20.097 -12.986 -10.268
  879    H    GLU  21           HN       GLU  21  16.284 -15.874  -6.496
  880    HA   GLU  21           HA       GLU  21  15.726 -18.815  -6.454
  881   1HB   GLU  21           HB2      GLU  21  18.036 -17.538  -7.430
  882   2HB   GLU  21           HB1      GLU  21  18.488 -18.165  -5.844
  883   1HG   GLU  21           HG2      GLU  21  18.163 -20.364  -6.463
  884   2HG   GLU  21           HG1      GLU  21  16.921 -19.958  -7.647
  885    H    GLY  22           HN       GLY  22  17.739 -19.345  -4.476
  886   1HA   GLY  22           HA2      GLY  22  17.909 -19.431  -2.137
  887   2HA   GLY  22           HA1      GLY  22  17.623 -17.690  -2.184
  888    H    ASP  23           HN       ASP  23  15.987 -17.229  -0.784
  889    HA   ASP  23           HA       ASP  23  13.944 -19.151  -0.080
  890   1HB   ASP  23           HB2      ASP  23  14.579 -16.327   0.594
  891   2HB   ASP  23           HB1      ASP  23  12.886 -16.800   0.759
  892    H    LYS  24           HN       LYS  24  11.533 -17.950  -0.165
  893    HA   LYS  24           HA       LYS  24  11.125 -17.169  -3.017
  894   1HB   LYS  24           HB2      LYS  24  10.506 -19.491  -2.927
  895   2HB   LYS  24           HB1      LYS  24   9.608 -19.253  -1.427
  896   1HG   LYS  24           HG2      LYS  24   7.777 -18.457  -2.507
  897   2HG   LYS  24           HG1      LYS  24   8.745 -17.496  -3.627
  898   1HD   LYS  24           HD2      LYS  24   9.348 -20.066  -4.412
  899   2HD   LYS  24           HD1      LYS  24   7.650 -20.208  -3.953
  900   1HE   LYS  24           HE2      LYS  24   6.991 -18.498  -5.481
  901   2HE   LYS  24           HE1      LYS  24   8.660 -17.990  -5.742
  902   1HZ   LYS  24           HZ1      LYS  24   7.701 -20.708  -6.420
  903   2HZ   LYS  24           HZ3      LYS  24   7.640 -19.422  -7.524
  904   3HZ   LYS  24           HZ2      LYS  24   9.138 -19.949  -6.918
  905    H    HIS  25           HN       HIS  25   9.890 -15.365  -3.199
  906    HA   HIS  25           HA       HIS  25   8.466 -13.599  -2.633
  907   1HB   HIS  25           HB2      HIS  25   7.347 -15.865  -0.999
  908   2HB   HIS  25           HB1      HIS  25   6.636 -14.252  -0.927
  909    HD1  HIS  25           HD1      HIS  25   6.903 -13.431  -3.882
  910    HD2  HIS  25           HD2      HIS  25   5.533 -17.174  -2.655
  911    HE1  HIS  25           HE1      HIS  25   5.547 -14.364  -5.808
  912    H    LYS  26           HN       LYS  26  11.014 -14.100  -1.122
  913    HA   LYS  26           HA       LYS  26  10.290 -12.561   1.347
  914   1HB   LYS  26           HB2      LYS  26  12.753 -14.293   1.131
  915   2HB   LYS  26           HB1      LYS  26  11.940 -13.705   2.584
  916   1HG   LYS  26           HG2      LYS  26  10.859 -15.764   0.639
  917   2HG   LYS  26           HG1      LYS  26  11.446 -16.083   2.269
  918   1HD   LYS  26           HD2      LYS  26   9.511 -13.987   2.435
  919   2HD   LYS  26           HD1      LYS  26   8.817 -15.292   1.471
  920   1HE   LYS  26           HE2      LYS  26   9.412 -16.912   3.240
  921   2HE   LYS  26           HE1      LYS  26  10.087 -15.600   4.207
  922   1HZ   LYS  26           HZ3      LYS  26   7.303 -15.486   3.234
  923   2HZ   LYS  26           HZ2      LYS  26   7.693 -16.328   4.658
  924   3HZ   LYS  26           HZ1      LYS  26   8.007 -14.662   4.538
  925    H    LEU  27           HN       LEU  27  11.180 -10.548   1.381
  926    HA   LEU  27           HA       LEU  27  13.307  -9.925  -0.599
  927   1HB   LEU  27           HB2      LEU  27  11.031  -8.554   0.101
  928   2HB   LEU  27           HB1      LEU  27  12.254  -7.734   1.071
  929    HG   LEU  27           HG       LEU  27  13.658  -7.681  -1.106
  930   1HD1  LEU  27          HD11      LEU  27  11.103  -8.826  -2.008
  931   2HD1  LEU  27          HD13      LEU  27  11.644  -7.449  -2.968
  932   3HD1  LEU  27          HD12      LEU  27  12.688  -8.860  -2.782
  933   1HD2  LEU  27          HD22      LEU  27  11.098  -6.062  -0.879
  934   2HD2  LEU  27          HD21      LEU  27  12.626  -5.685  -0.084
  935   3HD2  LEU  27          HD23      LEU  27  12.506  -5.614  -1.842
  936    H    LYS  28           HN       LYS  28  14.359  -7.652   0.823
  937    HA   LYS  28           HA       LYS  28  15.432  -8.737   3.349
  938   1HB   LYS  28           HB2      LYS  28  16.854  -8.922   0.856
  939   2HB   LYS  28           HB1      LYS  28  17.701  -7.801   1.925
  940   1HG   LYS  28           HG2      LYS  28  18.159  -9.422   3.490
  941   2HG   LYS  28           HG1      LYS  28  16.691 -10.332   3.130
  942   1HD   LYS  28           HD2      LYS  28  18.334 -11.722   2.221
  943   2HD   LYS  28           HD1      LYS  28  17.864 -10.765   0.817
  944   1HE   LYS  28           HE2      LYS  28  19.806  -9.491   0.860
  945   2HE   LYS  28           HE1      LYS  28  20.055  -9.744   2.586
  946   1HZ   LYS  28           HZ2      LYS  28  20.130 -12.118   0.909
  947   2HZ   LYS  28           HZ1      LYS  28  21.424 -11.033   0.721
  948   3HZ   LYS  28           HZ3      LYS  28  21.091 -11.700   2.246
  949    H    LYS  29           HN       LYS  29  17.368  -6.960   3.932
  950    HA   LYS  29           HA       LYS  29  15.868  -4.459   4.205
  951   1HB   LYS  29           HB2      LYS  29  18.732  -4.986   5.035
  952   2HB   LYS  29           HB1      LYS  29  17.630  -3.767   5.679
  953   1HG   LYS  29           HG2      LYS  29  17.240  -6.767   5.907
  954   2HG   LYS  29           HG1      LYS  29  17.816  -5.714   7.200
  955   1HD   LYS  29           HD2      LYS  29  15.664  -4.369   6.871
  956   2HD   LYS  29           HD1      LYS  29  15.095  -5.715   5.885
  957   1HE   LYS  29           HE2      LYS  29  14.710  -7.018   7.696
  958   2HE   LYS  29           HE1      LYS  29  16.250  -6.581   8.436
  959   1HZ   LYS  29           HZ3      LYS  29  14.941  -4.299   8.707
  960   2HZ   LYS  29           HZ2      LYS  29  13.623  -5.370   8.755
  961   3HZ   LYS  29           HZ1      LYS  29  14.892  -5.528   9.875
  962    H    SER  30           HN       SER  30  18.536  -5.666   2.256
  963    HA   SER  30           HA       SER  30  19.286  -2.993   1.329
  964   1HB   SER  30           HB2      SER  30  20.701  -4.291  -0.314
  965   2HB   SER  30           HB1      SER  30  21.028  -4.670   1.374
  966    HG   SER  30           HG       SER  30  20.307  -6.317  -0.554
  967    H    GLU  31           HN       GLU  31  17.318  -5.689   0.142
  968    HA   GLU  31           HA       GLU  31  16.820  -4.367  -2.422
  969   1HB   GLU  31           HB2      GLU  31  16.794  -6.902  -2.009
  970   2HB   GLU  31           HB1      GLU  31  15.230  -6.649  -1.230
  971   1HG   GLU  31           HG2      GLU  31  14.173  -6.358  -3.207
  972   2HG   GLU  31           HG1      GLU  31  15.441  -5.296  -3.820
  973    H    LEU  32           HN       LEU  32  15.413  -4.446   0.757
  974    HA   LEU  32           HA       LEU  32  12.842  -3.332  -0.101
  975   1HB   LEU  32           HB2      LEU  32  12.879  -4.674   1.927
  976   2HB   LEU  32           HB1      LEU  32  14.118  -3.637   2.634
  977    HG   LEU  32           HG       LEU  32  12.554  -1.725   2.578
  978   1HD1  LEU  32          HD11      LEU  32  10.886  -3.740   1.137
  979   2HD1  LEU  32          HD13      LEU  32  10.060  -2.583   2.183
  980   3HD1  LEU  32          HD12      LEU  32  11.058  -2.009   0.845
  981   1HD2  LEU  32          HD22      LEU  32  11.438  -4.228   3.886
  982   2HD2  LEU  32          HD21      LEU  32  12.611  -3.119   4.596
  983   3HD2  LEU  32          HD23      LEU  32  10.958  -2.579   4.294
  984    H    LYS  33           HN       LYS  33  15.834  -2.160   1.417
  985    HA   LYS  33           HA       LYS  33  15.022   0.548   1.791
  986   1HB   LYS  33           HB2      LYS  33  17.233  -0.802   2.452
  987   2HB   LYS  33           HB1      LYS  33  17.831  -0.060   0.972
  988   1HG   LYS  33           HG2      LYS  33  16.341   1.822   2.649
  989   2HG   LYS  33           HG1      LYS  33  17.761   1.161   3.462
  990   1HD   LYS  33           HD2      LYS  33  18.031   2.079   0.623
  991   2HD   LYS  33           HD1      LYS  33  17.985   3.290   1.905
  992   1HE   LYS  33           HE2      LYS  33  19.869   2.249   3.030
  993   2HE   LYS  33           HE1      LYS  33  19.862   0.910   1.882
  994   1HZ   LYS  33           HZ2      LYS  33  20.360   2.472   0.108
  995   2HZ   LYS  33           HZ1      LYS  33  20.370   3.760   1.217
  996   3HZ   LYS  33           HZ3      LYS  33  21.548   2.543   1.320
  997    H    GLU  34           HN       GLU  34  16.306  -1.212  -0.979
  998    HA   GLU  34           HA       GLU  34  16.490   1.202  -2.625
  999   1HB   GLU  34           HB2      GLU  34  17.546  -0.159  -4.165
 1000   2HB   GLU  34           HB1      GLU  34  17.766  -1.173  -2.742
 1001   1HG   GLU  34           HG2      GLU  34  16.872  -2.736  -4.166
 1002   2HG   GLU  34           HG1      GLU  34  15.380  -2.105  -3.479
 1003    H    LEU  35           HN       LEU  35  14.261  -1.400  -1.996
 1004    HA   LEU  35           HA       LEU  35  12.461  -1.145  -4.147
 1005   1HB   LEU  35           HB2      LEU  35  12.492  -2.684  -1.956
 1006   2HB   LEU  35           HB1      LEU  35  11.360  -1.458  -1.380
 1007    HG   LEU  35           HG       LEU  35  10.029  -3.153  -2.423
 1008   1HD1  LEU  35          HD12      LEU  35  10.469  -0.886  -4.391
 1009   2HD1  LEU  35          HD11      LEU  35   9.056  -1.940  -4.350
 1010   3HD1  LEU  35          HD13      LEU  35   9.380  -0.848  -3.003
 1011   1HD2  LEU  35          HD22      LEU  35  11.931  -4.197  -3.666
 1012   2HD2  LEU  35          HD21      LEU  35  10.495  -3.997  -4.668
 1013   3HD2  LEU  35          HD23      LEU  35  11.849  -2.880  -4.835
 1014    H    ILE  36           HN       ILE  36  12.514   0.610  -1.051
 1015    HA   ILE  36           HA       ILE  36  10.346   2.377  -1.868
 1016    HB   ILE  36           HB       ILE  36  12.091   3.137   0.406
 1017   1HG1  ILE  36          HG12      ILE  36  10.624   0.507   0.211
 1018   2HG1  ILE  36          HG11      ILE  36  12.232   0.826   0.849
 1019   1HG2  ILE  36          HG23      ILE  36   9.967   4.289  -0.119
 1020   2HG2  ILE  36          HG22      ILE  36   9.099   2.762   0.055
 1021   3HG2  ILE  36          HG21      ILE  36   9.883   3.495   1.455
 1022   1HD1  ILE  36          HD12      ILE  36  11.218   2.073   2.743
 1023   2HD1  ILE  36          HD11      ILE  36   9.615   1.682   2.123
 1024   3HD1  ILE  36          HD13      ILE  36  10.678   0.395   2.695
 1025    H    ASN  37           HN       ASN  37  13.801   2.914  -1.125
 1026    HA   ASN  37           HA       ASN  37  13.747   5.633  -2.049
 1027   1HB   ASN  37           HB2      ASN  37  15.445   4.354  -0.492
 1028   2HB   ASN  37           HB1      ASN  37  16.283   4.047  -2.015
 1029   1HD2  ASN  37          HD22      ASN  37  17.828   7.200  -1.597
 1030   2HD2  ASN  37          HD21      ASN  37  18.042   5.522  -1.733
 1031    H    ASN  38           HN       ASN  38  13.496   2.887  -3.920
 1032    HA   ASN  38           HA       ASN  38  15.111   4.070  -6.132
 1033   1HB   ASN  38           HB2      ASN  38  15.510   1.682  -5.648
 1034   2HB   ASN  38           HB1      ASN  38  13.807   1.340  -5.951
 1035   1HD2  ASN  38          HD22      ASN  38  14.098   1.741  -9.505
 1036   2HD2  ASN  38          HD21      ASN  38  13.003   1.840  -8.211
 1037    H    GLU  39           HN       GLU  39  11.793   3.174  -5.273
 1038    HA   GLU  39           HA       GLU  39  10.933   4.330  -7.896
 1039   1HB   GLU  39           HB2      GLU  39   9.253   2.565  -6.120
 1040   2HB   GLU  39           HB1      GLU  39   9.019   2.934  -7.825
 1041   1HG   GLU  39           HG2      GLU  39  11.585   1.627  -7.005
 1042   2HG   GLU  39           HG1      GLU  39  10.130   0.636  -7.073
 1043    H    LEU  40           HN       LEU  40  10.594   4.546  -4.437
 1044    HA   LEU  40           HA       LEU  40   8.280   6.320  -4.505
 1045   1HB   LEU  40           HB2      LEU  40  10.255   5.691  -2.283
 1046   2HB   LEU  40           HB1      LEU  40   8.808   6.655  -2.089
 1047    HG   LEU  40           HG       LEU  40   8.571   4.245  -1.369
 1048   1HD1  LEU  40          HD11      LEU  40   6.655   5.701  -2.000
 1049   2HD1  LEU  40          HD13      LEU  40   6.783   5.094  -3.651
 1050   3HD1  LEU  40          HD12      LEU  40   6.368   3.993  -2.338
 1051   1HD2  LEU  40          HD21      LEU  40   9.923   3.338  -3.317
 1052   2HD2  LEU  40          HD23      LEU  40   8.391   2.518  -3.032
 1053   3HD2  LEU  40          HD22      LEU  40   8.537   3.686  -4.342
 1054    H    SER  41           HN       SER  41  11.723   6.657  -3.704
 1055    HA   SER  41           HA       SER  41  12.028   9.339  -3.251
 1056   1HB   SER  41           HB2      SER  41  13.882   7.666  -3.415
 1057   2HB   SER  41           HB1      SER  41  13.759   7.747  -5.170
 1058    HG   SER  41           HG       SER  41  15.362   9.165  -4.205
 1059    H    HIS  42           HN       HIS  42  10.593  10.723  -4.314
 1060    HA   HIS  42           HA       HIS  42  11.345  11.761  -6.855
 1061   1HB   HIS  42           HB2      HIS  42  10.371   9.554  -7.604
 1062   2HB   HIS  42           HB1      HIS  42   8.817  10.091  -6.961
 1063    HD1  HIS  42           HD1      HIS  42  10.732  10.118 -10.002
 1064    HD2  HIS  42           HD2      HIS  42   8.087  12.788  -8.188
 1065    HE1  HIS  42           HE1      HIS  42   9.972  11.715 -11.813
 1066    H    PHE  43           HN       PHE  43   8.789  11.249  -4.480
 1067    HA   PHE  43           HA       PHE  43   7.883  14.059  -4.974
 1068   1HB   PHE  43           HB2      PHE  43   5.931  12.724  -3.417
 1069   2HB   PHE  43           HB1      PHE  43   5.785  13.244  -5.093
 1070    HD1  PHE  43           HD1      PHE  43   6.681  10.413  -2.875
 1071    HD2  PHE  43           HD2      PHE  43   5.963  11.678  -6.917
 1072    HE1  PHE  43           HE1      PHE  43   6.619   8.043  -3.607
 1073    HE2  PHE  43           HE2      PHE  43   5.901   9.308  -7.648
 1074    HZ   PHE  43           HZ       PHE  43   6.228   7.490  -5.993
 1075    H    LEU  44           HN       LEU  44  10.075  12.949  -3.224
 1076    HA   LEU  44           HA       LEU  44   9.012  13.597  -0.524
 1077   1HB   LEU  44           HB2      LEU  44  11.482  12.240  -1.567
 1078   2HB   LEU  44           HB1      LEU  44  11.512  12.965   0.041
 1079    HG   LEU  44           HG       LEU  44   9.343  11.677   0.498
 1080   1HD1  LEU  44          HD11      LEU  44  10.211  10.506  -2.140
 1081   2HD1  LEU  44          HD13      LEU  44   9.309   9.530  -0.981
 1082   3HD1  LEU  44          HD12      LEU  44   8.598  11.008  -1.631
 1083   1HD2  LEU  44          HD21      LEU  44  12.082  10.502   0.150
 1084   2HD2  LEU  44          HD23      LEU  44  11.172  10.795   1.633
 1085   3HD2  LEU  44          HD22      LEU  44  10.756   9.430   0.596
 1086    H    GLU  45           HN       GLU  45   9.106  15.714   0.034
 1087    HA   GLU  45           HA       GLU  45  11.487  17.286  -0.858
 1088   1HB   GLU  45           HB2      GLU  45   8.596  18.172  -0.646
 1089   2HB   GLU  45           HB1      GLU  45   9.947  19.284  -0.869
 1090   1HG   GLU  45           HG2      GLU  45  10.384  17.338  -2.808
 1091   2HG   GLU  45           HG1      GLU  45   8.633  17.553  -2.822
 1092    H    GLU  46           HN       GLU  46   8.769  17.998   1.325
 1093    HA   GLU  46           HA       GLU  46  10.715  18.838   3.385
 1094   1HB   GLU  46           HB2      GLU  46   7.694  19.037   3.207
 1095   2HB   GLU  46           HB1      GLU  46   8.626  19.582   4.602
 1096   1HG   GLU  46           HG2      GLU  46   9.489  21.393   3.491
 1097   2HG   GLU  46           HG1      GLU  46   9.551  20.544   1.945
 1098    H    ILE  47           HN       ILE  47   8.009  16.532   3.037
 1099    HA   ILE  47           HA       ILE  47   7.611  14.511   4.164
 1100    HB   ILE  47           HB       ILE  47  10.375  14.800   5.355
 1101   1HG1  ILE  47          HG12      ILE  47  10.335  15.212   2.844
 1102   2HG1  ILE  47          HG11      ILE  47  11.308  13.831   3.357
 1103   1HG2  ILE  47          HG21      ILE  47   8.323  12.725   5.173
 1104   2HG2  ILE  47          HG23      ILE  47   9.887  12.175   4.565
 1105   3HG2  ILE  47          HG22      ILE  47   9.749  12.802   6.208
 1106   1HD1  ILE  47          HD13      ILE  47   8.419  13.396   2.681
 1107   2HD1  ILE  47          HD12      ILE  47   9.586  13.572   1.370
 1108   3HD1  ILE  47          HD11      ILE  47   9.778  12.277   2.551
 1109    H    LYS  48           HN       LYS  48   6.064  15.755   5.477
 1110    HA   LYS  48           HA       LYS  48   6.867  16.976   7.970
 1111   1HB   LYS  48           HB2      LYS  48   4.467  16.719   6.455
 1112   2HB   LYS  48           HB1      LYS  48   4.134  16.109   8.078
 1113   1HG   LYS  48           HG2      LYS  48   5.117  18.187   9.033
 1114   2HG   LYS  48           HG1      LYS  48   5.352  18.803   7.396
 1115   1HD   LYS  48           HD2      LYS  48   3.264  19.646   7.530
 1116   2HD   LYS  48           HD1      LYS  48   2.681  17.983   7.446
 1117   1HE   LYS  48           HE2      LYS  48   3.601  18.714  10.126
 1118   2HE   LYS  48           HE1      LYS  48   2.275  19.734   9.566
 1119   1HZ   LYS  48           HZ3      LYS  48   1.911  16.947   8.965
 1120   2HZ   LYS  48           HZ2      LYS  48   2.007  17.262  10.632
 1121   3HZ   LYS  48           HZ1      LYS  48   0.840  18.052   9.684
 1122    H    GLU  49           HN       GLU  49   5.792  13.734   7.047
 1123    HA   GLU  49           HA       GLU  49   5.689  12.865   9.857
 1124   1HB   GLU  49           HB2      GLU  49   5.096  11.618   7.200
 1125   2HB   GLU  49           HB1      GLU  49   5.504  10.555   8.542
 1126   1HG   GLU  49           HG2      GLU  49   3.445  12.732   8.863
 1127   2HG   GLU  49           HG1      GLU  49   3.010  11.149   8.218
 1128    H    GLN  50           HN       GLN  50   8.122  13.753   9.777
 1129    HA   GLN  50           HA       GLN  50  10.178  12.247   8.557
 1130   1HB   GLN  50           HB2      GLN  50  10.254  14.438  10.021
 1131   2HB   GLN  50           HB1      GLN  50  10.532  13.305  11.344
 1132   1HG   GLN  50           HG2      GLN  50  12.583  12.623  10.518
 1133   2HG   GLN  50           HG1      GLN  50  12.135  12.953   8.844
 1134   1HE2  GLN  50          HE22      GLN  50  13.582  16.155   8.888
 1135   2HE2  GLN  50          HE21      GLN  50  12.994  14.848   7.977
 1136    H    GLU  51           HN       GLU  51   8.133  11.473  11.275
 1137    HA   GLU  51           HA       GLU  51   9.864   9.370  12.311
 1138   1HB   GLU  51           HB2      GLU  51   7.422  10.654  13.095
 1139   2HB   GLU  51           HB1      GLU  51   7.154   8.910  13.063
 1140   1HG   GLU  51           HG2      GLU  51   9.063   8.533  14.511
 1141   2HG   GLU  51           HG1      GLU  51   9.500  10.240  14.444
 1142    H    VAL  52           HN       VAL  52   7.218   9.567   9.994
 1143    HA   VAL  52           HA       VAL  52   6.777   6.723   9.796
 1144    HB   VAL  52           HB       VAL  52   6.210   8.995   7.872
 1145   1HG1  VAL  52          HG11      VAL  52   5.544   6.052   7.758
 1146   2HG1  VAL  52          HG13      VAL  52   4.577   7.259   6.908
 1147   3HG1  VAL  52          HG12      VAL  52   6.284   7.055   6.508
 1148   1HG2  VAL  52          HG23      VAL  52   5.054   8.450  10.288
 1149   2HG2  VAL  52          HG22      VAL  52   4.211   9.227   8.949
 1150   3HG2  VAL  52          HG21      VAL  52   4.042   7.491   9.209
 1151    H    VAL  53           HN       VAL  53   8.629   9.003   7.751
 1152    HA   VAL  53           HA       VAL  53   9.700   6.849   6.115
 1153    HB   VAL  53           HB       VAL  53  10.506   9.758   6.417
 1154   1HG1  VAL  53          HG11      VAL  53  12.059   7.701   5.380
 1155   2HG1  VAL  53          HG13      VAL  53  11.265   8.366   3.953
 1156   3HG1  VAL  53          HG12      VAL  53  12.232   9.414   4.993
 1157   1HG2  VAL  53          HG21      VAL  53   8.733   8.212   4.530
 1158   2HG2  VAL  53          HG23      VAL  53   8.366   9.688   5.424
 1159   3HG2  VAL  53          HG22      VAL  53   9.459   9.742   4.040
 1160    H    ASP  54           HN       ASP  54  10.725   8.558   9.008
 1161    HA   ASP  54           HA       ASP  54  13.435   7.446   8.916
 1162   1HB   ASP  54           HB2      ASP  54  11.897   8.861  11.118
 1163   2HB   ASP  54           HB1      ASP  54  13.577   8.349  11.259
 1164    H    LYS  55           HN       LYS  55  10.318   6.409   9.948
 1165    HA   LYS  55           HA       LYS  55  11.289   4.506  11.937
 1166   1HB   LYS  55           HB2      LYS  55   9.010   5.389  12.114
 1167   2HB   LYS  55           HB1      LYS  55   8.617   4.747  10.518
 1168   1HG   LYS  55           HG2      LYS  55   9.731   2.754  12.385
 1169   2HG   LYS  55           HG1      LYS  55   8.168   3.416  12.872
 1170   1HD   LYS  55           HD2      LYS  55   7.536   2.998  10.350
 1171   2HD   LYS  55           HD1      LYS  55   8.879   1.856  10.407
 1172   1HE   LYS  55           HE2      LYS  55   7.747   0.979  12.581
 1173   2HE   LYS  55           HE1      LYS  55   6.316   1.829  11.994
 1174   1HZ   LYS  55           HZ3      LYS  55   7.274   0.466   9.818
 1175   2HZ   LYS  55           HZ2      LYS  55   7.453  -0.630  11.103
 1176   3HZ   LYS  55           HZ1      LYS  55   5.930   0.040  10.762
 1177    H    VAL  56           HN       VAL  56  10.127   4.300   8.558
 1178    HA   VAL  56           HA       VAL  56  10.704   1.446   8.425
 1179    HB   VAL  56           HB       VAL  56  10.406   1.885   5.914
 1180   1HG1  VAL  56          HG13      VAL  56   8.625   1.235   7.721
 1181   2HG1  VAL  56          HG12      VAL  56   8.049   2.885   7.488
 1182   3HG1  VAL  56          HG11      VAL  56   8.080   1.760   6.128
 1183   1HG2  VAL  56          HG22      VAL  56  10.628   4.568   6.818
 1184   2HG2  VAL  56          HG21      VAL  56  10.309   4.007   5.180
 1185   3HG2  VAL  56          HG23      VAL  56   8.968   4.345   6.274
 1186    H    MET  57           HN       MET  57  12.325   4.435   7.447
 1187    HA   MET  57           HA       MET  57  14.534   3.134   6.110
 1188   1HB   MET  57           HB2      MET  57  13.881   5.564   5.843
 1189   2HB   MET  57           HB1      MET  57  14.509   5.846   7.469
 1190   1HG   MET  57           HG2      MET  57  16.266   6.393   5.896
 1191   2HG   MET  57           HG1      MET  57  16.713   4.888   6.697
 1192   1HE   MET  57           HE3      MET  57  14.522   6.319   4.229
 1193   2HE   MET  57           HE2      MET  57  15.272   5.953   2.676
 1194   3HE   MET  57           HE1      MET  57  14.004   4.903   3.304
 1195    H    GLU  58           HN       GLU  58  13.698   3.777   9.423
 1196    HA   GLU  58           HA       GLU  58  16.399   3.507  10.475
 1197   1HB   GLU  58           HB2      GLU  58  13.652   3.730  11.586
 1198   2HB   GLU  58           HB1      GLU  58  14.813   2.856  12.586
 1199   1HG   GLU  58           HG2      GLU  58  16.388   4.774  12.382
 1200   2HG   GLU  58           HG1      GLU  58  15.161   5.655  11.473
 1201    H    THR  59           HN       THR  59  13.542   1.322  10.570
 1202    HA   THR  59           HA       THR  59  14.995  -0.942  11.530
 1203    HB   THR  59           HB       THR  59  12.537  -0.885   9.749
 1204    HG1  THR  59           HG1      THR  59  12.609   0.191  11.933
 1205   1HG2  THR  59          HG23      THR  59  13.904  -3.034  11.355
 1206   2HG2  THR  59          HG22      THR  59  12.174  -3.118  11.022
 1207   3HG2  THR  59          HG21      THR  59  13.330  -3.101   9.690
 1208    H    LEU  60           HN       LEU  60  14.679   0.508   8.390
 1209    HA   LEU  60           HA       LEU  60  15.584  -1.713   6.803
 1210   1HB   LEU  60           HB2      LEU  60  15.249   1.226   6.457
 1211   2HB   LEU  60           HB1      LEU  60  16.351   0.419   5.341
 1212    HG   LEU  60           HG       LEU  60  13.507  -0.470   5.894
 1213   1HD1  LEU  60          HD13      LEU  60  14.711   1.403   3.906
 1214   2HD1  LEU  60          HD12      LEU  60  13.459   0.304   3.328
 1215   3HD1  LEU  60          HD11      LEU  60  13.108   1.426   4.643
 1216   1HD2  LEU  60          HD22      LEU  60  15.648  -1.359   3.937
 1217   2HD2  LEU  60          HD21      LEU  60  14.874  -2.328   5.191
 1218   3HD2  LEU  60          HD23      LEU  60  13.952  -1.811   3.784
 1219    H    ASP  61           HN       ASP  61  17.303   1.178   8.004
 1220    HA   ASP  61           HA       ASP  61  19.903   0.100   7.246
 1221   1HB   ASP  61           HB2      ASP  61  18.967   2.623   7.712
 1222   2HB   ASP  61           HB1      ASP  61  19.791   2.290   9.235
 1223    H    GLU  62           HN       GLU  62  17.807  -0.561   9.777
 1224    HA   GLU  62           HA       GLU  62  19.732  -0.804  11.930
 1225   1HB   GLU  62           HB2      GLU  62  16.948  -0.948  11.702
 1226   2HB   GLU  62           HB1      GLU  62  17.440  -2.577  12.170
 1227   1HG   GLU  62           HG2      GLU  62  18.920  -1.408  13.941
 1228   2HG   GLU  62           HG1      GLU  62  17.938   0.022  13.621
 1229    H    ASP  63           HN       ASP  63  18.032  -3.274   9.988
 1230    HA   ASP  63           HA       ASP  63  19.908  -5.341  10.855
 1231   1HB   ASP  63           HB2      ASP  63  17.551  -5.240   8.997
 1232   2HB   ASP  63           HB1      ASP  63  18.645  -6.623   8.942
 1233    H    GLY  64           HN       GLY  64  19.052  -4.169   7.594
 1234   1HA   GLY  64           HA2      GLY  64  20.625  -3.433   5.925
 1235   2HA   GLY  64           HA1      GLY  64  21.935  -4.098   6.904
 1236    H    ASP  65           HN       ASP  65  21.237  -6.677   7.318
 1237    HA   ASP  65           HA       ASP  65  20.798  -7.786   4.574
 1238   1HB   ASP  65           HB2      ASP  65  23.216  -7.841   5.553
 1239   2HB   ASP  65           HB1      ASP  65  22.589  -9.120   6.596
 1240    H    GLY  66           HN       GLY  66  18.879  -7.405   6.783
 1241   1HA   GLY  66           HA2      GLY  66  18.443 -10.128   7.824
 1242   2HA   GLY  66           HA1      GLY  66  17.490  -8.701   8.235
 1243    H    GLU  67           HN       GLU  67  16.251 -11.128   7.530
 1244    HA   GLU  67           HA       GLU  67  15.433 -10.880   4.703
 1245   1HB   GLU  67           HB2      GLU  67  14.860 -12.855   6.909
 1246   2HB   GLU  67           HB1      GLU  67  13.907 -12.853   5.425
 1247   1HG   GLU  67           HG2      GLU  67  15.761 -13.393   4.081
 1248   2HG   GLU  67           HG1      GLU  67  16.917 -12.864   5.304
 1249    H    CYS  68           HN       CYS  68  13.287 -10.366   4.067
 1250    HA   CYS  68           HA       CYS  68  11.568  -9.208   6.228
 1251   1HB   CYS  68           HB2      CYS  68  11.656  -8.070   3.440
 1252   2HB   CYS  68           HB1      CYS  68  11.108  -7.301   4.932
 1253    HG   CYS  68           HG       CYS  68  14.139  -7.943   4.474
 1254    H    ASP  69           HN       ASP  69   9.268  -9.325   5.795
 1255    HA   ASP  69           HA       ASP  69   8.586 -11.611   4.038
 1256   1HB   ASP  69           HB2      ASP  69   6.643 -10.106   5.792
 1257   2HB   ASP  69           HB1      ASP  69   6.580 -11.791   5.272
 1258    H    PHE  70           HN       PHE  70   6.166 -11.175   3.074
 1259    HA   PHE  70           HA       PHE  70   6.581  -8.977   1.177
 1260   1HB   PHE  70           HB2      PHE  70   4.655  -9.879   0.007
 1261   2HB   PHE  70           HB1      PHE  70   5.704 -11.218   0.474
 1262    HD1  PHE  70           HD1      PHE  70   5.125 -12.605   2.496
 1263    HD2  PHE  70           HD2      PHE  70   2.444  -9.668   0.876
 1264    HE1  PHE  70           HE1      PHE  70   3.245 -13.631   3.748
 1265    HE2  PHE  70           HE2      PHE  70   0.562 -10.692   2.128
 1266    HZ   PHE  70           HZ       PHE  70   0.963 -12.674   3.564
 1267    H    GLN  71           HN       GLN  71   4.596  -9.625   3.996
 1268    HA   GLN  71           HA       GLN  71   2.782  -7.377   3.488
 1269   1HB   GLN  71           HB2      GLN  71   3.238  -9.256   5.809
 1270   2HB   GLN  71           HB1      GLN  71   2.203  -7.836   5.983
 1271   1HG   GLN  71           HG2      GLN  71   1.200  -8.805   3.683
 1272   2HG   GLN  71           HG1      GLN  71   1.769 -10.316   4.396
 1273   1HE2  GLN  71          HE22      GLN  71  -1.092  -8.201   6.484
 1274   2HE2  GLN  71          HE21      GLN  71   0.049  -7.348   5.562
 1275    H    GLU  72           HN       GLU  72   5.895  -7.823   5.009
 1276    HA   GLU  72           HA       GLU  72   5.678  -5.386   6.599
 1277   1HB   GLU  72           HB2      GLU  72   7.700  -6.022   7.505
 1278   2HB   GLU  72           HB1      GLU  72   7.185  -7.582   6.881
 1279   1HG   GLU  72           HG2      GLU  72   9.332  -7.470   6.032
 1280   2HG   GLU  72           HG1      GLU  72   8.425  -6.786   4.696
 1281    H    PHE  73           HN       PHE  73   7.085  -6.349   3.509
 1282    HA   PHE  73           HA       PHE  73   8.251  -3.703   3.046
 1283   1HB   PHE  73           HB2      PHE  73   9.431  -4.857   1.498
 1284   2HB   PHE  73           HB1      PHE  73   8.520  -6.303   1.912
 1285    HD1  PHE  73           HD2      PHE  73   6.596  -7.011   0.569
 1286    HD2  PHE  73           HD1      PHE  73   8.849  -3.499  -0.447
 1287    HE1  PHE  73           HE2      PHE  73   5.530  -6.977  -1.669
 1288    HE2  PHE  73           HE1      PHE  73   7.785  -3.463  -2.687
 1289    HZ   PHE  73           HZ       PHE  73   6.125  -5.202  -3.299
 1290    H    MET  74           HN       MET  74   5.231  -5.333   2.449
 1291    HA   MET  74           HA       MET  74   4.294  -3.418   0.472
 1292   1HB   MET  74           HB2      MET  74   3.297  -5.841   1.753
 1293   2HB   MET  74           HB1      MET  74   2.046  -4.612   1.658
 1294   1HG   MET  74           HG2      MET  74   3.641  -5.824  -0.615
 1295   2HG   MET  74           HG1      MET  74   1.898  -5.879  -0.372
 1296   1HE   MET  74           HE1      MET  74   0.422  -4.347  -0.438
 1297   2HE   MET  74           HE3      MET  74   0.695  -2.602  -0.342
 1298   3HE   MET  74           HE2      MET  74   0.339  -3.357  -1.894
 1299    H    ALA  75           HN       ALA  75   3.738  -3.966   3.946
 1300    HA   ALA  75           HA       ALA  75   2.025  -1.646   4.250
 1301   1HB   ALA  75           HB2      ALA  75   3.619  -3.274   6.256
 1302   2HB   ALA  75           HB1      ALA  75   2.513  -1.974   6.706
 1303   3HB   ALA  75           HB3      ALA  75   1.896  -3.418   5.902
 1304    H    PHE  76           HN       PHE  76   5.426  -2.194   4.082
 1305    HA   PHE  76           HA       PHE  76   6.210   0.303   5.384
 1306   1HB   PHE  76           HB2      PHE  76   7.537  -1.996   4.078
 1307   2HB   PHE  76           HB1      PHE  76   8.364  -0.456   3.865
 1308    HD1  PHE  76           HD1      PHE  76   6.267  -1.546   6.749
 1309    HD2  PHE  76           HD2      PHE  76  10.223  -0.653   5.327
 1310    HE1  PHE  76           HE1      PHE  76   7.134  -1.696   9.068
 1311    HE2  PHE  76           HE2      PHE  76  11.089  -0.802   7.646
 1312    HZ   PHE  76           HZ       PHE  76   9.545  -1.324   9.515
 1313    H    VAL  77           HN       VAL  77   5.693  -0.871   2.100
 1314    HA   VAL  77           HA       VAL  77   6.697   1.415   0.692
 1315    HB   VAL  77           HB       VAL  77   4.607  -0.666   0.006
 1316   1HG1  VAL  77          HG13      VAL  77   5.304   1.827  -1.337
 1317   2HG1  VAL  77          HG12      VAL  77   5.569   0.419  -2.366
 1318   3HG1  VAL  77          HG11      VAL  77   3.980   0.711  -1.663
 1319   1HG2  VAL  77          HG23      VAL  77   7.357  -0.848   0.211
 1320   2HG2  VAL  77          HG22      VAL  77   6.344  -1.910  -0.766
 1321   3HG2  VAL  77          HG21      VAL  77   7.126  -0.512  -1.504
 1322    H    SER  78           HN       SER  78   3.704   0.789   2.383
 1323    HA   SER  78           HA       SER  78   2.260   2.999   1.138
 1324   1HB   SER  78           HB2      SER  78   0.858   2.471   3.407
 1325   2HB   SER  78           HB1      SER  78   0.678   1.554   1.913
 1326    HG   SER  78           HG       SER  78   1.609   0.754   4.298
 1327    H    MET  79           HN       MET  79   3.156   2.493   4.568
 1328    HA   MET  79           HA       MET  79   2.734   5.054   5.514
 1329   1HB   MET  79           HB2      MET  79   5.147   4.444   6.751
 1330   2HB   MET  79           HB1      MET  79   3.545   3.997   7.331
 1331   1HG   MET  79           HG2      MET  79   3.677   1.839   6.333
 1332   2HG   MET  79           HG1      MET  79   5.078   2.290   5.360
 1333   1HE   MET  79           HE3      MET  79   3.451   1.501   8.427
 1334   2HE   MET  79           HE2      MET  79   4.641   0.737   9.475
 1335   3HE   MET  79           HE1      MET  79   4.390   2.479   9.563
 1336    H    VAL  80           HN       VAL  80   5.428   4.019   3.482
 1337    HA   VAL  80           HA       VAL  80   6.833   6.555   3.807
 1338    HB   VAL  80           HB       VAL  80   8.284   5.681   1.980
 1339   1HG1  VAL  80          HG12      VAL  80   8.655   5.150   4.394
 1340   2HG1  VAL  80          HG11      VAL  80   7.727   3.668   4.172
 1341   3HG1  VAL  80          HG13      VAL  80   9.251   3.890   3.313
 1342   1HG2  VAL  80          HG22      VAL  80   6.055   3.746   1.788
 1343   2HG2  VAL  80          HG21      VAL  80   7.196   4.275   0.553
 1344   3HG2  VAL  80          HG23      VAL  80   7.669   3.040   1.719
 1345    H    THR  81           HN       THR  81   4.894   5.052   1.201
 1346    HA   THR  81           HA       THR  81   5.059   7.460  -0.444
 1347    HB   THR  81           HB       THR  81   2.910   5.422  -0.866
 1348    HG1  THR  81           HG1      THR  81   5.609   4.903  -0.693
 1349   1HG2  THR  81          HG23      THR  81   3.832   7.528  -2.315
 1350   2HG2  THR  81          HG22      THR  81   4.818   6.225  -2.983
 1351   3HG2  THR  81          HG21      THR  81   3.058   6.115  -3.032
 1352    H    THR  82           HN       THR  82   3.527   6.904   2.395
 1353    HA   THR  82           HA       THR  82   1.375   8.856   1.730
 1354    HB   THR  82           HB       THR  82   0.609   6.968   3.821
 1355    HG1  THR  82           HG1      THR  82   0.160   5.436   1.893
 1356   1HG2  THR  82          HG23      THR  82  -0.541   8.066   1.267
 1357   2HG2  THR  82          HG22      THR  82  -1.362   6.777   2.148
 1358   3HG2  THR  82          HG21      THR  82  -1.078   8.334   2.926
 1359    H    ALA  83           HN       ALA  83   4.105   8.366   3.417
 1360    HA   ALA  83           HA       ALA  83   3.624   8.913   6.115
 1361   1HB   ALA  83           HB1      ALA  83   5.885   8.556   5.173
 1362   2HB   ALA  83           HB3      ALA  83   5.801  10.132   4.385
 1363   3HB   ALA  83           HB2      ALA  83   5.824  10.027   6.145
 1364    H    CYS  84           HN       CYS  84   4.534  11.543   3.860
 1365    HA   CYS  84           HA       CYS  84   2.269  13.181   4.242
 1366   1HB   CYS  84           HB2      CYS  84   3.876  12.994   6.599
 1367   2HB   CYS  84           HB1      CYS  84   4.050  14.624   5.946
 1368    HG   CYS  84           HG       CYS  84   1.596  13.600   7.336
 1369    H    HIS  85           HN       HIS  85   4.097  12.668   2.161
 1370    HA   HIS  85           HA       HIS  85   5.977  14.888   1.937
 1371   1HB   HIS  85           HB2      HIS  85   5.997  14.084  -0.536
 1372   2HB   HIS  85           HB1      HIS  85   6.638  12.997   0.695
 1373    HD1  HIS  85           HD1      HIS  85   6.000  10.769  -0.352
 1374    HD2  HIS  85           HD2      HIS  85   2.762  13.381  -0.055
 1375    HE1  HIS  85           HE1      HIS  85   3.939   9.423  -0.944
 1376    H    GLU  86           HN       GLU  86   5.619  15.947  -0.548
 1377    HA   GLU  86           HA       GLU  86   3.120  17.504  -0.169
 1378   1HB   GLU  86           HB2      GLU  86   5.312  18.681  -0.485
 1379   2HB   GLU  86           HB1      GLU  86   5.408  17.983  -2.103
 1380   1HG   GLU  86           HG2      GLU  86   3.421  19.140  -2.808
 1381   2HG   GLU  86           HG1      GLU  86   3.065  19.655  -1.158
 1382    H    PHE  87           HN       PHE  87   2.373  15.080  -0.989
 1383    HA   PHE  87           HA       PHE  87   2.363  14.871  -3.909
 1384   1HB   PHE  87           HB2      PHE  87   1.083  12.848  -3.579
 1385   2HB   PHE  87           HB1      PHE  87   2.387  12.871  -2.398
 1386    HD1  PHE  87           HD2      PHE  87   0.492  15.301  -1.012
 1387    HD2  PHE  87           HD1      PHE  87   0.176  11.103  -1.890
 1388    HE1  PHE  87           HE2      PHE  87  -1.162  15.046   0.809
 1389    HE2  PHE  87           HE1      PHE  87  -1.480  10.853  -0.061
 1390    HZ   PHE  87           HZ       PHE  87  -2.149  12.822   1.288
 1391    H    PHE  88           HN       PHE  88  -0.144  14.164  -4.627
 1392    HA   PHE  88           HA       PHE  88  -2.178  15.123  -5.305
 1393   1HB   PHE  88           HB2      PHE  88  -2.075  16.139  -2.449
 1394   2HB   PHE  88           HB1      PHE  88  -3.500  16.199  -3.483
 1395    HD1  PHE  88           HD1      PHE  88  -2.556  13.413  -4.833
 1396    HD2  PHE  88           HD2      PHE  88  -3.391  14.749  -0.834
 1397    HE1  PHE  88           HE1      PHE  88  -3.127  11.093  -4.180
 1398    HE2  PHE  88           HE2      PHE  88  -3.960  12.424  -0.182
 1399    HZ   PHE  88           HZ       PHE  88  -3.829  10.599  -1.855
 1400    H    GLU  89           HN       GLU  89   0.369  16.651  -5.636
 1401    HA   GLU  89           HA       GLU  89  -0.762  19.418  -5.627
 1402   1HB   GLU  89           HB2      GLU  89   1.500  18.770  -4.427
 1403   2HB   GLU  89           HB1      GLU  89   2.153  18.856  -6.064
 1404   1HG   GLU  89           HG2      GLU  89   2.364  21.037  -4.955
 1405   2HG   GLU  89           HG1      GLU  89   1.224  21.144  -6.297
 1406    H    HIS  90           HN       HIS  90   1.759  17.756  -7.523
 1407    HA   HIS  90           HA       HIS  90   0.197  18.083  -9.990
 1408   1HB   HIS  90           HB2      HIS  90   1.727  19.549 -11.106
 1409   2HB   HIS  90           HB1      HIS  90   1.382  20.303  -9.549
 1410    HD1  HIS  90           HD1      HIS  90   4.146  19.944 -11.581
 1411    HD2  HIS  90           HD2      HIS  90   3.512  18.899  -7.594
 1412    HE1  HIS  90           HE1      HIS  90   6.438  19.751 -10.519
 1413    H    GLU  91           HN       GLU  91   1.593  15.971  -8.320
 1414    HA   GLU  91           HA       GLU  91   3.557  14.983 -10.341
 1415   1HB   GLU  91           HB2      GLU  91   3.169  14.548  -7.407
 1416   2HB   GLU  91           HB1      GLU  91   3.872  13.234  -8.354
 1417   1HG   GLU  91           HG2      GLU  91   5.855  14.291  -8.296
 1418   2HG   GLU  91           HG1      GLU  91   5.144  15.623  -9.206
   
  No H/Q in entry =        1418
  Start of MODEL    3
    1   1H    MET   0           HT2      MET   0   7.049   3.037 -15.398
    2   2H    MET   0           HT1      MET   0   7.748   4.584 -15.350
    3   3H    MET   0           HT3      MET   0   7.235   3.933 -16.829
    4    HA   MET   0           HA       MET   0   9.088   2.737 -17.120
    5   1HB   MET   0           HB2      MET   0   9.857   5.047 -16.443
    6   2HB   MET   0           HB1      MET   0  10.097   4.422 -14.812
    7   1HG   MET   0           HG2      MET   0  11.642   2.697 -15.732
    8   2HG   MET   0           HG1      MET   0  11.452   3.413 -17.332
    9   1HE   MET   0           HE3      MET   0  13.903   2.863 -16.591
   10   2HE   MET   0           HE2      MET   0  14.307   4.256 -17.590
   11   3HE   MET   0           HE1      MET   0  15.010   4.101 -15.982
   12    H    SER   1           HN       SER   1   8.005   2.798 -13.784
   13    HA   SER   1           HA       SER   1   9.194   0.080 -13.448
   14   1HB   SER   1           HB2      SER   1  10.594   1.121 -11.966
   15   2HB   SER   1           HB1      SER   1   9.521   2.503 -11.767
   16    HG   SER   1           HG       SER   1   9.123   1.534  -9.930
   17    H    GLU   2           HN       GLU   2   8.007  -1.240 -11.851
   18    HA   GLU   2           HA       GLU   2   5.125  -0.825 -12.092
   19   1HB   GLU   2           HB2      GLU   2   6.600  -3.061 -12.003
   20   2HB   GLU   2           HB1      GLU   2   6.245  -2.912 -10.281
   21   1HG   GLU   2           HG2      GLU   2   4.367  -4.074 -10.908
   22   2HG   GLU   2           HG1      GLU   2   3.785  -2.443 -11.243
   23    H    LEU   3           HN       LEU   3   7.576  -0.411  -9.614
   24    HA   LEU   3           HA       LEU   3   5.701  -0.149  -7.414
   25   1HB   LEU   3           HB2      LEU   3   8.346  -0.565  -7.487
   26   2HB   LEU   3           HB1      LEU   3   8.363   1.188  -7.305
   27    HG   LEU   3           HG       LEU   3   6.679   0.832  -5.394
   28   1HD1  LEU   3          HD13      LEU   3   6.376  -1.628  -6.185
   29   2HD1  LEU   3          HD12      LEU   3   7.867  -1.932  -5.297
   30   3HD1  LEU   3          HD11      LEU   3   6.450  -1.307  -4.453
   31   1HD2  LEU   3          HD21      LEU   3   9.594   0.095  -5.366
   32   2HD2  LEU   3          HD23      LEU   3   8.804   1.521  -4.694
   33   3HD2  LEU   3          HD22      LEU   3   8.653  -0.035  -3.881
   34    H    GLU   4           HN       GLU   4   7.407   2.142  -9.522
   35    HA   GLU   4           HA       GLU   4   6.336   4.485  -8.190
   36   1HB   GLU   4           HB2      GLU   4   8.350   4.824  -9.394
   37   2HB   GLU   4           HB1      GLU   4   7.729   4.008 -10.829
   38   1HG   GLU   4           HG2      GLU   4   6.099   6.310 -10.013
   39   2HG   GLU   4           HG1      GLU   4   7.753   6.744 -10.439
   40    H    LYS   5           HN       LYS   5   5.550   2.917 -11.321
   41    HA   LYS   5           HA       LYS   5   3.323   4.638 -11.878
   42   1HB   LYS   5           HB2      LYS   5   4.667   2.550 -13.191
   43   2HB   LYS   5           HB1      LYS   5   3.007   1.984 -13.006
   44   1HG   LYS   5           HG2      LYS   5   2.293   3.394 -14.604
   45   2HG   LYS   5           HG1      LYS   5   3.019   4.770 -13.773
   46   1HD   LYS   5           HD2      LYS   5   4.238   4.788 -15.748
   47   2HD   LYS   5           HD1      LYS   5   5.264   3.755 -14.751
   48   1HE   LYS   5           HE2      LYS   5   5.008   2.592 -16.822
   49   2HE   LYS   5           HE1      LYS   5   3.939   1.776 -15.683
   50   1HZ   LYS   5           HZ3      LYS   5   2.247   3.537 -16.580
   51   2HZ   LYS   5           HZ2      LYS   5   3.274   3.526 -17.934
   52   3HZ   LYS   5           HZ1      LYS   5   2.526   2.090 -17.420
   53    H    ALA   6           HN       ALA   6   3.620   1.650 -10.033
   54    HA   ALA   6           HA       ALA   6   0.729   1.272  -9.852
   55   1HB   ALA   6           HB1      ALA   6   2.278  -0.646  -9.739
   56   2HB   ALA   6           HB3      ALA   6   2.974   0.008  -8.256
   57   3HB   ALA   6           HB2      ALA   6   1.297  -0.533  -8.278
   58    H    MET   7           HN       MET   7   3.180   1.889  -7.309
   59    HA   MET   7           HA       MET   7   1.378   2.581  -5.265
   60   1HB   MET   7           HB2      MET   7   3.641   2.292  -4.633
   61   2HB   MET   7           HB1      MET   7   4.214   3.443  -5.840
   62   1HG   MET   7           HG2      MET   7   4.173   4.280  -3.420
   63   2HG   MET   7           HG1      MET   7   3.373   5.307  -4.606
   64   1HE   MET   7           HE3      MET   7   3.217   3.446  -1.408
   65   2HE   MET   7           HE2      MET   7   1.577   2.829  -1.232
   66   3HE   MET   7           HE1      MET   7   2.655   2.115  -2.430
   67    H    VAL   8           HN       VAL   8   3.047   4.815  -7.504
   68    HA   VAL   8           HA       VAL   8   1.711   7.158  -6.574
   69    HB   VAL   8           HB       VAL   8   2.670   6.700  -9.408
   70   1HG1  VAL   8          HG13      VAL   8   2.465   9.133  -7.604
   71   2HG1  VAL   8          HG12      VAL   8   3.211   9.134  -9.202
   72   3HG1  VAL   8          HG11      VAL   8   1.487   8.804  -9.034
   73   1HG2  VAL   8          HG22      VAL   8   4.193   6.223  -7.161
   74   2HG2  VAL   8          HG21      VAL   8   4.840   6.730  -8.720
   75   3HG2  VAL   8          HG23      VAL   8   4.519   7.928  -7.467
   76    H    ALA   9           HN       ALA   9   0.722   4.625  -8.785
   77    HA   ALA   9           HA       ALA   9  -1.451   6.047 -10.029
   78   1HB   ALA   9           HB3      ALA   9  -0.788   3.140  -9.612
   79   2HB   ALA   9           HB2      ALA   9  -2.363   3.601 -10.256
   80   3HB   ALA   9           HB1      ALA   9  -0.892   4.044 -11.122
   81    H    LEU  10           HN       LEU  10  -1.181   4.104  -7.075
   82    HA   LEU  10           HA       LEU  10  -3.946   4.038  -6.415
   83   1HB   LEU  10           HB2      LEU  10  -1.430   3.463  -5.094
   84   2HB   LEU  10           HB1      LEU  10  -2.537   4.280  -3.988
   85    HG   LEU  10           HG       LEU  10  -3.990   2.328  -5.528
   86   1HD1  LEU  10          HD11      LEU  10  -1.332   1.507  -4.465
   87   2HD1  LEU  10          HD13      LEU  10  -2.684   0.417  -4.161
   88   3HD1  LEU  10          HD12      LEU  10  -2.253   0.849  -5.816
   89   1HD2  LEU  10          HD22      LEU  10  -3.410   3.002  -2.675
   90   2HD2  LEU  10          HD21      LEU  10  -4.962   2.846  -3.497
   91   3HD2  LEU  10          HD23      LEU  10  -4.072   1.403  -3.014
   92    H    ILE  11           HN       ILE  11  -1.547   6.580  -6.149
   93    HA   ILE  11           HA       ILE  11  -3.091   8.248  -4.347
   94    HB   ILE  11           HB       ILE  11  -0.768   8.735  -6.214
   95   1HG1  ILE  11          HG12      ILE  11   0.438   9.111  -4.175
   96   2HG1  ILE  11          HG11      ILE  11  -1.053   9.215  -3.237
   97   1HG2  ILE  11          HG21      ILE  11  -2.464  10.768  -4.755
   98   2HG2  ILE  11          HG23      ILE  11  -0.772  11.084  -5.138
   99   3HG2  ILE  11          HG22      ILE  11  -1.929  10.793  -6.435
  100   1HD1  ILE  11          HD12      ILE  11  -1.530   6.842  -3.751
  101   2HD1  ILE  11          HD11      ILE  11  -0.021   6.741  -4.659
  102   3HD1  ILE  11          HD13      ILE  11   0.012   7.022  -2.918
  103    H    ASP  12           HN       ASP  12  -2.958   7.739  -7.815
  104    HA   ASP  12           HA       ASP  12  -4.476  10.034  -8.616
  105   1HB   ASP  12           HB2      ASP  12  -3.145   8.416 -10.099
  106   2HB   ASP  12           HB1      ASP  12  -4.530   7.335  -9.986
  107    H    VAL  13           HN       VAL  13  -5.521   6.634  -8.207
  108    HA   VAL  13           HA       VAL  13  -8.305   7.114  -8.443
  109    HB   VAL  13           HB       VAL  13  -6.593   4.936  -7.783
  110   1HG1  VAL  13          HG12      VAL  13  -8.762   5.404  -5.735
  111   2HG1  VAL  13          HG11      VAL  13  -8.130   3.798  -6.092
  112   3HG1  VAL  13          HG13      VAL  13  -7.059   5.045  -5.455
  113   1HG2  VAL  13          HG22      VAL  13  -8.668   5.285  -9.376
  114   2HG2  VAL  13          HG21      VAL  13  -8.290   3.681  -8.749
  115   3HG2  VAL  13          HG23      VAL  13  -9.566   4.642  -8.001
  116    H    PHE  14           HN       PHE  14  -6.387   6.786  -5.455
  117    HA   PHE  14           HA       PHE  14  -8.267   7.394  -3.531
  118   1HB   PHE  14           HB2      PHE  14  -5.881   6.937  -3.040
  119   2HB   PHE  14           HB1      PHE  14  -5.463   8.544  -3.636
  120    HD1  PHE  14           HD2      PHE  14  -8.121   7.133  -1.385
  121    HD2  PHE  14           HD1      PHE  14  -5.045  10.075  -1.938
  122    HE1  PHE  14           HE2      PHE  14  -8.645   8.100   0.838
  123    HE2  PHE  14           HE1      PHE  14  -5.569  11.041   0.285
  124    HZ   PHE  14           HZ       PHE  14  -7.368  10.052   1.674
  125    H    HIS  15           HN       HIS  15  -6.758   9.670  -5.780
  126    HA   HIS  15           HA       HIS  15  -7.874  12.027  -4.498
  127   1HB   HIS  15           HB2      HIS  15  -5.863  11.874  -6.136
  128   2HB   HIS  15           HB1      HIS  15  -7.088  11.869  -7.406
  129    HD1  HIS  15           HD1      HIS  15  -8.337  14.055  -7.868
  130    HD2  HIS  15           HD2      HIS  15  -5.768  14.319  -4.597
  131    HE1  HIS  15           HE1      HIS  15  -8.222  16.507  -7.242
  132    H    GLN  16           HN       GLN  16  -8.733  10.159  -7.417
  133    HA   GLN  16           HA       GLN  16 -10.987  11.614  -8.233
  134   1HB   GLN  16           HB2      GLN  16  -9.807   9.312  -9.053
  135   2HB   GLN  16           HB1      GLN  16 -11.258   8.658  -8.298
  136   1HG   GLN  16           HG2      GLN  16 -12.347   9.169 -10.208
  137   2HG   GLN  16           HG1      GLN  16 -12.176  10.863  -9.747
  138   1HE2  GLN  16          HE22      GLN  16  -9.188   9.435 -12.193
  139   2HE2  GLN  16          HE21      GLN  16  -9.701   8.495 -10.876
  140    H    TYR  17           HN       TYR  17 -10.669   9.269  -5.620
  141    HA   TYR  17           HA       TYR  17 -13.541   9.265  -5.043
  142   1HB   TYR  17           HB2      TYR  17 -11.114   8.100  -3.672
  143   2HB   TYR  17           HB1      TYR  17 -12.718   8.026  -2.945
  144    HD1  TYR  17           HD2      TYR  17 -14.636   7.104  -4.470
  145    HD2  TYR  17           HD1      TYR  17 -10.455   6.437  -5.191
  146    HE1  TYR  17           HE2      TYR  17 -15.191   5.138  -5.879
  147    HE2  TYR  17           HE1      TYR  17 -11.009   4.471  -6.600
  148    HH   TYR  17           HH       TYR  17 -13.907   3.901  -7.895
  149    H    SER  18           HN       SER  18 -10.638  10.840  -3.783
  150    HA   SER  18           HA       SER  18 -12.217  12.155  -1.650
  151   1HB   SER  18           HB2      SER  18  -9.348  11.704  -2.217
  152   2HB   SER  18           HB1      SER  18  -9.735  13.248  -1.466
  153    HG   SER  18           HG       SER  18 -10.581  12.212   0.253
  154    H    GLY  19           HN       GLY  19 -12.543  12.732  -4.604
  155   1HA   GLY  19           HA2      GLY  19 -11.823  15.624  -4.543
  156   2HA   GLY  19           HA1      GLY  19 -12.011  14.694  -6.028
  157    H    ARG  20           HN       ARG  20 -14.354  13.690  -3.871
  158    HA   ARG  20           HA       ARG  20 -16.424  15.167  -5.360
  159   1HB   ARG  20           HB2      ARG  20 -16.626  13.030  -3.218
  160   2HB   ARG  20           HB1      ARG  20 -17.997  13.706  -4.098
  161   1HG   ARG  20           HG2      ARG  20 -16.660  13.024  -6.231
  162   2HG   ARG  20           HG1      ARG  20 -15.760  11.974  -5.136
  163   1HD   ARG  20           HD2      ARG  20 -18.232  11.321  -4.346
  164   2HD   ARG  20           HD1      ARG  20 -18.614  11.815  -5.995
  165    HE   ARG  20           HE       ARG  20 -16.433  10.121  -6.287
  166   1HH1  ARG  20          HH11      ARG  20 -18.293   9.300  -3.752
  167   2HH1  ARG  20          HH12      ARG  20 -19.025   7.896  -4.453
  168   1HH2  ARG  20          HH21      ARG  20 -17.912   8.583  -7.663
  169   2HH2  ARG  20          HH22      ARG  20 -18.812   7.491  -6.664
  170    H    GLU  21           HN       GLU  21 -16.209  17.307  -4.542
  171    HA   GLU  21           HA       GLU  21 -16.346  19.042  -2.946
  172   1HB   GLU  21           HB2      GLU  21 -18.504  18.137  -1.371
  173   2HB   GLU  21           HB1      GLU  21 -18.583  19.202  -2.772
  174   1HG   GLU  21           HG2      GLU  21 -18.573  17.058  -4.195
  175   2HG   GLU  21           HG1      GLU  21 -18.914  16.201  -2.691
  176    H    GLY  22           HN       GLY  22 -17.254  19.013  -0.285
  177   1HA   GLY  22           HA2      GLY  22 -16.559  18.497   1.900
  178   2HA   GLY  22           HA1      GLY  22 -15.931  16.970   1.275
  179    H    ASP  23           HN       ASP  23 -14.074  17.449   2.753
  180    HA   ASP  23           HA       ASP  23 -12.369  19.687   2.463
  181   1HB   ASP  23           HB2      ASP  23 -11.962  16.852   3.379
  182   2HB   ASP  23           HB1      ASP  23 -10.581  17.935   3.228
  183    H    LYS  24           HN       LYS  24 -10.835  16.686   1.562
  184    HA   LYS  24           HA       LYS  24 -10.858  16.805  -1.240
  185   1HB   LYS  24           HB2      LYS  24  -9.935  19.088  -1.013
  186   2HB   LYS  24           HB1      LYS  24  -8.587  18.448  -0.075
  187   1HG   LYS  24           HG2      LYS  24  -7.867  18.730  -2.382
  188   2HG   LYS  24           HG1      LYS  24  -7.985  17.004  -2.035
  189   1HD   LYS  24           HD2      LYS  24  -9.249  16.914  -3.918
  190   2HD   LYS  24           HD1      LYS  24 -10.530  17.576  -2.902
  191   1HE   LYS  24           HE2      LYS  24  -9.475  19.890  -3.515
  192   2HE   LYS  24           HE1      LYS  24  -8.739  19.005  -4.852
  193   1HZ   LYS  24           HZ3      LYS  24 -11.542  18.455  -4.477
  194   2HZ   LYS  24           HZ2      LYS  24 -11.212  20.070  -4.885
  195   3HZ   LYS  24           HZ1      LYS  24 -10.686  18.811  -5.898
  196    H    HIS  25           HN       HIS  25  -9.141  16.090   1.711
  197    HA   HIS  25           HA       HIS  25  -7.924  13.739   0.332
  198   1HB   HIS  25           HB2      HIS  25  -6.479  15.033   2.615
  199   2HB   HIS  25           HB1      HIS  25  -5.831  14.091   1.272
  200    HD1  HIS  25           HD1      HIS  25  -6.304  17.517   2.394
  201    HD2  HIS  25           HD2      HIS  25  -6.014  15.616  -1.307
  202    HE1  HIS  25           HE1      HIS  25  -5.795  19.327   0.697
  203    H    LYS  26           HN       LYS  26 -10.336  13.503   1.610
  204    HA   LYS  26           HA       LYS  26  -9.586  11.869   3.973
  205   1HB   LYS  26           HB2      LYS  26 -11.289  12.825   5.378
  206   2HB   LYS  26           HB1      LYS  26 -10.342  14.169   4.742
  207   1HG   LYS  26           HG2      LYS  26 -12.423  14.987   4.234
  208   2HG   LYS  26           HG1      LYS  26 -12.194  13.993   2.795
  209   1HD   LYS  26           HD2      LYS  26 -14.067  12.881   3.369
  210   2HD   LYS  26           HD1      LYS  26 -13.170  12.224   4.738
  211   1HE   LYS  26           HE2      LYS  26 -14.267  14.976   5.048
  212   2HE   LYS  26           HE1      LYS  26 -15.427  13.649   5.060
  213   1HZ   LYS  26           HZ1      LYS  26 -13.191  12.962   6.625
  214   2HZ   LYS  26           HZ3      LYS  26 -13.768  14.475   7.129
  215   3HZ   LYS  26           HZ2      LYS  26 -14.813  13.135   7.105
  216    H    LEU  27           HN       LEU  27 -10.473   9.892   3.693
  217    HA   LEU  27           HA       LEU  27 -12.775   9.621   1.829
  218   1HB   LEU  27           HB2      LEU  27 -10.450   8.019   2.468
  219   2HB   LEU  27           HB1      LEU  27 -11.921   7.074   2.695
  220    HG   LEU  27           HG       LEU  27 -11.224   8.650   0.201
  221   1HD1  LEU  27          HD12      LEU  27 -10.261   6.165   1.051
  222   2HD1  LEU  27          HD11      LEU  27 -11.563   5.772  -0.071
  223   3HD1  LEU  27          HD13      LEU  27 -10.224   6.791  -0.597
  224   1HD2  LEU  27          HD22      LEU  27 -13.543   6.826   0.904
  225   2HD2  LEU  27          HD21      LEU  27 -13.627   8.549   0.536
  226   3HD2  LEU  27          HD23      LEU  27 -13.195   7.397  -0.728
  227    H    LYS  28           HN       LYS  28 -13.787   7.176   2.865
  228    HA   LYS  28           HA       LYS  28 -14.611   7.832   5.646
  229   1HB   LYS  28           HB2      LYS  28 -16.408   7.619   3.242
  230   2HB   LYS  28           HB1      LYS  28 -17.010   7.179   4.840
  231   1HG   LYS  28           HG2      LYS  28 -16.428   9.388   5.709
  232   2HG   LYS  28           HG1      LYS  28 -15.722   9.836   4.156
  233   1HD   LYS  28           HD2      LYS  28 -17.817  10.741   3.857
  234   2HD   LYS  28           HD1      LYS  28 -18.153   9.104   3.292
  235   1HE   LYS  28           HE2      LYS  28 -18.907   8.490   5.575
  236   2HE   LYS  28           HE1      LYS  28 -18.622  10.149   6.101
  237   1HZ   LYS  28           HZ2      LYS  28 -20.467   9.359   3.913
  238   2HZ   LYS  28           HZ1      LYS  28 -20.949   9.726   5.502
  239   3HZ   LYS  28           HZ3      LYS  28 -20.244  10.926   4.533
  240    H    LYS  29           HN       LYS  29 -16.349   5.861   6.189
  241    HA   LYS  29           HA       LYS  29 -14.701   3.436   5.827
  242   1HB   LYS  29           HB2      LYS  29 -17.277   3.686   7.398
  243   2HB   LYS  29           HB1      LYS  29 -16.004   2.480   7.591
  244   1HG   LYS  29           HG2      LYS  29 -15.792   5.446   8.184
  245   2HG   LYS  29           HG1      LYS  29 -15.778   4.133   9.361
  246   1HD   LYS  29           HD2      LYS  29 -13.757   3.308   7.783
  247   2HD   LYS  29           HD1      LYS  29 -13.628   5.047   7.518
  248   1HE   LYS  29           HE2      LYS  29 -12.542   5.201   9.483
  249   2HE   LYS  29           HE1      LYS  29 -14.042   4.740  10.285
  250   1HZ   LYS  29           HZ1      LYS  29 -12.408   2.618   9.106
  251   2HZ   LYS  29           HZ3      LYS  29 -11.858   3.329  10.545
  252   3HZ   LYS  29           HZ2      LYS  29 -13.387   2.591  10.496
  253    H    SER  30           HN       SER  30 -17.699   4.809   4.700
  254    HA   SER  30           HA       SER  30 -18.732   2.272   3.661
  255   1HB   SER  30           HB2      SER  30 -20.405   3.788   2.529
  256   2HB   SER  30           HB1      SER  30 -20.343   3.968   4.280
  257    HG   SER  30           HG       SER  30 -20.035   5.841   2.496
  258    H    GLU  31           HN       GLU  31 -17.234   5.203   2.265
  259    HA   GLU  31           HA       GLU  31 -17.204   4.081  -0.421
  260   1HB   GLU  31           HB2      GLU  31 -17.111   6.595   0.309
  261   2HB   GLU  31           HB1      GLU  31 -15.386   6.300   0.518
  262   1HG   GLU  31           HG2      GLU  31 -15.031   5.927  -1.750
  263   2HG   GLU  31           HG1      GLU  31 -16.698   5.423  -2.031
  264    H    LEU  32           HN       LEU  32 -15.197   3.929   2.392
  265    HA   LEU  32           HA       LEU  32 -12.790   3.070   0.978
  266   1HB   LEU  32           HB2      LEU  32 -12.429   4.078   3.116
  267   2HB   LEU  32           HB1      LEU  32 -13.643   3.057   3.883
  268    HG   LEU  32           HG       LEU  32 -12.254   1.077   3.530
  269   1HD1  LEU  32          HD12      LEU  32 -11.049   2.727   1.555
  270   2HD1  LEU  32          HD11      LEU  32  -9.796   2.328   2.729
  271   3HD1  LEU  32          HD13      LEU  32 -10.686   1.040   1.917
  272   1HD2  LEU  32          HD22      LEU  32 -11.861   2.777   5.471
  273   2HD2  LEU  32          HD21      LEU  32 -10.640   1.537   5.181
  274   3HD2  LEU  32          HD23      LEU  32 -10.381   3.182   4.602
  275    H    LYS  33           HN       LYS  33 -15.400   1.519   2.822
  276    HA   LYS  33           HA       LYS  33 -14.494  -1.164   2.661
  277   1HB   LYS  33           HB2      LYS  33 -16.582  -0.070   3.855
  278   2HB   LYS  33           HB1      LYS  33 -17.409  -0.505   2.362
  279   1HG   LYS  33           HG2      LYS  33 -16.870  -2.827   2.637
  280   2HG   LYS  33           HG1      LYS  33 -15.756  -2.475   3.957
  281   1HD   LYS  33           HD2      LYS  33 -17.709  -1.562   5.263
  282   2HD   LYS  33           HD1      LYS  33 -18.768  -2.150   3.981
  283   1HE   LYS  33           HE2      LYS  33 -16.790  -3.986   5.322
  284   2HE   LYS  33           HE1      LYS  33 -18.383  -3.697   6.023
  285   1HZ   LYS  33           HZ1      LYS  33 -18.197  -4.379   3.177
  286   2HZ   LYS  33           HZ3      LYS  33 -18.002  -5.619   4.317
  287   3HZ   LYS  33           HZ2      LYS  33 -19.437  -4.709   4.291
  288    H    GLU  34           HN       GLU  34 -16.407   0.789   0.401
  289    HA   GLU  34           HA       GLU  34 -16.704  -1.370  -1.526
  290   1HB   GLU  34           HB2      GLU  34 -17.989   0.142  -2.719
  291   2HB   GLU  34           HB1      GLU  34 -18.056   0.909  -1.135
  292   1HG   GLU  34           HG2      GLU  34 -17.437   2.718  -2.418
  293   2HG   GLU  34           HG1      GLU  34 -15.849   2.106  -1.978
  294    H    LEU  35           HN       LEU  35 -14.479   1.245  -0.939
  295    HA   LEU  35           HA       LEU  35 -13.069   1.317  -3.386
  296   1HB   LEU  35           HB2      LEU  35 -12.815   2.505  -0.890
  297   2HB   LEU  35           HB1      LEU  35 -11.350   1.525  -1.017
  298    HG   LEU  35           HG       LEU  35 -10.953   3.750  -1.965
  299   1HD1  LEU  35          HD11      LEU  35 -10.397   1.329  -3.159
  300   2HD1  LEU  35          HD13      LEU  35 -11.133   2.235  -4.480
  301   3HD1  LEU  35          HD12      LEU  35  -9.713   2.878  -3.655
  302   1HD2  LEU  35          HD21      LEU  35 -13.600   3.302  -3.026
  303   2HD2  LEU  35          HD23      LEU  35 -12.663   4.795  -2.997
  304   3HD2  LEU  35          HD22      LEU  35 -12.484   3.666  -4.341
  305    H    ILE  36           HN       ILE  36 -12.610  -0.807  -0.560
  306    HA   ILE  36           HA       ILE  36 -10.395  -2.222  -1.838
  307    HB   ILE  36           HB       ILE  36 -11.816  -3.452   0.461
  308   1HG1  ILE  36          HG12      ILE  36 -10.571  -0.702   0.518
  309   2HG1  ILE  36          HG11      ILE  36 -12.084  -1.240   1.244
  310   1HG2  ILE  36          HG23      ILE  36  -9.419  -3.836  -0.765
  311   2HG2  ILE  36          HG22      ILE  36  -8.943  -2.733   0.527
  312   3HG2  ILE  36          HG21      ILE  36  -9.729  -4.261   0.918
  313   1HD1  ILE  36          HD13      ILE  36 -10.455  -2.854   2.596
  314   2HD1  ILE  36          HD12      ILE  36  -9.282  -1.591   2.229
  315   3HD1  ILE  36          HD11      ILE  36 -10.747  -1.198   3.131
  316    H    ASN  37           HN       ASN  37 -13.758  -3.064  -0.973
  317    HA   ASN  37           HA       ASN  37 -13.577  -5.643  -2.290
  318   1HB   ASN  37           HB2      ASN  37 -15.102  -5.046  -0.343
  319   2HB   ASN  37           HB1      ASN  37 -16.104  -4.185  -1.511
  320   1HD2  ASN  37          HD22      ASN  37 -17.495  -7.613  -1.339
  321   2HD2  ASN  37          HD21      ASN  37 -17.386  -6.270  -0.306
  322    H    ASN  38           HN       ASN  38 -13.732  -2.624  -3.643
  323    HA   ASN  38           HA       ASN  38 -15.406  -3.629  -5.908
  324   1HB   ASN  38           HB2      ASN  38 -16.078  -1.471  -4.652
  325   2HB   ASN  38           HB1      ASN  38 -14.703  -0.730  -5.472
  326   1HD2  ASN  38          HD22      ASN  38 -16.367  -0.500  -8.571
  327   2HD2  ASN  38          HD21      ASN  38 -14.979  -0.141  -7.662
  328    H    GLU  39           HN       GLU  39 -12.881  -1.105  -5.675
  329    HA   GLU  39           HA       GLU  39 -11.780  -2.036  -8.237
  330   1HB   GLU  39           HB2      GLU  39 -11.016   0.230  -6.374
  331   2HB   GLU  39           HB1      GLU  39 -10.204  -0.099  -7.906
  332   1HG   GLU  39           HG2      GLU  39 -12.443   0.072  -9.044
  333   2HG   GLU  39           HG1      GLU  39 -13.123   0.606  -7.506
  334    H    LEU  40           HN       LEU  40 -11.529  -3.391  -5.391
  335    HA   LEU  40           HA       LEU  40  -8.627  -4.019  -5.727
  336   1HB   LEU  40           HB2      LEU  40  -9.829  -2.754  -3.510
  337   2HB   LEU  40           HB1      LEU  40  -9.556  -4.418  -3.006
  338    HG   LEU  40           HG       LEU  40  -7.652  -2.734  -2.604
  339   1HD1  LEU  40          HD12      LEU  40  -7.568  -5.308  -2.657
  340   2HD1  LEU  40          HD11      LEU  40  -6.853  -5.124  -4.259
  341   3HD1  LEU  40          HD13      LEU  40  -6.045  -4.443  -2.848
  342   1HD2  LEU  40          HD23      LEU  40  -8.014  -2.238  -5.314
  343   2HD2  LEU  40          HD22      LEU  40  -6.616  -1.754  -4.357
  344   3HD2  LEU  40          HD21      LEU  40  -6.575  -3.260  -5.274
  345    H    SER  41           HN       SER  41 -11.851  -5.127  -4.855
  346    HA   SER  41           HA       SER  41 -11.071  -7.855  -4.278
  347   1HB   SER  41           HB2      SER  41 -13.390  -6.385  -3.988
  348   2HB   SER  41           HB1      SER  41 -13.791  -7.462  -5.321
  349    HG   SER  41           HG       SER  41 -14.071  -8.888  -3.805
  350    H    HIS  42           HN       HIS  42  -9.671  -8.247  -6.173
  351    HA   HIS  42           HA       HIS  42 -11.274  -8.944  -8.599
  352   1HB   HIS  42           HB2      HIS  42  -9.639  -6.966  -8.816
  353   2HB   HIS  42           HB1      HIS  42  -8.355  -8.163  -8.662
  354    HD1  HIS  42           HD1      HIS  42  -7.496  -8.632 -10.957
  355    HD2  HIS  42           HD2      HIS  42 -11.653  -8.317 -10.914
  356    HE1  HIS  42           HE1      HIS  42  -8.276  -9.144 -13.311
  357    H    PHE  43           HN       PHE  43  -9.218 -10.009  -6.112
  358    HA   PHE  43           HA       PHE  43  -8.962 -12.652  -7.461
  359   1HB   PHE  43           HB2      PHE  43  -6.650 -12.785  -6.315
  360   2HB   PHE  43           HB1      PHE  43  -6.771 -11.788  -7.765
  361    HD1  PHE  43           HD2      PHE  43  -7.075  -9.289  -7.524
  362    HD2  PHE  43           HD1      PHE  43  -6.104 -11.830  -4.201
  363    HE1  PHE  43           HE2      PHE  43  -6.343  -7.308  -6.223
  364    HE2  PHE  43           HE1      PHE  43  -5.370  -9.847  -2.901
  365    HZ   PHE  43           HZ       PHE  43  -5.490  -7.587  -3.913
  366    H    LEU  44           HN       LEU  44 -10.711 -11.482  -5.328
  367    HA   LEU  44           HA       LEU  44  -9.799 -12.996  -2.937
  368   1HB   LEU  44           HB2      LEU  44 -10.675 -10.575  -2.836
  369   2HB   LEU  44           HB1      LEU  44 -12.269 -11.266  -3.135
  370    HG   LEU  44           HG       LEU  44 -10.822 -12.713  -1.055
  371   1HD1  LEU  44          HD12      LEU  44 -10.094 -10.159  -0.930
  372   2HD1  LEU  44          HD11      LEU  44 -11.688  -9.976  -0.200
  373   3HD1  LEU  44          HD13      LEU  44 -10.501 -11.053   0.533
  374   1HD2  LEU  44          HD22      LEU  44 -13.484 -11.907  -1.784
  375   2HD2  LEU  44          HD21      LEU  44 -12.991 -13.113  -0.597
  376   3HD2  LEU  44          HD23      LEU  44 -13.180 -11.427  -0.114
  377    H    GLU  45           HN       GLU  45 -11.039 -14.704  -2.091
  378    HA   GLU  45           HA       GLU  45 -13.645 -15.408  -3.094
  379   1HB   GLU  45           HB2      GLU  45 -12.843 -17.596  -4.172
  380   2HB   GLU  45           HB1      GLU  45 -12.592 -16.121  -5.104
  381   1HG   GLU  45           HG2      GLU  45 -10.325 -16.237  -4.921
  382   2HG   GLU  45           HG1      GLU  45 -10.392 -16.814  -3.257
  383    H    GLU  46           HN       GLU  46 -10.674 -16.416  -1.473
  384    HA   GLU  46           HA       GLU  46 -12.373 -18.008   0.388
  385   1HB   GLU  46           HB2      GLU  46 -11.194 -19.776  -0.461
  386   2HB   GLU  46           HB1      GLU  46  -9.922 -18.744  -1.104
  387   1HG   GLU  46           HG2      GLU  46  -8.669 -18.854   0.820
  388   2HG   GLU  46           HG1      GLU  46 -10.086 -19.000   1.861
  389    H    ILE  47           HN       ILE  47  -9.504 -15.974  -0.041
  390    HA   ILE  47           HA       ILE  47  -8.425 -14.550   1.480
  391    HB   ILE  47           HB       ILE  47 -10.870 -15.069   3.201
  392   1HG1  ILE  47          HG12      ILE  47 -10.359 -12.749   1.321
  393   2HG1  ILE  47          HG11      ILE  47 -11.289 -14.171   0.849
  394   1HG2  ILE  47          HG23      ILE  47  -8.702 -12.956   3.219
  395   2HG2  ILE  47          HG22      ILE  47 -10.228 -12.770   4.083
  396   3HG2  ILE  47          HG21      ILE  47  -9.123 -14.076   4.514
  397   1HD1  ILE  47          HD12      ILE  47 -12.100 -13.010   3.433
  398   2HD1  ILE  47          HD11      ILE  47 -12.356 -11.944   2.053
  399   3HD1  ILE  47          HD13      ILE  47 -13.093 -13.546   2.078
  400    H    LYS  48           HN       LYS  48  -6.632 -15.479   2.356
  401    HA   LYS  48           HA       LYS  48  -6.913 -17.856   4.086
  402   1HB   LYS  48           HB2      LYS  48  -5.130 -17.840   2.387
  403   2HB   LYS  48           HB1      LYS  48  -4.443 -16.388   3.118
  404   1HG   LYS  48           HG2      LYS  48  -3.276 -18.465   3.851
  405   2HG   LYS  48           HG1      LYS  48  -4.009 -17.588   5.196
  406   1HD   LYS  48           HD2      LYS  48  -5.944 -19.093   5.153
  407   2HD   LYS  48           HD1      LYS  48  -5.267 -19.949   3.766
  408   1HE   LYS  48           HE2      LYS  48  -3.915 -19.715   6.469
  409   2HE   LYS  48           HE1      LYS  48  -4.821 -21.126   5.920
  410   1HZ   LYS  48           HZ2      LYS  48  -3.191 -20.811   3.868
  411   2HZ   LYS  48           HZ1      LYS  48  -2.204 -20.157   5.085
  412   3HZ   LYS  48           HZ3      LYS  48  -2.779 -21.746   5.225
  413    H    GLU  49           HN       GLU  49  -5.637 -14.527   4.303
  414    HA   GLU  49           HA       GLU  49  -5.095 -14.811   7.163
  415   1HB   GLU  49           HB2      GLU  49  -4.810 -12.670   5.116
  416   2HB   GLU  49           HB1      GLU  49  -5.014 -12.143   6.786
  417   1HG   GLU  49           HG2      GLU  49  -2.984 -14.230   5.948
  418   2HG   GLU  49           HG1      GLU  49  -2.606 -12.511   6.072
  419    H    GLN  50           HN       GLN  50  -7.336 -15.527   7.694
  420    HA   GLN  50           HA       GLN  50  -9.625 -13.871   7.337
  421   1HB   GLN  50           HB2      GLN  50  -9.732 -16.241   8.073
  422   2HB   GLN  50           HB1      GLN  50  -9.032 -15.774   9.624
  423   1HG   GLN  50           HG2      GLN  50 -11.033 -14.023   9.613
  424   2HG   GLN  50           HG1      GLN  50 -11.761 -15.216   8.535
  425   1HE2  GLN  50          HE22      GLN  50 -11.807 -17.783  11.114
  426   2HE2  GLN  50          HE21      GLN  50 -11.498 -17.609   9.455
  427    H    GLU  51           HN       GLU  51  -6.926 -13.618   9.506
  428    HA   GLU  51           HA       GLU  51  -8.292 -11.870  11.412
  429   1HB   GLU  51           HB2      GLU  51  -5.564 -12.990  11.067
  430   2HB   GLU  51           HB1      GLU  51  -5.662 -11.437  11.899
  431   1HG   GLU  51           HG2      GLU  51  -7.669 -12.694  13.160
  432   2HG   GLU  51           HG1      GLU  51  -6.697 -14.104  12.735
  433    H    VAL  52           HN       VAL  52  -6.167 -11.451   8.604
  434    HA   VAL  52           HA       VAL  52  -5.837  -8.600   8.995
  435    HB   VAL  52           HB       VAL  52  -5.474 -10.343   6.536
  436   1HG1  VAL  52          HG12      VAL  52  -4.791  -7.444   7.086
  437   2HG1  VAL  52          HG11      VAL  52  -4.045  -8.378   5.787
  438   3HG1  VAL  52          HG13      VAL  52  -5.784  -8.087   5.778
  439   1HG2  VAL  52          HG22      VAL  52  -4.021 -10.276   8.883
  440   2HG2  VAL  52          HG21      VAL  52  -3.392 -10.793   7.319
  441   3HG2  VAL  52          HG23      VAL  52  -3.148  -9.133   7.864
  442    H    VAL  53           HN       VAL  53  -7.984 -10.578   6.944
  443    HA   VAL  53           HA       VAL  53  -9.313  -8.215   5.864
  444    HB   VAL  53           HB       VAL  53 -10.219 -11.112   5.851
  445   1HG1  VAL  53          HG12      VAL  53 -11.955  -9.367   5.346
  446   2HG1  VAL  53          HG11      VAL  53 -10.943  -8.811   4.013
  447   3HG1  VAL  53          HG13      VAL  53 -11.620 -10.439   3.984
  448   1HG2  VAL  53          HG23      VAL  53  -8.060  -9.749   4.469
  449   2HG2  VAL  53          HG22      VAL  53  -8.487 -11.461   4.445
  450   3HG2  VAL  53          HG21      VAL  53  -9.258 -10.343   3.319
  451    H    ASP  54           HN       ASP  54  -9.715 -10.310   8.615
  452    HA   ASP  54           HA       ASP  54 -12.454  -9.476   9.168
  453   1HB   ASP  54           HB2      ASP  54 -11.703 -11.635   9.993
  454   2HB   ASP  54           HB1      ASP  54 -10.379 -10.876  10.878
  455    H    LYS  55           HN       LYS  55  -9.232  -8.330   9.979
  456    HA   LYS  55           HA       LYS  55 -10.209  -6.593  12.126
  457   1HB   LYS  55           HB2      LYS  55  -7.906  -5.676  12.112
  458   2HB   LYS  55           HB1      LYS  55  -7.907  -7.437  12.205
  459   1HG   LYS  55           HG2      LYS  55  -7.496  -7.586   9.791
  460   2HG   LYS  55           HG1      LYS  55  -7.544  -5.828   9.663
  461   1HD   LYS  55           HD2      LYS  55  -5.220  -6.526   9.763
  462   2HD   LYS  55           HD1      LYS  55  -5.629  -5.713  11.275
  463   1HE   LYS  55           HE2      LYS  55  -6.300  -8.368  11.759
  464   2HE   LYS  55           HE1      LYS  55  -4.810  -8.481  10.822
  465   1HZ   LYS  55           HZ1      LYS  55  -4.720  -6.419  12.808
  466   2HZ   LYS  55           HZ3      LYS  55  -4.983  -7.950  13.484
  467   3HZ   LYS  55           HZ2      LYS  55  -3.623  -7.681  12.503
  468    H    VAL  56           HN       VAL  56  -9.137  -6.113   8.738
  469    HA   VAL  56           HA       VAL  56  -9.693  -3.264   8.829
  470    HB   VAL  56           HB       VAL  56  -9.408  -3.395   6.376
  471   1HG1  VAL  56          HG12      VAL  56  -7.477  -4.539   8.309
  472   2HG1  VAL  56          HG11      VAL  56  -7.110  -4.806   6.606
  473   3HG1  VAL  56          HG13      VAL  56  -7.298  -3.163   7.222
  474   1HG2  VAL  56          HG23      VAL  56  -9.593  -6.335   6.964
  475   2HG2  VAL  56          HG22      VAL  56 -10.376  -5.409   5.685
  476   3HG2  VAL  56          HG21      VAL  56  -8.655  -5.777   5.579
  477    H    MET  57           HN       MET  57 -11.359  -6.111   7.518
  478    HA   MET  57           HA       MET  57 -13.663  -4.722   6.532
  479   1HB   MET  57           HB2      MET  57 -13.090  -7.075   5.939
  480   2HB   MET  57           HB1      MET  57 -13.447  -7.558   7.598
  481   1HG   MET  57           HG2      MET  57 -15.588  -7.833   6.975
  482   2HG   MET  57           HG1      MET  57 -15.686  -6.084   6.771
  483   1HE   MET  57           HE2      MET  57 -14.323  -5.038   4.800
  484   2HE   MET  57           HE1      MET  57 -13.188  -6.264   4.238
  485   3HE   MET  57           HE3      MET  57 -14.413  -5.617   3.139
  486    H    GLU  58           HN       GLU  58 -12.652  -5.706   9.726
  487    HA   GLU  58           HA       GLU  58 -15.304  -5.492  10.927
  488   1HB   GLU  58           HB2      GLU  58 -12.518  -5.877  11.910
  489   2HB   GLU  58           HB1      GLU  58 -13.655  -5.142  13.038
  490   1HG   GLU  58           HG2      GLU  58 -15.224  -7.015  12.686
  491   2HG   GLU  58           HG1      GLU  58 -14.081  -7.760  11.566
  492    H    THR  59           HN       THR  59 -12.374  -3.421  11.118
  493    HA   THR  59           HA       THR  59 -13.634  -1.229  12.415
  494    HB   THR  59           HB       THR  59 -11.574  -0.707  10.302
  495    HG1  THR  59           HG1      THR  59 -11.266  -2.317  12.593
  496   1HG2  THR  59          HG21      THR  59 -12.281   0.265  13.047
  497   2HG2  THR  59          HG23      THR  59 -10.627   0.464  12.469
  498   3HG2  THR  59          HG22      THR  59 -11.966   1.193  11.581
  499    H    LEU  60           HN       LEU  60 -13.726  -2.379   9.153
  500    HA   LEU  60           HA       LEU  60 -14.734  -0.003   7.883
  501   1HB   LEU  60           HB2      LEU  60 -14.485  -2.902   7.231
  502   2HB   LEU  60           HB1      LEU  60 -15.666  -1.984   6.305
  503    HG   LEU  60           HG       LEU  60 -12.779  -1.152   6.677
  504   1HD1  LEU  60          HD11      LEU  60 -14.006  -3.094   4.893
  505   2HD1  LEU  60          HD13      LEU  60 -13.263  -1.776   3.987
  506   3HD1  LEU  60          HD12      LEU  60 -12.300  -2.717   5.125
  507   1HD2  LEU  60          HD23      LEU  60 -14.870   0.440   6.067
  508   2HD2  LEU  60          HD22      LEU  60 -13.268   0.678   5.372
  509   3HD2  LEU  60          HD21      LEU  60 -14.507  -0.177   4.455
  510    H    ASP  61           HN       ASP  61 -16.394  -3.010   8.874
  511    HA   ASP  61           HA       ASP  61 -19.019  -1.750   8.622
  512   1HB   ASP  61           HB2      ASP  61 -18.089  -4.359   8.552
  513   2HB   ASP  61           HB1      ASP  61 -18.890  -4.265  10.122
  514    H    GLU  62           HN       GLU  62 -16.661  -1.429  10.888
  515    HA   GLU  62           HA       GLU  62 -18.289  -1.688  13.299
  516   1HB   GLU  62           HB2      GLU  62 -15.805  -2.027  13.276
  517   2HB   GLU  62           HB1      GLU  62 -15.618  -0.303  12.949
  518   1HG   GLU  62           HG2      GLU  62 -16.576   0.303  15.049
  519   2HG   GLU  62           HG1      GLU  62 -17.180  -1.332  15.325
  520    H    ASP  63           HN       ASP  63 -16.851   1.053  11.529
  521    HA   ASP  63           HA       ASP  63 -18.594   2.904  13.042
  522   1HB   ASP  63           HB2      ASP  63 -16.045   3.099  11.709
  523   2HB   ASP  63           HB1      ASP  63 -17.148   4.315  11.067
  524    H    GLY  64           HN       GLY  64 -17.788   2.429   9.594
  525   1HA   GLY  64           HA2      GLY  64 -19.326   2.244   7.781
  526   2HA   GLY  64           HA1      GLY  64 -20.648   2.564   8.906
  527    H    ASP  65           HN       ASP  65 -20.072   4.946  10.020
  528    HA   ASP  65           HA       ASP  65 -19.941   6.767   7.658
  529   1HB   ASP  65           HB2      ASP  65 -22.033   6.649   9.199
  530   2HB   ASP  65           HB1      ASP  65 -21.042   7.534  10.359
  531    H    GLY  66           HN       GLY  66 -17.591   5.723   9.077
  532   1HA   GLY  66           HA2      GLY  66 -16.621   8.017  10.655
  533   2HA   GLY  66           HA1      GLY  66 -15.755   6.504  10.392
  534    H    GLU  67           HN       GLU  67 -14.124   8.502  10.022
  535    HA   GLU  67           HA       GLU  67 -14.096   8.984   7.070
  536   1HB   GLU  67           HB2      GLU  67 -12.639  11.033   7.805
  537   2HB   GLU  67           HB1      GLU  67 -14.394  11.137   7.944
  538   1HG   GLU  67           HG2      GLU  67 -14.363  11.013  10.242
  539   2HG   GLU  67           HG1      GLU  67 -12.910  10.013  10.272
  540    H    CYS  68           HN       CYS  68 -12.314   8.204   6.043
  541    HA   CYS  68           HA       CYS  68 -10.117   7.111   7.719
  542   1HB   CYS  68           HB2      CYS  68 -11.207   6.540   5.007
  543   2HB   CYS  68           HB1      CYS  68  -9.474   6.309   5.229
  544    HG   CYS  68           HG       CYS  68 -11.637   4.513   6.363
  545    H    ASP  69           HN       ASP  69  -7.902   7.632   7.204
  546    HA   ASP  69           HA       ASP  69  -7.622  10.387   6.179
  547   1HB   ASP  69           HB2      ASP  69  -5.584   8.511   7.420
  548   2HB   ASP  69           HB1      ASP  69  -5.308  10.210   7.033
  549    H    PHE  70           HN       PHE  70  -4.979  10.194   5.179
  550    HA   PHE  70           HA       PHE  70  -5.565   8.899   2.579
  551   1HB   PHE  70           HB2      PHE  70  -3.066  10.030   2.293
  552   2HB   PHE  70           HB1      PHE  70  -4.584  10.816   1.872
  553    HD1  PHE  70           HD1      PHE  70  -5.661  12.405   3.460
  554    HD2  PHE  70           HD2      PHE  70  -1.794  10.699   4.227
  555    HE1  PHE  70           HE1      PHE  70  -5.236  14.143   5.179
  556    HE2  PHE  70           HE2      PHE  70  -1.371  12.437   5.946
  557    HZ   PHE  70           HZ       PHE  70  -3.091  14.158   6.421
  558    H    GLN  71           HN       GLN  71  -3.067   8.845   5.116
  559    HA   GLN  71           HA       GLN  71  -1.626   6.650   3.852
  560   1HB   GLN  71           HB2      GLN  71  -0.206   6.718   5.757
  561   2HB   GLN  71           HB1      GLN  71  -0.679   8.394   5.487
  562   1HG   GLN  71           HG2      GLN  71  -1.469   8.470   7.589
  563   2HG   GLN  71           HG1      GLN  71  -2.677   7.265   7.143
  564   1HE2  GLN  71          HE22      GLN  71  -0.133   4.627   8.126
  565   2HE2  GLN  71          HE21      GLN  71  -0.773   5.095   6.625
  566    H    GLU  72           HN       GLU  72  -4.364   6.959   5.921
  567    HA   GLU  72           HA       GLU  72  -4.215   4.274   7.048
  568   1HB   GLU  72           HB2      GLU  72  -6.159   6.537   7.075
  569   2HB   GLU  72           HB1      GLU  72  -6.812   4.925   7.366
  570   1HG   GLU  72           HG2      GLU  72  -4.418   5.116   8.873
  571   2HG   GLU  72           HG1      GLU  72  -5.319   6.605   9.163
  572    H    PHE  73           HN       PHE  73  -6.372   5.796   4.620
  573    HA   PHE  73           HA       PHE  73  -7.584   3.356   3.773
  574   1HB   PHE  73           HB2      PHE  73  -8.798   5.106   2.927
  575   2HB   PHE  73           HB1      PHE  73  -7.384   6.143   2.773
  576    HD1  PHE  73           HD2      PHE  73  -9.429   3.551   1.140
  577    HD2  PHE  73           HD1      PHE  73  -6.010   6.116   0.759
  578    HE1  PHE  73           HE2      PHE  73  -9.346   3.076  -1.292
  579    HE2  PHE  73           HE1      PHE  73  -5.926   5.643  -1.674
  580    HZ   PHE  73           HZ       PHE  73  -7.596   4.123  -2.700
  581    H    MET  74           HN       MET  74  -4.470   4.731   3.139
  582    HA   MET  74           HA       MET  74  -3.959   3.183   0.711
  583   1HB   MET  74           HB2      MET  74  -2.649   5.261   2.236
  584   2HB   MET  74           HB1      MET  74  -1.509   3.964   1.887
  585   1HG   MET  74           HG2      MET  74  -3.068   4.420  -0.464
  586   2HG   MET  74           HG1      MET  74  -2.480   5.980   0.112
  587   1HE   MET  74           HE3      MET  74  -2.026   2.659  -1.158
  588   2HE   MET  74           HE2      MET  74  -1.422   3.549  -2.553
  589   3HE   MET  74           HE1      MET  74  -0.346   2.464  -1.678
  590    H    ALA  75           HN       ALA  75  -2.776   3.008   4.083
  591    HA   ALA  75           HA       ALA  75  -1.388   0.512   3.678
  592   1HB   ALA  75           HB2      ALA  75  -2.232   2.131   6.064
  593   2HB   ALA  75           HB1      ALA  75  -1.674   0.475   6.304
  594   3HB   ALA  75           HB3      ALA  75  -0.611   1.664   5.552
  595    H    PHE  76           HN       PHE  76  -4.682   1.320   4.018
  596    HA   PHE  76           HA       PHE  76  -5.532  -1.206   5.220
  597   1HB   PHE  76           HB2      PHE  76  -6.726   1.324   4.581
  598   2HB   PHE  76           HB1      PHE  76  -7.681   0.045   3.831
  599    HD1  PHE  76           HD1      PHE  76  -5.724   0.291   7.025
  600    HD2  PHE  76           HD2      PHE  76  -9.507  -0.518   5.164
  601    HE1  PHE  76           HE1      PHE  76  -6.689  -0.281   9.235
  602    HE2  PHE  76           HE2      PHE  76 -10.471  -1.091   7.374
  603    HZ   PHE  76           HZ       PHE  76  -9.061  -0.973   9.411
  604    H    VAL  77           HN       VAL  77  -5.203   0.141   1.977
  605    HA   VAL  77           HA       VAL  77  -6.570  -2.057   0.647
  606    HB   VAL  77           HB       VAL  77  -4.682   0.101  -0.337
  607   1HG1  VAL  77          HG12      VAL  77  -6.057  -2.170  -1.760
  608   2HG1  VAL  77          HG11      VAL  77  -5.762  -0.648  -2.600
  609   3HG1  VAL  77          HG13      VAL  77  -4.409  -1.576  -1.956
  610   1HG2  VAL  77          HG21      VAL  77  -7.629  -0.222  -0.035
  611   2HG2  VAL  77          HG23      VAL  77  -6.641   1.235   0.079
  612   3HG2  VAL  77          HG22      VAL  77  -7.067   0.578  -1.502
  613    H    SER  78           HN       SER  78  -3.304  -1.434   1.741
  614    HA   SER  78           HA       SER  78  -2.093  -3.525   0.108
  615   1HB   SER  78           HB2      SER  78  -1.061  -2.114   2.582
  616   2HB   SER  78           HB1      SER  78  -0.102  -3.139   1.515
  617    HG   SER  78           HG       SER  78   0.144  -0.991   0.909
  618    H    MET  79           HN       MET  79  -3.290  -3.318   3.452
  619    HA   MET  79           HA       MET  79  -2.287  -5.870   4.276
  620   1HB   MET  79           HB2      MET  79  -4.766  -4.479   5.317
  621   2HB   MET  79           HB1      MET  79  -3.733  -5.619   6.173
  622   1HG   MET  79           HG2      MET  79  -2.100  -3.486   5.186
  623   2HG   MET  79           HG1      MET  79  -3.472  -2.791   6.050
  624   1HE   MET  79           HE3      MET  79  -3.009  -1.968   8.041
  625   2HE   MET  79           HE2      MET  79  -4.017  -3.272   8.659
  626   3HE   MET  79           HE1      MET  79  -2.522  -2.855   9.490
  627    H    VAL  80           HN       VAL  80  -5.276  -4.909   2.633
  628    HA   VAL  80           HA       VAL  80  -6.447  -7.563   2.928
  629    HB   VAL  80           HB       VAL  80  -8.115  -6.640   1.246
  630   1HG1  VAL  80          HG12      VAL  80  -7.637  -5.983   4.013
  631   2HG1  VAL  80          HG11      VAL  80  -8.433  -4.630   3.210
  632   3HG1  VAL  80          HG13      VAL  80  -9.177  -6.229   3.190
  633   1HG2  VAL  80          HG23      VAL  80  -6.089  -4.653   0.994
  634   2HG2  VAL  80          HG22      VAL  80  -7.636  -4.734   0.160
  635   3HG2  VAL  80          HG21      VAL  80  -7.509  -3.883   1.699
  636    H    THR  81           HN       THR  81  -4.774  -5.770   0.359
  637    HA   THR  81           HA       THR  81  -5.140  -7.720  -1.704
  638    HB   THR  81           HB       THR  81  -2.615  -6.093  -1.430
  639    HG1  THR  81           HG1      THR  81  -5.129  -5.153  -1.379
  640   1HG2  THR  81          HG21      THR  81  -3.480  -7.775  -3.374
  641   2HG2  THR  81          HG23      THR  81  -4.175  -6.257  -3.940
  642   3HG2  THR  81          HG22      THR  81  -2.436  -6.388  -3.682
  643    H    THR  82           HN       THR  82  -3.339  -7.764   1.188
  644    HA   THR  82           HA       THR  82  -1.576  -9.954   0.204
  645    HB   THR  82           HB       THR  82  -1.505  -8.388   2.803
  646    HG1  THR  82           HG1      THR  82  -0.232  -7.055   1.791
  647   1HG2  THR  82          HG21      THR  82  -0.134 -10.777   1.836
  648   2HG2  THR  82          HG23      THR  82   0.987  -9.495   2.296
  649   3HG2  THR  82          HG22      THR  82  -0.192 -10.095   3.461
  650    H    ALA  83           HN       ALA  83  -4.412  -9.342   2.022
  651    HA   ALA  83           HA       ALA  83  -4.182 -11.833   3.589
  652   1HB   ALA  83           HB2      ALA  83  -6.416  -9.787   3.423
  653   2HB   ALA  83           HB1      ALA  83  -6.355 -11.141   4.551
  654   3HB   ALA  83           HB3      ALA  83  -5.165  -9.846   4.663
  655    H    CYS  84           HN       CYS  84  -4.092 -12.677   1.081
  656    HA   CYS  84           HA       CYS  84  -6.893 -13.513   0.434
  657   1HB   CYS  84           HB2      CYS  84  -4.903 -12.295  -1.226
  658   2HB   CYS  84           HB1      CYS  84  -5.169 -13.942  -1.800
  659    HG   CYS  84           HG       CYS  84  -7.473 -13.333  -2.529
  660    H    HIS  85           HN       HIS  85  -6.310 -15.593  -1.306
  661    HA   HIS  85           HA       HIS  85  -5.810 -17.773   0.403
  662   1HB   HIS  85           HB2      HIS  85  -5.356 -19.067  -1.706
  663   2HB   HIS  85           HB1      HIS  85  -6.837 -18.113  -1.772
  664    HD1  HIS  85           HD1      HIS  85  -6.960 -17.367  -4.166
  665    HD2  HIS  85           HD2      HIS  85  -3.158 -16.795  -2.553
  666    HE1  HIS  85           HE1      HIS  85  -5.622 -16.109  -5.912
  667    H    GLU  86           HN       GLU  86  -3.814 -19.371  -0.488
  668    HA   GLU  86           HA       GLU  86  -1.510 -18.567   0.821
  669   1HB   GLU  86           HB2      GLU  86  -2.162 -20.789  -0.566
  670   2HB   GLU  86           HB1      GLU  86  -1.057 -20.047  -1.723
  671   1HG   GLU  86           HG2      GLU  86   0.602 -20.979  -0.498
  672   2HG   GLU  86           HG1      GLU  86   0.264 -19.715   0.687
  673    H    PHE  87           HN       PHE  87  -0.781 -16.466   0.504
  674    HA   PHE  87           HA       PHE  87   0.277 -14.682  -0.591
  675   1HB   PHE  87           HB2      PHE  87   1.691 -16.839  -1.253
  676   2HB   PHE  87           HB1      PHE  87   1.038 -16.490  -2.854
  677    HD1  PHE  87           HD2      PHE  87   2.035 -14.187  -0.071
  678    HD2  PHE  87           HD1      PHE  87   2.768 -15.510  -4.092
  679    HE1  PHE  87           HE2      PHE  87   3.698 -12.369  -0.365
  680    HE2  PHE  87           HE1      PHE  87   4.429 -13.696  -4.388
  681    HZ   PHE  87           HZ       PHE  87   4.893 -12.124  -2.525
  682    H    PHE  88           HN       PHE  88   0.576 -14.607  -3.576
  683    HA   PHE  88           HA       PHE  88  -2.274 -13.964  -4.199
  684   1HB   PHE  88           HB2      PHE  88  -0.038 -12.890  -5.862
  685   2HB   PHE  88           HB1      PHE  88  -1.567 -12.133  -5.418
  686    HD1  PHE  88           HD1      PHE  88  -1.598 -12.418  -2.493
  687    HD2  PHE  88           HD2      PHE  88   1.642 -11.419  -5.126
  688    HE1  PHE  88           HE1      PHE  88  -0.467 -11.214  -0.642
  689    HE2  PHE  88           HE2      PHE  88   2.775 -10.214  -3.276
  690    HZ   PHE  88           HZ       PHE  88   1.719 -10.112  -1.034
  691    H    GLU  89           HN       GLU  89  -1.865 -16.561  -4.545
  692    HA   GLU  89           HA       GLU  89  -0.633 -17.356  -7.013
  693   1HB   GLU  89           HB2      GLU  89  -1.367 -18.835  -5.021
  694   2HB   GLU  89           HB1      GLU  89  -2.967 -18.798  -5.762
  695   1HG   GLU  89           HG2      GLU  89  -2.333 -20.122  -7.512
  696   2HG   GLU  89           HG1      GLU  89  -0.729 -19.396  -7.608
  697    H    HIS  90           HN       HIS  90  -1.337 -16.027  -8.698
  698    HA   HIS  90           HA       HIS  90  -4.260 -16.025  -9.282
  699   1HB   HIS  90           HB2      HIS  90  -3.453 -13.798  -9.279
  700   2HB   HIS  90           HB1      HIS  90  -1.968 -14.248 -10.116
  701    HD1  HIS  90           HD1      HIS  90  -2.007 -14.247 -12.653
  702    HD2  HIS  90           HD2      HIS  90  -5.813 -13.824 -11.006
  703    HE1  HIS  90           HE1      HIS  90  -3.565 -13.727 -14.577
  704    H    GLU  91           HN       GLU  91  -1.148 -17.106 -10.459
  705    HA   GLU  91           HA       GLU  91  -2.525 -18.254 -12.856
  706   1HB   GLU  91           HB2      GLU  91  -0.637 -16.526 -13.195
  707   2HB   GLU  91           HB1      GLU  91   0.450 -17.801 -12.643
  708   1HG   GLU  91           HG2      GLU  91   0.270 -17.807 -15.104
  709   2HG   GLU  91           HG1      GLU  91  -0.391 -19.292 -14.420
  710   1H    MET   0           HT2      MET   0  -7.639  -1.053 -15.323
  711   2H    MET   0           HT1      MET   0  -8.345  -2.595 -15.432
  712   3H    MET   0           HT3      MET   0  -7.894  -1.769 -16.843
  713    HA   MET   0           HA       MET   0  -9.751  -0.547 -16.900
  714   1HB   MET   0           HB2      MET   0 -10.503  -2.921 -16.474
  715   2HB   MET   0           HB1      MET   0 -10.665  -2.496 -14.770
  716   1HG   MET   0           HG2      MET   0 -12.240  -0.673 -15.400
  717   2HG   MET   0           HG1      MET   0 -12.127  -1.191 -17.083
  718   1HE   MET   0           HE3      MET   0 -14.538  -0.733 -16.167
  719   2HE   MET   0           HE2      MET   0 -14.994  -1.995 -17.309
  720   3HE   MET   0           HE1      MET   0 -15.624  -2.034 -15.664
  721    H    SER   1           HN       SER   1  -8.519  -1.010 -13.650
  722    HA   SER   1           HA       SER   1  -9.677   1.647 -12.930
  723   1HB   SER   1           HB2      SER   1 -11.012   0.437 -11.522
  724   2HB   SER   1           HB1      SER   1  -9.939  -0.961 -11.544
  725    HG   SER   1           HG       SER   1  -9.454  -0.218  -9.620
  726    H    GLU   2           HN       GLU   2  -8.410   2.766 -11.242
  727    HA   GLU   2           HA       GLU   2  -5.545   2.382 -11.664
  728   1HB   GLU   2           HB2      GLU   2  -7.002   4.589 -11.235
  729   2HB   GLU   2           HB1      GLU   2  -6.573   4.235  -9.561
  730   1HG   GLU   2           HG2      GLU   2  -4.716   5.463 -10.125
  731   2HG   GLU   2           HG1      GLU   2  -4.161   3.883 -10.682
  732    H    LEU   3           HN       LEU   3  -7.883   1.671  -9.142
  733    HA   LEU   3           HA       LEU   3  -5.910   1.145  -7.081
  734   1HB   LEU   3           HB2      LEU   3  -8.555   1.569  -6.979
  735   2HB   LEU   3           HB1      LEU   3  -8.572  -0.195  -7.013
  736    HG   LEU   3           HG       LEU   3  -6.803  -0.077  -5.150
  737   1HD1  LEU   3          HD13      LEU   3  -6.526   2.467  -5.646
  738   2HD1  LEU   3          HD12      LEU   3  -7.972   2.653  -4.652
  739   3HD1  LEU   3          HD11      LEU   3  -6.518   1.933  -3.965
  740   1HD2  LEU   3          HD21      LEU   3  -9.710   0.652  -4.902
  741   2HD2  LEU   3          HD23      LEU   3  -8.898  -0.845  -4.447
  742   3HD2  LEU   3          HD22      LEU   3  -8.705   0.599  -3.454
  743    H    GLU   4           HN       GLU   4  -7.723  -0.873  -9.374
  744    HA   GLU   4           HA       GLU   4  -6.610  -3.359  -8.385
  745   1HB   GLU   4           HB2      GLU   4  -8.678  -3.551  -9.527
  746   2HB   GLU   4           HB1      GLU   4  -8.119  -2.569 -10.878
  747   1HG   GLU   4           HG2      GLU   4  -6.466  -4.950 -10.425
  748   2HG   GLU   4           HG1      GLU   4  -8.140  -5.332 -10.825
  749    H    LYS   5           HN       LYS   5  -5.956  -1.425 -11.334
  750    HA   LYS   5           HA       LYS   5  -3.768  -3.070 -12.200
  751   1HB   LYS   5           HB2      LYS   5  -5.157  -0.838 -13.184
  752   2HB   LYS   5           HB1      LYS   5  -3.487  -0.299 -13.009
  753   1HG   LYS   5           HG2      LYS   5  -2.854  -1.506 -14.799
  754   2HG   LYS   5           HG1      LYS   5  -3.551  -2.971 -14.108
  755   1HD   LYS   5           HD2      LYS   5  -4.857  -2.751 -16.012
  756   2HD   LYS   5           HD1      LYS   5  -5.831  -1.846 -14.851
  757   1HE   LYS   5           HE2      LYS   5  -5.662  -0.442 -16.775
  758   2HE   LYS   5           HE1      LYS   5  -4.537   0.230 -15.595
  759   1HZ   LYS   5           HZ3      LYS   5  -2.899  -1.410 -16.776
  760   2HZ   LYS   5           HZ2      LYS   5  -3.985  -1.236 -18.070
  761   3HZ   LYS   5           HZ1      LYS   5  -3.207   0.127 -17.422
  762    H    ALA   6           HN       ALA   6  -3.962  -0.327  -9.993
  763    HA   ALA   6           HA       ALA   6  -1.063   0.026  -9.901
  764   1HB   ALA   6           HB1      ALA   6  -2.595   1.917  -9.483
  765   2HB   ALA   6           HB3      ALA   6  -3.227   1.089  -8.061
  766   3HB   ALA   6           HB2      ALA   6  -1.549   1.628  -8.094
  767    H    MET   7           HN       MET   7  -3.400  -0.890  -7.340
  768    HA   MET   7           HA       MET   7  -1.513  -1.825  -5.483
  769   1HB   MET   7           HB2      MET   7  -3.742  -1.613  -4.715
  770   2HB   MET   7           HB1      MET   7  -4.378  -2.608  -6.025
  771   1HG   MET   7           HG2      MET   7  -4.232  -3.731  -3.730
  772   2HG   MET   7           HG1      MET   7  -3.493  -4.609  -5.069
  773   1HE   MET   7           HE3      MET   7  -3.180  -3.146  -1.677
  774   2HE   MET   7           HE2      MET   7  -1.530  -2.556  -1.506
  775   3HE   MET   7           HE1      MET   7  -2.656  -1.703  -2.556
  776    H    VAL   8           HN       VAL   8  -3.295  -3.773  -7.897
  777    HA   VAL   8           HA       VAL   8  -1.934  -6.213  -7.321
  778    HB   VAL   8           HB       VAL   8  -3.016  -5.414 -10.029
  779   1HG1  VAL   8          HG13      VAL   8  -2.745  -8.047  -8.550
  780   2HG1  VAL   8          HG12      VAL   8  -3.563  -7.855 -10.100
  781   3HG1  VAL   8          HG11      VAL   8  -1.831  -7.548  -9.973
  782   1HG2  VAL   8          HG22      VAL   8  -4.432  -5.211  -7.675
  783   2HG2  VAL   8          HG21      VAL   8  -5.152  -5.524  -9.252
  784   3HG2  VAL   8          HG23      VAL   8  -4.783  -6.865  -8.171
  785    H    ALA   9           HN       ALA   9  -1.029  -3.431  -9.251
  786    HA   ALA   9           HA       ALA   9   1.076  -4.693 -10.759
  787   1HB   ALA   9           HB3      ALA   9   0.453  -1.857  -9.959
  788   2HB   ALA   9           HB2      ALA   9   1.994  -2.240 -10.726
  789   3HB   ALA   9           HB1      ALA   9   0.483  -2.572 -11.571
  790    H    LEU  10           HN       LEU  10   0.952  -3.120  -7.580
  791    HA   LEU  10           HA       LEU  10   3.744  -3.136  -7.045
  792   1HB   LEU  10           HB2      LEU  10   1.295  -2.723  -5.549
  793   2HB   LEU  10           HB1      LEU  10   2.445  -3.667  -4.603
  794    HG   LEU  10           HG       LEU  10   3.837  -1.545  -5.960
  795   1HD1  LEU  10          HD11      LEU  10   1.237  -0.856  -4.684
  796   2HD1  LEU  10          HD13      LEU  10   2.608   0.187  -4.312
  797   3HD1  LEU  10          HD12      LEU  10   2.102  -0.041  -5.986
  798   1HD2  LEU  10          HD22      LEU  10   3.386  -2.558  -3.187
  799   2HD2  LEU  10          HD21      LEU  10   4.900  -2.303  -4.055
  800   3HD2  LEU  10          HD23      LEU  10   4.040  -0.929  -3.359
  801    H    ILE  11           HN       ILE  11   1.345  -5.690  -6.981
  802    HA   ILE  11           HA       ILE  11   2.957  -7.564  -5.469
  803    HB   ILE  11           HB       ILE  11   0.549  -7.822  -7.273
  804   1HG1  ILE  11          HG12      ILE  11  -0.566  -8.439  -5.240
  805   2HG1  ILE  11          HG11      ILE  11   0.964  -8.657  -4.391
  806   1HG2  ILE  11          HG21      ILE  11   2.299 -10.013  -6.152
  807   2HG2  ILE  11          HG23      ILE  11   0.590 -10.282  -6.489
  808   3HG2  ILE  11          HG22      ILE  11   1.686  -9.837  -7.796
  809   1HD1  ILE  11          HD12      ILE  11   1.434  -6.239  -4.635
  810   2HD1  ILE  11          HD11      ILE  11  -0.116  -6.028  -5.449
  811   3HD1  ILE  11          HD13      ILE  11  -0.068  -6.517  -3.756
  812    H    ASP  12           HN       ASP  12   2.671  -6.640  -8.839
  813    HA   ASP  12           HA       ASP  12   4.137  -8.824  -9.983
  814   1HB   ASP  12           HB2      ASP  12   2.750  -7.038 -11.194
  815   2HB   ASP  12           HB1      ASP  12   4.146  -5.979 -11.016
  816    H    VAL  13           HN       VAL  13   5.221  -5.497  -9.211
  817    HA   VAL  13           HA       VAL  13   7.988  -5.947  -9.633
  818    HB   VAL  13           HB       VAL  13   6.323  -3.862  -8.633
  819   1HG1  VAL  13          HG12      VAL  13   8.581  -4.576  -6.758
  820   2HG1  VAL  13          HG11      VAL  13   7.939  -2.938  -6.882
  821   3HG1  VAL  13          HG13      VAL  13   6.893  -4.257  -6.357
  822   1HG2  VAL  13          HG22      VAL  13   8.323  -4.020 -10.349
  823   2HG2  VAL  13          HG21      VAL  13   7.984  -2.502  -9.515
  824   3HG2  VAL  13          HG23      VAL  13   9.285  -3.548  -8.948
  825    H    PHE  14           HN       PHE  14   6.209  -5.982  -6.542
  826    HA   PHE  14           HA       PHE  14   8.170  -6.818  -4.793
  827   1HB   PHE  14           HB2      PHE  14   5.810  -6.424  -4.142
  828   2HB   PHE  14           HB1      PHE  14   5.358  -7.947  -4.909
  829    HD1  PHE  14           HD2      PHE  14   8.123  -6.815  -2.627
  830    HD2  PHE  14           HD1      PHE  14   5.009  -9.671  -3.392
  831    HE1  PHE  14           HE2      PHE  14   8.741  -8.043  -0.564
  832    HE2  PHE  14           HE1      PHE  14   5.627 -10.896  -1.328
  833    HZ   PHE  14           HZ       PHE  14   7.491 -10.082   0.085
  834    H    HIS  15           HN       HIS  15   6.548  -8.805  -7.231
  835    HA   HIS  15           HA       HIS  15   7.706 -11.301  -6.300
  836   1HB   HIS  15           HB2      HIS  15   5.623 -10.949  -7.812
  837   2HB   HIS  15           HB1      HIS  15   6.789 -10.792  -9.127
  838    HD1  HIS  15           HD1      HIS  15   8.001 -12.907  -9.909
  839    HD2  HIS  15           HD2      HIS  15   5.583 -13.560  -6.578
  840    HE1  HIS  15           HE1      HIS  15   7.901 -15.417  -9.580
  841    H    GLN  16           HN       GLN  16   8.443  -9.095  -9.005
  842    HA   GLN  16           HA       GLN  16  10.648 -10.443 -10.096
  843   1HB   GLN  16           HB2      GLN  16   9.448  -8.057 -10.574
  844   2HB   GLN  16           HB1      GLN  16  10.936  -7.502  -9.812
  845   1HG   GLN  16           HG2      GLN  16  11.933  -7.777 -11.819
  846   2HG   GLN  16           HG1      GLN  16  11.773  -9.516 -11.561
  847   1HE2  GLN  16          HE22      GLN  16   8.686  -7.802 -13.673
  848   2HE2  GLN  16          HE21      GLN  16   9.264  -7.027 -12.279
  849    H    TYR  17           HN       TYR  17  10.463  -8.430  -7.204
  850    HA   TYR  17           HA       TYR  17  13.357  -8.495  -6.765
  851   1HB   TYR  17           HB2      TYR  17  11.003  -7.502  -5.151
  852   2HB   TYR  17           HB1      TYR  17  12.638  -7.518  -4.496
  853    HD1  TYR  17           HD2      TYR  17  14.493  -6.419  -5.985
  854    HD2  TYR  17           HD1      TYR  17  10.286  -5.670  -6.424
  855    HE1  TYR  17           HE2      TYR  17  14.993  -4.299  -7.170
  856    HE2  TYR  17           HE1      TYR  17  10.786  -3.548  -7.608
  857    HH   TYR  17           HH       TYR  17  13.630  -2.827  -8.956
  858    H    SER  18           HN       SER  18  10.505 -10.208  -5.572
  859    HA   SER  18           HA       SER  18  12.172 -11.773  -3.691
  860   1HB   SER  18           HB2      SER  18   9.282 -11.255  -4.065
  861   2HB   SER  18           HB1      SER  18   9.693 -12.878  -3.526
  862    HG   SER  18           HG       SER  18  10.622 -12.057  -1.735
  863    H    GLY  19           HN       GLY  19  12.358 -11.990  -6.705
  864   1HA   GLY  19           HA2      GLY  19  11.627 -14.867  -6.964
  865   2HA   GLY  19           HA1      GLY  19  11.752 -13.766  -8.332
  866    H    ARG  20           HN       ARG  20  14.197 -13.030  -6.180
  867    HA   ARG  20           HA       ARG  20  16.187 -14.318  -7.932
  868   1HB   ARG  20           HB2      ARG  20  16.497 -12.456  -5.554
  869   2HB   ARG  20           HB1      ARG  20  17.825 -13.021  -6.571
  870   1HG   ARG  20           HG2      ARG  20  16.398 -12.087  -8.543
  871   2HG   ARG  20           HG1      ARG  20  15.555 -11.177  -7.289
  872   1HD   ARG  20           HD2      ARG  20  18.064 -10.624  -6.542
  873   2HD   ARG  20           HD1      ARG  20  18.367 -10.916  -8.254
  874    HE   ARG  20           HE       ARG  20  16.185  -9.197  -8.236
  875   1HH1  ARG  20          HH11      ARG  20  18.165  -8.690  -5.709
  876   2HH1  ARG  20          HH12      ARG  20  18.873  -7.212  -6.266
  877   1HH2  ARG  20          HH21      ARG  20  17.611  -7.507  -9.481
  878   2HH2  ARG  20          HH22      ARG  20  18.561  -6.543  -8.401
  879    H    GLU  21           HN       GLU  21  15.999 -16.543  -7.372
  880    HA   GLU  21           HA       GLU  21  16.197 -18.457  -6.003
  881   1HB   GLU  21           HB2      GLU  21  18.429 -17.748  -4.434
  882   2HB   GLU  21           HB1      GLU  21  18.438 -18.636  -5.954
  883   1HG   GLU  21           HG2      GLU  21  18.375 -16.336  -7.104
  884   2HG   GLU  21           HG1      GLU  21  18.791 -15.667  -5.526
  885    H    GLY  22           HN       GLY  22  17.222 -18.750  -3.405
  886   1HA   GLY  22           HA2      GLY  22  16.630 -18.498  -1.144
  887   2HA   GLY  22           HA1      GLY  22  15.983 -16.906  -1.550
  888    H    ASP  23           HN       ASP  23  14.193 -17.560  -0.056
  889    HA   ASP  23           HA       ASP  23  12.463 -19.744  -0.537
  890   1HB   ASP  23           HB2      ASP  23  12.114 -17.041   0.736
  891   2HB   ASP  23           HB1      ASP  23  10.722 -18.097   0.518
  892    H    LYS  24           HN       LYS  24  10.908 -16.657  -0.995
  893    HA   LYS  24           HA       LYS  24  10.805 -16.436  -3.788
  894   1HB   LYS  24           HB2      LYS  24   9.880 -18.729  -3.798
  895   2HB   LYS  24           HB1      LYS  24   8.580 -18.207  -2.729
  896   1HG   LYS  24           HG2      LYS  24   7.753 -18.209  -5.015
  897   2HG   LYS  24           HG1      LYS  24   7.895 -16.538  -4.468
  898   1HD   LYS  24           HD2      LYS  24   9.075 -16.221  -6.382
  899   2HD   LYS  24           HD1      LYS  24  10.395 -17.003  -5.516
  900   1HE   LYS  24           HE2      LYS  24   9.301 -19.225  -6.356
  901   2HE   LYS  24           HE1      LYS  24   8.510 -18.184  -7.539
  902   1HZ   LYS  24           HZ3      LYS  24  11.328 -17.685  -7.230
  903   2HZ   LYS  24           HZ2      LYS  24  10.973 -19.241  -7.816
  904   3HZ   LYS  24           HZ1      LYS  24  10.408 -17.867  -8.643
  905    H    HIS  25           HN       HIS  25   9.228 -16.080  -0.692
  906    HA   HIS  25           HA       HIS  25   7.963 -13.581  -1.720
  907   1HB   HIS  25           HB2      HIS  25   6.613 -15.138   0.454
  908   2HB   HIS  25           HB1      HIS  25   5.912 -14.042  -0.736
  909    HD1  HIS  25           HD1      HIS  25   6.413 -17.580  -0.060
  910    HD2  HIS  25           HD2      HIS  25   5.969 -15.247  -3.485
  911    HE1  HIS  25           HE1      HIS  25   5.818 -19.171  -1.941
  912    H    LYS  26           HN       LYS  26  10.430 -13.504  -0.535
  913    HA   LYS  26           HA       LYS  26   9.800 -12.164   2.041
  914   1HB   LYS  26           HB2      LYS  26  11.559 -13.284   3.239
  915   2HB   LYS  26           HB1      LYS  26  10.574 -14.541   2.488
  916   1HG   LYS  26           HG2      LYS  26  12.628 -15.293   1.789
  917   2HG   LYS  26           HG1      LYS  26  12.340 -14.133   0.494
  918   1HD   LYS  26           HD2      LYS  26  14.242 -13.099   1.113
  919   2HD   LYS  26           HD1      LYS  26  13.412 -12.611   2.591
  920   1HE   LYS  26           HE2      LYS  26  14.504 -15.382   2.512
  921   2HE   LYS  26           HE1      LYS  26  15.672 -14.067   2.631
  922   1HZ   LYS  26           HZ1      LYS  26  13.515 -13.570   4.371
  923   2HZ   LYS  26           HZ3      LYS  26  14.103 -15.134   4.660
  924   3HZ   LYS  26           HZ2      LYS  26  15.154 -13.802   4.750
  925    H    LEU  27           HN       LEU  27  10.686 -10.170   1.964
  926    HA   LEU  27           HA       LEU  27  12.903  -9.676   0.043
  927   1HB   LEU  27           HB2      LEU  27  10.621  -8.159   0.979
  928   2HB   LEU  27           HB1      LEU  27  12.107  -7.251   1.251
  929    HG   LEU  27           HG       LEU  27  11.285  -8.518  -1.382
  930   1HD1  LEU  27          HD12      LEU  27  10.378  -6.151  -0.194
  931   2HD1  LEU  27          HD11      LEU  27  11.631  -5.627  -1.319
  932   3HD1  LEU  27          HD13      LEU  27  10.262  -6.575  -1.902
  933   1HD2  LEU  27          HD22      LEU  27  13.645  -6.791  -0.573
  934   2HD2  LEU  27          HD21      LEU  27  13.703  -8.457  -1.151
  935   3HD2  LEU  27          HD23      LEU  27  13.219  -7.162  -2.244
  936    H    LYS  28           HN       LYS  28  13.975  -7.376   1.318
  937    HA   LYS  28           HA       LYS  28  14.920  -8.360   3.958
  938   1HB   LYS  28           HB2      LYS  28  16.606  -7.863   1.516
  939   2HB   LYS  28           HB1      LYS  28  17.285  -7.618   3.126
  940   1HG   LYS  28           HG2      LYS  28  16.725  -9.913   3.748
  941   2HG   LYS  28           HG1      LYS  28  15.950 -10.171   2.185
  942   1HD   LYS  28           HD2      LYS  28  18.023 -11.038   1.685
  943   2HD   LYS  28           HD1      LYS  28  18.343  -9.345   1.307
  944   1HE   LYS  28           HE2      LYS  28  19.203  -9.009   3.611
  945   2HE   LYS  28           HE1      LYS  28  18.933 -10.719   3.944
  946   1HZ   LYS  28           HZ2      LYS  28  20.681  -9.674   1.784
  947   2HZ   LYS  28           HZ1      LYS  28  21.231 -10.229   3.293
  948   3HZ   LYS  28           HZ3      LYS  28  20.478 -11.304   2.219
  949    H    LYS  29           HN       LYS  29  16.691  -6.472   4.655
  950    HA   LYS  29           HA       LYS  29  15.044  -4.021   4.669
  951   1HB   LYS  29           HB2      LYS  29  17.688  -4.459   6.077
  952   2HB   LYS  29           HB1      LYS  29  16.431  -3.285   6.475
  953   1HG   LYS  29           HG2      LYS  29  16.229  -6.301   6.712
  954   2HG   LYS  29           HG1      LYS  29  16.276  -5.138   8.039
  955   1HD   LYS  29           HD2      LYS  29  14.192  -4.127   6.669
  956   2HD   LYS  29           HD1      LYS  29  14.040  -5.821   6.199
  957   1HE   LYS  29           HE2      LYS  29  13.043  -6.211   8.180
  958   2HE   LYS  29           HE1      LYS  29  14.581  -5.851   8.963
  959   1HZ   LYS  29           HZ1      LYS  29  12.908  -3.602   8.128
  960   2HZ   LYS  29           HZ3      LYS  29  12.419  -4.481   9.492
  961   3HZ   LYS  29           HZ2      LYS  29  13.949  -3.742   9.463
  962    H    SER  30           HN       SER  30  17.979  -5.249   3.246
  963    HA   SER  30           HA       SER  30  18.980  -2.607   2.478
  964   1HB   SER  30           HB2      SER  30  20.592  -3.975   1.093
  965   2HB   SER  30           HB1      SER  30  20.608  -4.365   2.812
  966    HG   SER  30           HG       SER  30  20.209  -6.009   0.827
  967    H    GLU  31           HN       GLU  31  17.403  -5.347   0.806
  968    HA   GLU  31           HA       GLU  31  17.258  -3.911  -1.720
  969   1HB   GLU  31           HB2      GLU  31  17.182  -6.493  -1.298
  970   2HB   GLU  31           HB1      GLU  31  15.469  -6.224  -0.976
  971   1HG   GLU  31           HG2      GLU  31  15.017  -5.582  -3.161
  972   2HG   GLU  31           HG1      GLU  31  16.673  -5.048  -3.456
  973    H    LEU  32           HN       LEU  32  15.383  -4.096   1.180
  974    HA   LEU  32           HA       LEU  32  12.919  -3.072  -0.005
  975   1HB   LEU  32           HB2      LEU  32  12.649  -4.331   2.009
  976   2HB   LEU  32           HB1      LEU  32  13.903  -3.409   2.838
  977    HG   LEU  32           HG       LEU  32  12.512  -1.401   2.791
  978   1HD1  LEU  32          HD12      LEU  32  11.209  -2.799   0.688
  979   2HD1  LEU  32          HD11      LEU  32  10.011  -2.544   1.959
  980   3HD1  LEU  32          HD13      LEU  32  10.872  -1.168   1.270
  981   1HD2  LEU  32          HD22      LEU  32  12.196  -3.320   4.527
  982   2HD2  LEU  32          HD21      LEU  32  10.972  -2.055   4.448
  983   3HD2  LEU  32          HD23      LEU  32  10.676  -3.617   3.686
  984    H    LYS  33           HN       LYS  33  15.620  -1.756   1.892
  985    HA   LYS  33           HA       LYS  33  14.723   0.928   2.101
  986   1HB   LYS  33           HB2      LYS  33  16.857  -0.304   3.055
  987   2HB   LYS  33           HB1      LYS  33  17.617   0.307   1.589
  988   1HG   LYS  33           HG2      LYS  33  17.107   2.580   2.168
  989   2HG   LYS  33           HG1      LYS  33  16.051   2.072   3.486
  990   1HD   LYS  33           HD2      LYS  33  18.054   1.008   4.581
  991   2HD   LYS  33           HD1      LYS  33  19.059   1.745   3.332
  992   1HE   LYS  33           HE2      LYS  33  17.156   3.409   4.977
  993   2HE   LYS  33           HE1      LYS  33  18.778   3.035   5.562
  994   1HZ   LYS  33           HZ1      LYS  33  18.466   4.054   2.833
  995   2HZ   LYS  33           HZ3      LYS  33  18.332   5.148   4.123
  996   3HZ   LYS  33           HZ2      LYS  33  19.758   4.248   3.921
  997    H    GLU  34           HN       GLU  34  16.521  -0.741  -0.467
  998    HA   GLU  34           HA       GLU  34  16.743   1.635  -2.128
  999   1HB   GLU  34           HB2      GLU  34  17.963   0.277  -3.555
 1000   2HB   GLU  34           HB1      GLU  34  18.099  -0.674  -2.081
 1001   1HG   GLU  34           HG2      GLU  34  17.411  -2.314  -3.545
 1002   2HG   GLU  34           HG1      GLU  34  15.849  -1.760  -2.960
 1003    H    LEU  35           HN       LEU  35  14.531  -1.030  -1.760
 1004    HA   LEU  35           HA       LEU  35  13.012  -0.806  -4.130
 1005   1HB   LEU  35           HB2      LEU  35  12.863  -2.285  -1.790
 1006   2HB   LEU  35           HB1      LEU  35  11.401  -1.297  -1.729
 1007    HG   LEU  35           HG       LEU  35  10.946  -3.390  -2.921
 1008   1HD1  LEU  35          HD11      LEU  35  10.348  -0.843  -3.788
 1009   2HD1  LEU  35          HD13      LEU  35  11.021  -1.584  -5.240
 1010   3HD1  LEU  35          HD12      LEU  35   9.636  -2.321  -4.435
 1011   1HD2  LEU  35          HD21      LEU  35  13.546  -2.819  -4.042
 1012   2HD2  LEU  35          HD23      LEU  35  12.601  -4.305  -4.151
 1013   3HD2  LEU  35          HD22      LEU  35  12.368  -3.022  -5.338
 1014    H    ILE  36           HN       ILE  36  12.695   0.962  -1.050
 1015    HA   ILE  36           HA       ILE  36  10.433   2.522  -2.044
 1016    HB   ILE  36           HB       ILE  36  11.964   3.466   0.320
 1017   1HG1  ILE  36          HG12      ILE  36  10.706   0.730   0.100
 1018   2HG1  ILE  36          HG11      ILE  36  12.252   1.176   0.816
 1019   1HG2  ILE  36          HG23      ILE  36   9.517   3.997  -0.738
 1020   2HG2  ILE  36          HG22      ILE  36   9.092   2.745   0.429
 1021   3HG2  ILE  36          HG21      ILE  36   9.905   4.216   0.969
 1022   1HD1  ILE  36          HD13      ILE  36  10.696   2.616   2.428
 1023   2HD1  ILE  36          HD12      ILE  36   9.501   1.406   1.964
 1024   3HD1  ILE  36          HD11      ILE  36  11.002   0.907   2.743
 1025    H    ASN  37           HN       ASN  37  13.837   3.252  -1.240
 1026    HA   ASN  37           HA       ASN  37  13.615   5.974  -2.221
 1027   1HB   ASN  37           HB2      ASN  37  15.221   5.142  -0.435
 1028   2HB   ASN  37           HB1      ASN  37  16.162   4.427  -1.745
 1029   1HD2  ASN  37          HD22      ASN  37  17.582   7.809  -1.219
 1030   2HD2  ASN  37          HD21      ASN  37  17.513   6.350  -0.355
 1031    H    ASN  38           HN       ASN  38  13.687   3.137  -3.938
 1032    HA   ASN  38           HA       ASN  38  15.263   4.406  -6.140
 1033   1HB   ASN  38           HB2      ASN  38  15.978   2.113  -5.187
 1034   2HB   ASN  38           HB1      ASN  38  14.563   1.476  -6.027
 1035   1HD2  ASN  38          HD22      ASN  38  16.084   1.619  -9.206
 1036   2HD2  ASN  38          HD21      ASN  38  14.736   1.156  -8.284
 1037    H    GLU  39           HN       GLU  39  12.738   1.872  -6.100
 1038    HA   GLU  39           HA       GLU  39  11.525   3.105  -8.475
 1039   1HB   GLU  39           HB2      GLU  39  10.834   0.634  -6.865
 1040   2HB   GLU  39           HB1      GLU  39   9.953   1.144  -8.305
 1041   1HG   GLU  39           HG2      GLU  39  12.136   1.111  -9.562
 1042   2HG   GLU  39           HG1      GLU  39  12.884   0.396  -8.134
 1043    H    LEU  40           HN       LEU  40  11.413   4.110  -5.475
 1044    HA   LEU  40           HA       LEU  40   8.503   4.777  -5.598
 1045   1HB   LEU  40           HB2      LEU  40   9.793   3.251  -3.610
 1046   2HB   LEU  40           HB1      LEU  40   9.555   4.843  -2.896
 1047    HG   LEU  40           HG       LEU  40   7.659   3.127  -2.612
 1048   1HD1  LEU  40          HD12      LEU  40   7.590   5.689  -2.349
 1049   2HD1  LEU  40          HD11      LEU  40   6.801   5.699  -3.927
 1050   3HD1  LEU  40          HD13      LEU  40   6.054   4.852  -2.574
 1051   1HD2  LEU  40          HD23      LEU  40   7.892   2.961  -5.378
 1052   2HD2  LEU  40          HD22      LEU  40   6.535   2.370  -4.419
 1053   3HD2  LEU  40          HD21      LEU  40   6.466   3.973  -5.146
 1054    H    SER  41           HN       SER  41  11.769   5.768  -4.748
 1055    HA   SER  41           HA       SER  41  11.034   8.406  -3.808
 1056   1HB   SER  41           HB2      SER  41  13.352   6.911  -3.806
 1057   2HB   SER  41           HB1      SER  41  13.700   8.141  -5.016
 1058    HG   SER  41           HG       SER  41  14.057   9.373  -3.354
 1059    H    HIS  42           HN       HIS  42   9.550   9.024  -5.575
 1060    HA   HIS  42           HA       HIS  42  11.046  10.008  -7.969
 1061   1HB   HIS  42           HB2      HIS  42   9.393   8.072  -8.351
 1062   2HB   HIS  42           HB1      HIS  42   8.123   9.243  -7.993
 1063    HD1  HIS  42           HD1      HIS  42   7.165   9.988 -10.168
 1064    HD2  HIS  42           HD2      HIS  42  11.316   9.662 -10.359
 1065    HE1  HIS  42           HE1      HIS  42   7.840  10.777 -12.478
 1066    H    PHE  43           HN       PHE  43   9.112  10.768  -5.278
 1067    HA   PHE  43           HA       PHE  43   8.811  13.553  -6.282
 1068   1HB   PHE  43           HB2      PHE  43   6.555  13.549  -5.022
 1069   2HB   PHE  43           HB1      PHE  43   6.604  12.734  -6.587
 1070    HD1  PHE  43           HD2      PHE  43   6.904  10.224  -6.668
 1071    HD2  PHE  43           HD1      PHE  43   6.099  12.347  -3.019
 1072    HE1  PHE  43           HE2      PHE  43   6.219   8.102  -5.585
 1073    HE2  PHE  43           HE1      PHE  43   5.412  10.223  -1.937
 1074    HZ   PHE  43           HZ       PHE  43   5.473   8.101  -3.220
 1075    H    LEU  44           HN       LEU  44  10.647  12.133  -4.391
 1076    HA   LEU  44           HA       LEU  44   9.855  13.350  -1.796
 1077   1HB   LEU  44           HB2      LEU  44  10.717  10.934  -2.030
 1078   2HB   LEU  44           HB1      LEU  44  12.301  11.654  -2.315
 1079    HG   LEU  44           HG       LEU  44  10.959  12.841  -0.010
 1080   1HD1  LEU  44          HD12      LEU  44  10.221  10.290  -0.162
 1081   2HD1  LEU  44          HD11      LEU  44  11.847  10.021   0.466
 1082   3HD1  LEU  44          HD13      LEU  44  10.699  11.004   1.378
 1083   1HD2  LEU  44          HD22      LEU  44  13.581  12.127  -0.954
 1084   2HD2  LEU  44          HD21      LEU  44  13.149  13.182   0.393
 1085   3HD2  LEU  44          HD23      LEU  44  13.350  11.451   0.658
 1086    H    GLU  45           HN       GLU  45  11.143  14.942  -0.803
 1087    HA   GLU  45           HA       GLU  45  13.704  15.760  -1.833
 1088   1HB   GLU  45           HB2      GLU  45  12.867  18.062  -2.599
 1089   2HB   GLU  45           HB1      GLU  45  12.566  16.711  -3.691
 1090   1HG   GLU  45           HG2      GLU  45  10.310  16.805  -3.393
 1091   2HG   GLU  45           HG1      GLU  45  10.455  17.177  -1.674
 1092    H    GLU  46           HN       GLU  46  10.815  16.568   0.034
 1093    HA   GLU  46           HA       GLU  46  12.607  17.923   1.995
 1094   1HB   GLU  46           HB2      GLU  46  11.401  19.780   1.424
 1095   2HB   GLU  46           HB1      GLU  46  10.095  18.835   0.719
 1096   1HG   GLU  46           HG2      GLU  46   8.932  18.713   2.695
 1097   2HG   GLU  46           HG1      GLU  46  10.394  18.731   3.682
 1098    H    ILE  47           HN       ILE  47   9.709  15.956   1.453
 1099    HA   ILE  47           HA       ILE  47   8.692  14.361   2.840
 1100    HB   ILE  47           HB       ILE  47  11.215  14.666   4.496
 1101   1HG1  ILE  47          HG12      ILE  47  10.605  12.590   2.373
 1102   2HG1  ILE  47          HG11      ILE  47  11.520  14.058   2.035
 1103   1HG2  ILE  47          HG23      ILE  47   9.035  12.569   4.355
 1104   2HG2  ILE  47          HG22      ILE  47  10.597  12.278   5.119
 1105   3HG2  ILE  47          HG21      ILE  47   9.523  13.524   5.757
 1106   1HD1  ILE  47          HD12      ILE  47  12.441  12.595   4.419
 1107   2HD1  ILE  47          HD11      ILE  47  12.629  11.702   2.909
 1108   3HD1  ILE  47          HD13      ILE  47  13.375  13.290   3.095
 1109    H    LYS  48           HN       LYS  48   6.944  15.180   3.904
 1110    HA   LYS  48           HA       LYS  48   7.320  17.330   5.896
 1111   1HB   LYS  48           HB2      LYS  48   5.462  17.519   4.293
 1112   2HB   LYS  48           HB1      LYS  48   4.799  15.990   4.871
 1113   1HG   LYS  48           HG2      LYS  48   3.678  17.964   5.905
 1114   2HG   LYS  48           HG1      LYS  48   4.466  16.932   7.098
 1115   1HD   LYS  48           HD2      LYS  48   6.407  18.429   7.151
 1116   2HD   LYS  48           HD1      LYS  48   5.673  19.447   5.910
 1117   1HE   LYS  48           HE2      LYS  48   4.443  18.890   8.624
 1118   2HE   LYS  48           HE1      LYS  48   5.332  20.356   8.208
 1119   1HZ   LYS  48           HZ2      LYS  48   3.612  20.292   6.211
 1120   2HZ   LYS  48           HZ1      LYS  48   2.675  19.497   7.384
 1121   3HZ   LYS  48           HZ3      LYS  48   3.264  21.057   7.688
 1122    H    GLU  49           HN       GLU  49   6.034  14.000   5.765
 1123    HA   GLU  49           HA       GLU  49   5.622  13.938   8.659
 1124   1HB   GLU  49           HB2      GLU  49   5.234  12.060   6.381
 1125   2HB   GLU  49           HB1      GLU  49   5.508  11.334   7.964
 1126   1HG   GLU  49           HG2      GLU  49   3.456  13.508   7.481
 1127   2HG   GLU  49           HG1      GLU  49   3.073  11.788   7.413
 1128    H    GLN  50           HN       GLN  50   7.889  14.583   9.172
 1129    HA   GLN  50           HA       GLN  50  10.149  12.980   8.509
 1130   1HB   GLN  50           HB2      GLN  50  10.306  15.243   9.523
 1131   2HB   GLN  50           HB1      GLN  50   9.674  14.595  11.035
 1132   1HG   GLN  50           HG2      GLN  50  11.662  12.857  10.716
 1133   2HG   GLN  50           HG1      GLN  50  12.346  14.172   9.762
 1134   1HE2  GLN  50          HE22      GLN  50  12.524  16.408  12.629
 1135   2HE2  GLN  50          HE21      GLN  50  12.137  16.433  10.977
 1136    H    GLU  51           HN       GLU  51   7.550  12.470  10.754
 1137    HA   GLU  51           HA       GLU  51   8.990  10.504  12.366
 1138   1HB   GLU  51           HB2      GLU  51   6.258  11.660  12.287
 1139   2HB   GLU  51           HB1      GLU  51   6.382  10.019  12.920
 1140   1HG   GLU  51           HG2      GLU  51   8.453  11.112  14.230
 1141   2HG   GLU  51           HG1      GLU  51   7.471  12.564  14.024
 1142    H    VAL  52           HN       VAL  52   6.737  10.430   9.631
 1143    HA   VAL  52           HA       VAL  52   6.408   7.553   9.686
 1144    HB   VAL  52           HB       VAL  52   5.944   9.577   7.477
 1145   1HG1  VAL  52          HG12      VAL  52   5.269   6.635   7.701
 1146   2HG1  VAL  52          HG11      VAL  52   4.470   7.717   6.561
 1147   3HG1  VAL  52          HG13      VAL  52   6.205   7.429   6.435
 1148   1HG2  VAL  52          HG22      VAL  52   4.599   9.229   9.864
 1149   2HG2  VAL  52          HG21      VAL  52   3.902   9.931   8.403
 1150   3HG2  VAL  52          HG23      VAL  52   3.673   8.219   8.754
 1151    H    VAL  53           HN       VAL  53   8.473   9.760   7.793
 1152    HA   VAL  53           HA       VAL  53   9.737   7.545   6.374
 1153    HB   VAL  53           HB       VAL  53  10.660  10.421   6.671
 1154   1HG1  VAL  53          HG12      VAL  53  12.360   8.748   5.877
 1155   2HG1  VAL  53          HG11      VAL  53  11.285   8.358   4.535
 1156   3HG1  VAL  53          HG13      VAL  53  11.971   9.976   4.674
 1157   1HG2  VAL  53          HG23      VAL  53   8.432   9.237   5.237
 1158   2HG2  VAL  53          HG22      VAL  53   8.869  10.938   5.399
 1159   3HG2  VAL  53          HG21      VAL  53   9.580   9.962   4.112
 1160    H    ASP  54           HN       ASP  54  10.276   9.292   9.339
 1161    HA   ASP  54           HA       ASP  54  13.031   8.396   9.658
 1162   1HB   ASP  54           HB2      ASP  54  12.333  10.441  10.774
 1163   2HB   ASP  54           HB1      ASP  54  11.045   9.582  11.620
 1164    H    LYS  55           HN       LYS  55   9.843   7.162  10.471
 1165    HA   LYS  55           HA       LYS  55  10.904   5.180  12.343
 1166   1HB   LYS  55           HB2      LYS  55   8.598   4.272  12.325
 1167   2HB   LYS  55           HB1      LYS  55   8.613   6.008  12.631
 1168   1HG   LYS  55           HG2      LYS  55   8.094   6.449  10.275
 1169   2HG   LYS  55           HG1      LYS  55   8.126   4.718   9.931
 1170   1HD   LYS  55           HD2      LYS  55   5.814   5.400  10.223
 1171   2HD   LYS  55           HD1      LYS  55   6.285   4.411  11.604
 1172   1HE   LYS  55           HE2      LYS  55   6.994   6.986  12.377
 1173   2HE   LYS  55           HE1      LYS  55   5.465   7.214  11.529
 1174   1HZ   LYS  55           HZ1      LYS  55   5.451   4.928  13.253
 1175   2HZ   LYS  55           HZ3      LYS  55   5.754   6.368  14.097
 1176   3HZ   LYS  55           HZ2      LYS  55   4.349   6.218  13.154
 1177    H    VAL  56           HN       VAL  56   9.678   5.113   8.976
 1178    HA   VAL  56           HA       VAL  56  10.219   2.273   8.694
 1179    HB   VAL  56           HB       VAL  56   9.824   2.698   6.291
 1180   1HG1  VAL  56          HG12      VAL  56   7.990   3.603   8.436
 1181   2HG1  VAL  56          HG11      VAL  56   7.548   4.073   6.796
 1182   3HG1  VAL  56          HG13      VAL  56   7.753   2.369   7.199
 1183   1HG2  VAL  56          HG23      VAL  56  10.056   5.546   7.220
 1184   2HG2  VAL  56          HG22      VAL  56  10.773   4.779   5.805
 1185   3HG2  VAL  56          HG21      VAL  56   9.051   5.159   5.825
 1186    H    MET  57           HN       MET  57  11.842   5.255   7.662
 1187    HA   MET  57           HA       MET  57  14.091   3.993   6.410
 1188   1HB   MET  57           HB2      MET  57  13.506   6.402   6.136
 1189   2HB   MET  57           HB1      MET  57  13.942   6.680   7.823
 1190   1HG   MET  57           HG2      MET  57  16.054   7.027   7.138
 1191   2HG   MET  57           HG1      MET  57  16.132   5.315   6.719
 1192   1HE   MET  57           HE2      MET  57  14.674   4.516   4.701
 1193   2HE   MET  57           HE1      MET  57  13.522   5.801   4.345
 1194   3HE   MET  57           HE3      MET  57  14.692   5.291   3.119
 1195    H    GLU  58           HN       GLU  58  13.231   4.586   9.744
 1196    HA   GLU  58           HA       GLU  58  15.932   4.229  10.786
 1197   1HB   GLU  58           HB2      GLU  58  13.197   4.495  11.936
 1198   2HB   GLU  58           HB1      GLU  58  14.378   3.627  12.914
 1199   1HG   GLU  58           HG2      GLU  58  15.942   5.526  12.719
 1200   2HG   GLU  58           HG1      GLU  58  14.755   6.402  11.753
 1201    H    THR  59           HN       THR  59  13.002   2.151  10.858
 1202    HA   THR  59           HA       THR  59  14.305  -0.182  11.820
 1203    HB   THR  59           HB       THR  59  12.149  -0.443   9.756
 1204    HG1  THR  59           HG1      THR  59  11.956   0.878  12.238
 1205   1HG2  THR  59          HG21      THR  59  12.974  -1.740  12.326
 1206   2HG2  THR  59          HG23      THR  59  11.294  -1.866  11.805
 1207   3HG2  THR  59          HG22      THR  59  12.587  -2.483  10.775
 1208    H    LEU  60           HN       LEU  60  14.257   1.352   8.721
 1209    HA   LEU  60           HA       LEU  60  15.193  -0.854   7.126
 1210   1HB   LEU  60           HB2      LEU  60  14.932   2.103   6.843
 1211   2HB   LEU  60           HB1      LEU  60  16.064   1.302   5.759
 1212    HG   LEU  60           HG       LEU  60  13.193   0.432   6.159
 1213   1HD1  LEU  60          HD11      LEU  60  14.349   2.575   4.571
 1214   2HD1  LEU  60          HD13      LEU  60  13.559   1.376   3.546
 1215   3HD1  LEU  60          HD12      LEU  60  12.652   2.174   4.832
 1216   1HD2  LEU  60          HD23      LEU  60  15.245  -1.074   5.264
 1217   2HD2  LEU  60          HD22      LEU  60  13.610  -1.227   4.621
 1218   3HD2  LEU  60          HD21      LEU  60  14.811  -0.268   3.758
 1219    H    ASP  61           HN       ASP  61  16.914   2.011   8.399
 1220    HA   ASP  61           HA       ASP  61  19.518   0.787   7.874
 1221   1HB   ASP  61           HB2      ASP  61  18.602   3.386   8.164
 1222   2HB   ASP  61           HB1      ASP  61  19.472   3.105   9.671
 1223    H    GLU  62           HN       GLU  62  17.262   0.198  10.189
 1224    HA   GLU  62           HA       GLU  62  19.000   0.163  12.537
 1225   1HB   GLU  62           HB2      GLU  62  16.521   0.505  12.671
 1226   2HB   GLU  62           HB1      GLU  62  16.307  -1.166  12.145
 1227   1HG   GLU  62           HG2      GLU  62  17.354  -2.022  14.108
 1228   2HG   GLU  62           HG1      GLU  62  17.980  -0.433  14.554
 1229    H    ASP  63           HN       ASP  63  17.465  -2.343  10.514
 1230    HA   ASP  63           HA       ASP  63  19.263  -4.364  11.710
 1231   1HB   ASP  63           HB2      ASP  63  16.656  -4.395  10.480
 1232   2HB   ASP  63           HB1      ASP  63  17.723  -5.526   9.645
 1233    H    GLY  64           HN       GLY  64  18.305  -3.476   8.385
 1234   1HA   GLY  64           HA2      GLY  64  19.760  -3.074   6.540
 1235   2HA   GLY  64           HA1      GLY  64  21.129  -3.531   7.555
 1236    H    ASP  65           HN       ASP  65  20.590  -6.028   8.395
 1237    HA   ASP  65           HA       ASP  65  20.342  -7.551   5.838
 1238   1HB   ASP  65           HB2      ASP  65  22.502  -7.620   7.283
 1239   2HB   ASP  65           HB1      ASP  65  21.558  -8.639   8.371
 1240    H    GLY  66           HN       GLY  66  18.066  -6.684   7.480
 1241   1HA   GLY  66           HA2      GLY  66  17.152  -9.150   8.811
 1242   2HA   GLY  66           HA1      GLY  66  16.284  -7.616   8.774
 1243    H    GLU  67           HN       GLU  67  14.627  -9.553   8.240
 1244    HA   GLU  67           HA       GLU  67  14.463  -9.677   5.254
 1245   1HB   GLU  67           HB2      GLU  67  13.028 -11.797   5.802
 1246   2HB   GLU  67           HB1      GLU  67  14.786 -11.920   5.845
 1247   1HG   GLU  67           HG2      GLU  67  14.860 -12.072   8.141
 1248   2HG   GLU  67           HG1      GLU  67  13.416 -11.083   8.360
 1249    H    CYS  68           HN       CYS  68  12.640  -8.777   4.413
 1250    HA   CYS  68           HA       CYS  68  10.529  -7.893   6.310
 1251   1HB   CYS  68           HB2      CYS  68  11.500  -7.000   3.640
 1252   2HB   CYS  68           HB1      CYS  68   9.779  -6.798   3.967
 1253    HG   CYS  68           HG       CYS  68  12.001  -5.152   5.212
 1254    H    ASP  69           HN       ASP  69   8.289  -8.346   5.839
 1255    HA   ASP  69           HA       ASP  69   7.946 -10.958   4.499
 1256   1HB   ASP  69           HB2      ASP  69   5.979  -9.244   6.052
 1257   2HB   ASP  69           HB1      ASP  69   5.675 -10.883   5.474
 1258    H    PHE  70           HN       PHE  70   5.262 -10.645   3.654
 1259    HA   PHE  70           HA       PHE  70   5.737  -9.045   1.207
 1260   1HB   PHE  70           HB2      PHE  70   3.223 -10.133   0.900
 1261   2HB   PHE  70           HB1      PHE  70   4.715 -10.863   0.318
 1262    HD1  PHE  70           HD1      PHE  70   5.853 -12.632   1.650
 1263    HD2  PHE  70           HD2      PHE  70   2.036 -11.028   2.795
 1264    HE1  PHE  70           HE1      PHE  70   5.494 -14.565   3.162
 1265    HE2  PHE  70           HE2      PHE  70   1.679 -12.960   4.308
 1266    HZ   PHE  70           HZ       PHE  70   3.408 -14.728   4.489
 1267    H    GLN  71           HN       GLN  71   3.357  -9.296   3.843
 1268    HA   GLN  71           HA       GLN  71   1.875  -6.965   2.924
 1269   1HB   GLN  71           HB2      GLN  71   0.543  -7.260   4.872
 1270   2HB   GLN  71           HB1      GLN  71   0.991  -8.891   4.376
 1271   1HG   GLN  71           HG2      GLN  71   1.875  -9.222   6.415
 1272   2HG   GLN  71           HG1      GLN  71   3.070  -7.974   6.063
 1273   1HE2  GLN  71          HE22      GLN  71   0.594  -5.471   7.482
 1274   2HE2  GLN  71          HE21      GLN  71   1.159  -5.753   5.906
 1275    H    GLU  72           HN       GLU  72   4.702  -7.520   4.810
 1276    HA   GLU  72           HA       GLU  72   4.621  -4.992   6.261
 1277   1HB   GLU  72           HB2      GLU  72   6.548  -7.243   5.925
 1278   2HB   GLU  72           HB1      GLU  72   7.224  -5.678   6.378
 1279   1HG   GLU  72           HG2      GLU  72   4.900  -6.047   7.962
 1280   2HG   GLU  72           HG1      GLU  72   5.803  -7.561   8.026
 1281    H    PHE  73           HN       PHE  73   6.655  -6.211   3.569
 1282    HA   PHE  73           HA       PHE  73   7.843  -3.688   2.971
 1283   1HB   PHE  73           HB2      PHE  73   9.007  -5.327   1.864
 1284   2HB   PHE  73           HB1      PHE  73   7.581  -6.335   1.651
 1285    HD1  PHE  73           HD2      PHE  73   9.567  -3.566   0.252
 1286    HD2  PHE  73           HD1      PHE  73   6.117  -6.064  -0.280
 1287    HE1  PHE  73           HE2      PHE  73   9.376  -2.802  -2.099
 1288    HE2  PHE  73           HE1      PHE  73   5.926  -5.301  -2.631
 1289    HZ   PHE  73           HZ       PHE  73   7.556  -3.670  -3.540
 1290    H    MET  74           HN       MET  74   4.694  -4.974   2.319
 1291    HA   MET  74           HA       MET  74   4.085  -3.146   0.124
 1292   1HB   MET  74           HB2      MET  74   2.831  -5.392   1.445
 1293   2HB   MET  74           HB1      MET  74   1.686  -4.060   1.307
 1294   1HG   MET  74           HG2      MET  74   3.135  -4.231  -1.151
 1295   2HG   MET  74           HG1      MET  74   2.563  -5.849  -0.743
 1296   1HE   MET  74           HE3      MET  74   2.073  -2.400  -1.576
 1297   2HE   MET  74           HE2      MET  74   1.401  -3.115  -3.040
 1298   3HE   MET  74           HE1      MET  74   0.374  -2.142  -1.989
 1299    H    ALA  75           HN       ALA  75   3.056  -3.377   3.543
 1300    HA   ALA  75           HA       ALA  75   1.667  -0.850   3.510
 1301   1HB   ALA  75           HB2      ALA  75   2.609  -2.745   5.640
 1302   2HB   ALA  75           HB1      ALA  75   2.072  -1.130   6.105
 1303   3HB   ALA  75           HB3      ALA  75   0.969  -2.219   5.265
 1304    H    PHE  76           HN       PHE  76   4.969  -1.696   3.597
 1305    HA   PHE  76           HA       PHE  76   5.887   0.668   5.056
 1306   1HB   PHE  76           HB2      PHE  76   7.035  -1.769   4.060
 1307   2HB   PHE  76           HB1      PHE  76   7.963  -0.410   3.428
 1308    HD1  PHE  76           HD1      PHE  76   6.150  -1.035   6.655
 1309    HD2  PHE  76           HD2      PHE  76   9.852  -0.014   4.734
 1310    HE1  PHE  76           HE1      PHE  76   7.217  -0.733   8.873
 1311    HE2  PHE  76           HE2      PHE  76  10.919   0.289   6.950
 1312    HZ   PHE  76           HZ       PHE  76   9.601  -0.071   9.020
 1313    H    VAL  77           HN       VAL  77   5.405  -0.280   1.693
 1314    HA   VAL  77           HA       VAL  77   6.723   2.062   0.577
 1315    HB   VAL  77           HB       VAL  77   4.779   0.039  -0.572
 1316   1HG1  VAL  77          HG12      VAL  77   6.101   2.465  -1.771
 1317   2HG1  VAL  77          HG11      VAL  77   5.759   1.055  -2.776
 1318   3HG1  VAL  77          HG13      VAL  77   4.442   1.900  -1.962
 1319   1HG2  VAL  77          HG21      VAL  77   7.739   0.320  -0.370
 1320   2HG2  VAL  77          HG23      VAL  77   6.748  -1.137  -0.389
 1321   3HG2  VAL  77          HG22      VAL  77   7.106  -0.297  -1.896
 1322    H    SER  78           HN       SER  78   3.507   1.313   1.738
 1323    HA   SER  78           HA       SER  78   2.235   3.587   0.429
 1324   1HB   SER  78           HB2      SER  78   1.307   1.889   2.758
 1325   2HB   SER  78           HB1      SER  78   0.308   3.035   1.870
 1326    HG   SER  78           HG       SER  78   0.022   0.977   1.018
 1327    H    MET  79           HN       MET  79   3.577   2.978   3.668
 1328    HA   MET  79           HA       MET  79   2.631   5.412   4.840
 1329   1HB   MET  79           HB2      MET  79   5.145   3.906   5.586
 1330   2HB   MET  79           HB1      MET  79   4.161   4.935   6.622
 1331   1HG   MET  79           HG2      MET  79   2.471   2.935   5.460
 1332   2HG   MET  79           HG1      MET  79   3.876   2.142   6.169
 1333   1HE   MET  79           HE3      MET  79   3.499   1.086   8.061
 1334   2HE   MET  79           HE2      MET  79   4.541   2.306   8.787
 1335   3HE   MET  79           HE1      MET  79   3.084   1.791   9.631
 1336    H    VAL  80           HN       VAL  80   5.536   4.654   2.953
 1337    HA   VAL  80           HA       VAL  80   6.737   7.252   3.516
 1338    HB   VAL  80           HB       VAL  80   8.321   6.538   1.659
 1339   1HG1  VAL  80          HG12      VAL  80   7.966   5.552   4.345
 1340   2HG1  VAL  80          HG11      VAL  80   8.716   4.306   3.347
 1341   3HG1  VAL  80          HG13      VAL  80   9.467   5.895   3.488
 1342   1HG2  VAL  80          HG23      VAL  80   6.274   4.597   1.260
 1343   2HG2  VAL  80          HG22      VAL  80   7.782   4.778   0.371
 1344   3HG2  VAL  80          HG21      VAL  80   7.720   3.746   1.798
 1345    H    THR  81           HN       THR  81   4.939   5.784   0.827
 1346    HA   THR  81           HA       THR  81   5.224   7.967  -0.999
 1347    HB   THR  81           HB       THR  81   2.703   6.322  -0.806
 1348    HG1  THR  81           HG1      THR  81   5.210   5.380  -0.989
 1349   1HG2  THR  81          HG21      THR  81   3.490   8.224  -2.569
 1350   2HG2  THR  81          HG23      THR  81   4.149   6.784  -3.347
 1351   3HG2  THR  81          HG22      THR  81   2.423   6.886  -2.995
 1352    H    THR  82           HN       THR  82   3.557   7.664   1.959
 1353    HA   THR  82           HA       THR  82   1.764   9.957   1.330
 1354    HB   THR  82           HB       THR  82   1.800   8.090   3.719
 1355    HG1  THR  82           HG1      THR  82   0.475   6.890   2.615
 1356   1HG2  THR  82          HG21      THR  82   0.401  10.578   3.115
 1357   2HG2  THR  82          HG23      THR  82  -0.705   9.252   3.467
 1358   3HG2  THR  82          HG22      THR  82   0.529   9.705   4.642
 1359    H    ALA  83           HN       ALA  83   4.674   9.129   2.926
 1360    HA   ALA  83           HA       ALA  83   4.531  11.414   4.794
 1361   1HB   ALA  83           HB2      ALA  83   6.743   9.401   4.279
 1362   2HB   ALA  83           HB1      ALA  83   6.739  10.609   5.565
 1363   3HB   ALA  83           HB3      ALA  83   5.547   9.310   5.572
 1364    H    CYS  84           HN       CYS  84   4.335  12.552   2.415
 1365    HA   CYS  84           HA       CYS  84   7.108  13.460   1.747
 1366   1HB   CYS  84           HB2      CYS  84   5.036  12.452   0.042
 1367   2HB   CYS  84           HB1      CYS  84   5.287  14.155  -0.339
 1368    HG   CYS  84           HG       CYS  84   7.552  13.636  -1.240
 1369    H    HIS  85           HN       HIS  85   6.459  15.733   0.301
 1370    HA   HIS  85           HA       HIS  85   6.050  17.692   2.283
 1371   1HB   HIS  85           HB2      HIS  85   5.509  19.230   0.372
 1372   2HB   HIS  85           HB1      HIS  85   6.980  18.291   0.123
 1373    HD1  HIS  85           HD1      HIS  85   6.991  17.841  -2.349
 1374    HD2  HIS  85           HD2      HIS  85   3.263  17.080  -0.644
 1375    HE1  HIS  85           HE1      HIS  85   5.570  16.799  -4.170
 1376    H    GLU  86           HN       GLU  86   4.026  19.386   1.687
 1377    HA   GLU  86           HA       GLU  86   1.777  18.432   2.994
 1378   1HB   GLU  86           HB2      GLU  86   2.381  20.804   1.858
 1379   2HB   GLU  86           HB1      GLU  86   1.219  20.208   0.671
 1380   1HG   GLU  86           HG2      GLU  86  -0.375  20.988   2.077
 1381   2HG   GLU  86           HG1      GLU  86   0.008  19.589   3.082
 1382    H    PHE  87           HN       PHE  87   1.023  16.385   2.458
 1383    HA   PHE  87           HA       PHE  87  -0.097  14.745   1.204
 1384   1HB   PHE  87           HB2      PHE  87  -1.524  16.968   0.876
 1385   2HB   PHE  87           HB1      PHE  87  -0.945  16.813  -0.784
 1386    HD1  PHE  87           HD2      PHE  87  -1.830  14.197   1.740
 1387    HD2  PHE  87           HD1      PHE  87  -2.736  15.993  -2.053
 1388    HE1  PHE  87           HE2      PHE  87  -3.512  12.428   1.305
 1389    HE2  PHE  87           HE1      PHE  87  -4.420  14.226  -2.490
 1390    HZ   PHE  87           HZ       PHE  87  -4.808  12.443  -0.811
 1391    H    PHE  88           HN       PHE  88  -0.529  15.033  -1.752
 1392    HA   PHE  88           HA       PHE  88   2.285  14.467  -2.579
 1393   1HB   PHE  88           HB2      PHE  88  -0.032  13.604  -4.256
 1394   2HB   PHE  88           HB1      PHE  88   1.511  12.798  -3.979
 1395    HD1  PHE  88           HD1      PHE  88   1.677  12.728  -1.044
 1396    HD2  PHE  88           HD2      PHE  88  -1.682  12.056  -3.629
 1397    HE1  PHE  88           HE1      PHE  88   0.622  11.310   0.696
 1398    HE2  PHE  88           HE2      PHE  88  -2.738  10.638  -1.891
 1399    HZ   PHE  88           HZ       PHE  88  -1.585  10.264   0.273
 1400    H    GLU  89           HN       GLU  89   1.879  17.088  -2.588
 1401    HA   GLU  89           HA       GLU  89   0.540  18.173  -4.881
 1402   1HB   GLU  89           HB2      GLU  89   1.372  19.401  -2.759
 1403   2HB   GLU  89           HB1      GLU  89   2.937  19.453  -3.573
 1404   1HG   GLU  89           HG2      GLU  89   2.233  20.978  -5.119
 1405   2HG   GLU  89           HG1      GLU  89   0.621  20.270  -5.227
 1406    H    HIS  90           HN       HIS  90   1.162  17.057  -6.747
 1407    HA   HIS  90           HA       HIS  90   4.054  17.123  -7.460
 1408   1HB   HIS  90           HB2      HIS  90   3.232  14.912  -7.691
 1409   2HB   HIS  90           HB1      HIS  90   1.715  15.463  -8.398
 1410    HD1  HIS  90           HD1      HIS  90   1.639  15.767 -10.914
 1411    HD2  HIS  90           HD2      HIS  90   5.512  15.144  -9.507
 1412    HE1  HIS  90           HE1      HIS  90   3.105  15.482 -12.958
 1413    H    GLU  91           HN       GLU  91   0.898  18.341  -8.350
 1414    HA   GLU  91           HA       GLU  91   2.172  19.768 -10.650
 1415   1HB   GLU  91           HB2      GLU  91   0.261  18.093 -11.114
 1416   2HB   GLU  91           HB1      GLU  91  -0.794  19.292 -10.361
 1417   1HG   GLU  91           HG2      GLU  91  -0.723  19.599 -12.809
 1418   2HG   GLU  91           HG1      GLU  91  -0.023  20.989 -11.980
   
  No H/Q in entry =        1418
  Start of MODEL    4
    1   1H    MET   0           HT1      MET   0  10.454   6.121 -14.044
    2   2H    MET   0           HT3      MET   0   9.610   7.371 -14.822
    3   3H    MET   0           HT2      MET   0   9.142   6.871 -13.267
    4    HA   MET   0           HA       MET   0   7.615   5.658 -14.337
    5   1HB   MET   0           HB2      MET   0   8.370   6.849 -16.483
    6   2HB   MET   0           HB1      MET   0   9.394   5.441 -16.773
    7   1HG   MET   0           HG2      MET   0   6.599   4.811 -16.053
    8   2HG   MET   0           HG1      MET   0   6.797   5.633 -17.601
    9   1HE   MET   0           HE2      MET   0   6.793   4.428 -19.533
   10   2HE   MET   0           HE1      MET   0   6.986   2.684 -19.690
   11   3HE   MET   0           HE3      MET   0   5.708   3.348 -18.662
   12    H    SER   1           HN       SER   1   8.496   4.173 -12.641
   13    HA   SER   1           HA       SER   1   9.961   1.875 -13.882
   14   1HB   SER   1           HB2      SER   1  10.822   1.366 -11.636
   15   2HB   SER   1           HB1      SER   1  11.253   3.011 -12.099
   16    HG   SER   1           HG       SER   1  10.380   3.344 -10.171
   17    H    GLU   2           HN       GLU   2   9.473   0.068 -11.750
   18    HA   GLU   2           HA       GLU   2   6.752  -0.731 -12.421
   19   1HB   GLU   2           HB2      GLU   2   9.057  -2.055 -11.578
   20   2HB   GLU   2           HB1      GLU   2   7.969  -2.174 -10.195
   21   1HG   GLU   2           HG2      GLU   2   7.394  -4.049 -11.503
   22   2HG   GLU   2           HG1      GLU   2   6.172  -2.853 -11.942
   23    H    LEU   3           HN       LEU   3   8.288  -0.347  -9.214
   24    HA   LEU   3           HA       LEU   3   5.873  -0.129  -7.752
   25   1HB   LEU   3           HB2      LEU   3   8.144  -0.445  -6.757
   26   2HB   LEU   3           HB1      LEU   3   8.507   1.235  -7.130
   27    HG   LEU   3           HG       LEU   3   6.353   1.792  -5.808
   28   1HD1  LEU   3          HD12      LEU   3   6.851  -1.090  -5.054
   29   2HD1  LEU   3          HD11      LEU   3   6.017   0.020  -3.965
   30   3HD1  LEU   3          HD13      LEU   3   5.338  -0.334  -5.553
   31   1HD2  LEU   3          HD21      LEU   3   9.011   1.665  -5.116
   32   2HD2  LEU   3          HD23      LEU   3   7.743   2.341  -4.092
   33   3HD2  LEU   3          HD22      LEU   3   8.266   0.673  -3.861
   34    H    GLU   4           HN       GLU   4   8.023   2.514  -8.782
   35    HA   GLU   4           HA       GLU   4   6.561   4.713  -7.970
   36   1HB   GLU   4           HB2      GLU   4   8.752   4.682  -9.289
   37   2HB   GLU   4           HB1      GLU   4   7.763   4.566 -10.744
   38   1HG   GLU   4           HG2      GLU   4   6.839   6.661  -8.919
   39   2HG   GLU   4           HG1      GLU   4   8.490   6.924  -9.479
   40    H    LYS   5           HN       LYS   5   5.808   2.594 -10.701
   41    HA   LYS   5           HA       LYS   5   3.643   4.336 -11.632
   42   1HB   LYS   5           HB2      LYS   5   5.109   2.399 -12.858
   43   2HB   LYS   5           HB1      LYS   5   3.654   1.488 -12.453
   44   1HG   LYS   5           HG2      LYS   5   2.776   2.389 -14.339
   45   2HG   LYS   5           HG1      LYS   5   2.619   3.869 -13.392
   46   1HD   LYS   5           HD2      LYS   5   4.517   4.832 -14.325
   47   2HD   LYS   5           HD1      LYS   5   5.241   3.272 -14.718
   48   1HE   LYS   5           HE2      LYS   5   4.540   3.781 -16.832
   49   2HE   LYS   5           HE1      LYS   5   2.997   3.160 -16.245
   50   1HZ   LYS   5           HZ3      LYS   5   3.723   5.993 -15.865
   51   2HZ   LYS   5           HZ2      LYS   5   3.053   5.463 -17.334
   52   3HZ   LYS   5           HZ1      LYS   5   2.183   5.282 -15.885
   53    H    ALA   6           HN       ALA   6   3.890   1.329  -9.750
   54    HA   ALA   6           HA       ALA   6   0.990   1.076  -9.505
   55   1HB   ALA   6           HB2      ALA   6   2.927  -0.746  -9.343
   56   2HB   ALA   6           HB1      ALA   6   2.871  -0.310  -7.635
   57   3HB   ALA   6           HB3      ALA   6   1.426  -0.930  -8.434
   58    H    MET   7           HN       MET   7   3.503   1.467  -6.987
   59    HA   MET   7           HA       MET   7   1.904   2.192  -4.850
   60   1HB   MET   7           HB2      MET   7   4.330   1.931  -4.642
   61   2HB   MET   7           HB1      MET   7   4.589   3.381  -5.618
   62   1HG   MET   7           HG2      MET   7   4.799   4.084  -3.343
   63   2HG   MET   7           HG1      MET   7   3.211   4.638  -3.874
   64   1HE   MET   7           HE2      MET   7   1.426   4.578  -2.548
   65   2HE   MET   7           HE1      MET   7   0.925   3.127  -3.414
   66   3HE   MET   7           HE3      MET   7   0.771   3.209  -1.653
   67    H    VAL   8           HN       VAL   8   3.313   4.453  -7.222
   68    HA   VAL   8           HA       VAL   8   1.993   6.769  -6.180
   69    HB   VAL   8           HB       VAL   8   2.879   6.291  -9.040
   70   1HG1  VAL   8          HG11      VAL   8   2.475   8.788  -7.364
   71   2HG1  VAL   8          HG13      VAL   8   3.207   8.771  -8.969
   72   3HG1  VAL   8          HG12      VAL   8   1.520   8.299  -8.764
   73   1HG2  VAL   8          HG23      VAL   8   4.547   5.879  -7.046
   74   2HG2  VAL   8          HG22      VAL   8   5.059   6.869  -8.412
   75   3HG2  VAL   8          HG21      VAL   8   4.530   7.638  -6.915
   76    H    ALA   9           HN       ALA   9   1.037   4.426  -8.681
   77    HA   ALA   9           HA       ALA   9  -1.246   5.766  -9.676
   78   1HB   ALA   9           HB3      ALA   9  -0.492   2.875  -9.371
   79   2HB   ALA   9           HB2      ALA   9  -2.128   3.289  -9.885
   80   3HB   ALA   9           HB1      ALA   9  -0.744   3.810 -10.845
   81    H    LEU  10           HN       LEU  10  -0.881   3.758  -6.759
   82    HA   LEU  10           HA       LEU  10  -3.623   3.662  -6.027
   83   1HB   LEU  10           HB2      LEU  10  -1.217   2.829  -4.888
   84   2HB   LEU  10           HB1      LEU  10  -1.848   4.007  -3.734
   85    HG   LEU  10           HG       LEU  10  -3.745   1.995  -4.871
   86   1HD1  LEU  10          HD12      LEU  10  -1.513   1.431  -2.933
   87   2HD1  LEU  10          HD11      LEU  10  -3.048   0.576  -2.785
   88   3HD1  LEU  10          HD13      LEU  10  -2.100   0.437  -4.267
   89   1HD2  LEU  10          HD21      LEU  10  -3.577   3.893  -2.662
   90   2HD2  LEU  10          HD23      LEU  10  -4.997   3.102  -3.348
   91   3HD2  LEU  10          HD22      LEU  10  -4.047   2.286  -2.106
   92    H    ILE  11           HN       ILE  11  -1.112   6.056  -5.160
   93    HA   ILE  11           HA       ILE  11  -2.681   7.754  -3.557
   94    HB   ILE  11           HB       ILE  11  -0.396   8.269  -5.460
   95   1HG1  ILE  11          HG12      ILE  11   0.673   8.938  -3.265
   96   2HG1  ILE  11          HG11      ILE  11  -0.795   8.390  -2.458
   97   1HG2  ILE  11          HG21      ILE  11  -2.283  10.240  -4.332
   98   2HG2  ILE  11          HG23      ILE  11  -0.585  10.589  -4.004
   99   3HG2  ILE  11          HG22      ILE  11  -1.144  10.411  -5.667
  100   1HD1  ILE  11          HD12      ILE  11   0.985   6.685  -4.228
  101   2HD1  ILE  11          HD11      ILE  11   0.915   6.613  -2.467
  102   3HD1  ILE  11          HD13      ILE  11  -0.487   6.139  -3.423
  103    H    ASP  12           HN       ASP  12  -2.639   7.332  -7.040
  104    HA   ASP  12           HA       ASP  12  -4.108   9.652  -7.794
  105   1HB   ASP  12           HB2      ASP  12  -2.935   7.991  -9.325
  106   2HB   ASP  12           HB1      ASP  12  -4.322   6.930  -9.104
  107    H    VAL  13           HN       VAL  13  -5.340   6.324  -7.317
  108    HA   VAL  13           HA       VAL  13  -8.069   6.810  -7.551
  109    HB   VAL  13           HB       VAL  13  -6.608   4.977  -5.631
  110   1HG1  VAL  13          HG12      VAL  13  -9.382   5.743  -5.665
  111   2HG1  VAL  13          HG11      VAL  13  -9.238   4.056  -6.160
  112   3HG1  VAL  13          HG13      VAL  13  -8.573   4.580  -4.613
  113   1HG2  VAL  13          HG21      VAL  13  -7.545   4.862  -8.434
  114   2HG2  VAL  13          HG23      VAL  13  -6.244   3.968  -7.646
  115   3HG2  VAL  13          HG22      VAL  13  -7.916   3.435  -7.464
  116    H    PHE  14           HN       PHE  14  -6.038   7.359  -4.682
  117    HA   PHE  14           HA       PHE  14  -8.140   8.085  -2.906
  118   1HB   PHE  14           HB2      PHE  14  -5.746   7.642  -2.265
  119   2HB   PHE  14           HB1      PHE  14  -5.339   9.231  -2.914
  120    HD1  PHE  14           HD1      PHE  14  -6.662  11.261  -2.009
  121    HD2  PHE  14           HD2      PHE  14  -6.551   7.433  -0.063
  122    HE1  PHE  14           HE1      PHE  14  -7.387  12.321   0.113
  123    HE2  PHE  14           HE2      PHE  14  -7.274   8.493   2.060
  124    HZ   PHE  14           HZ       PHE  14  -7.692  10.937   2.148
  125    H    HIS  15           HN       HIS  15  -6.013  10.244  -4.828
  126    HA   HIS  15           HA       HIS  15  -7.537  12.605  -4.171
  127   1HB   HIS  15           HB2      HIS  15  -5.103  12.393  -5.087
  128   2HB   HIS  15           HB1      HIS  15  -5.879  12.351  -6.670
  129    HD1  HIS  15           HD1      HIS  15  -4.601  14.747  -6.944
  130    HD2  HIS  15           HD2      HIS  15  -7.790  14.645  -4.258
  131    HE1  HIS  15           HE1      HIS  15  -5.274  17.156  -6.538
  132    H    GLN  16           HN       GLN  16  -8.335   9.990  -6.096
  133    HA   GLN  16           HA       GLN  16  -9.828  11.565  -8.103
  134   1HB   GLN  16           HB2      GLN  16  -8.667   9.007  -8.076
  135   2HB   GLN  16           HB1      GLN  16 -10.408   8.722  -8.082
  136   1HG   GLN  16           HG2      GLN  16  -9.984   8.929 -10.359
  137   2HG   GLN  16           HG1      GLN  16 -10.411  10.589  -9.940
  138   1HE2  GLN  16          HE22      GLN  16  -7.192  11.866 -10.637
  139   2HE2  GLN  16          HE21      GLN  16  -8.771  12.199 -10.114
  140    H    TYR  17           HN       TYR  17 -10.474   9.372  -5.378
  141    HA   TYR  17           HA       TYR  17 -13.363   9.622  -5.662
  142   1HB   TYR  17           HB2      TYR  17 -11.525   8.387  -3.619
  143   2HB   TYR  17           HB1      TYR  17 -13.252   8.541  -3.297
  144    HD1  TYR  17           HD1      TYR  17 -10.892   7.360  -5.966
  145    HD2  TYR  17           HD2      TYR  17 -14.699   6.863  -4.042
  146    HE1  TYR  17           HE1      TYR  17 -11.325   5.346  -7.349
  147    HE2  TYR  17           HE2      TYR  17 -15.134   4.851  -5.424
  148    HH   TYR  17           HH       TYR  17 -13.790   4.143  -8.114
  149    H    SER  18           HN       SER  18 -11.042  10.740  -3.157
  150    HA   SER  18           HA       SER  18 -13.094  12.572  -2.098
  151   1HB   SER  18           HB2      SER  18 -11.817  11.662  -0.360
  152   2HB   SER  18           HB1      SER  18 -10.314  11.775  -1.272
  153    HG   SER  18           HG       SER  18 -11.846  13.910  -0.185
  154    H    GLY  19           HN       GLY  19 -11.690  12.867  -4.835
  155   1HA   GLY  19           HA2      GLY  19 -10.866  15.703  -4.421
  156   2HA   GLY  19           HA1      GLY  19 -10.068  14.664  -5.601
  157    H    ARG  20           HN       ARG  20 -13.522  14.534  -5.029
  158    HA   ARG  20           HA       ARG  20 -14.137  16.243  -7.331
  159   1HB   ARG  20           HB2      ARG  20 -15.142  14.496  -8.693
  160   2HB   ARG  20           HB1      ARG  20 -13.463  14.068  -8.365
  161   1HG   ARG  20           HG2      ARG  20 -14.130  12.536  -6.610
  162   2HG   ARG  20           HG1      ARG  20 -15.811  13.057  -6.739
  163   1HD   ARG  20           HD2      ARG  20 -15.077  12.319  -9.348
  164   2HD   ARG  20           HD1      ARG  20 -14.388  11.073  -8.307
  165    HE   ARG  20           HE       ARG  20 -16.586  10.383  -7.753
  166   1HH1  ARG  20          HH21      ARG  20 -17.751  13.003  -6.995
  167   2HH1  ARG  20          HH22      ARG  20 -18.929  13.269  -8.237
  168   1HH2  ARG  20          HH11      ARG  20 -17.583  10.900 -10.387
  169   2HH2  ARG  20          HH12      ARG  20 -18.834  12.078 -10.159
  170    H    GLU  21           HN       GLU  21 -15.239  14.043  -4.795
  171    HA   GLU  21           HA       GLU  21 -17.970  15.197  -5.035
  172   1HB   GLU  21           HB2      GLU  21 -18.397  13.362  -3.205
  173   2HB   GLU  21           HB1      GLU  21 -18.212  12.883  -4.892
  174   1HG   GLU  21           HG2      GLU  21 -16.039  12.068  -4.561
  175   2HG   GLU  21           HG1      GLU  21 -15.798  13.029  -3.101
  176    H    GLY  22           HN       GLY  22 -16.936  13.960  -1.951
  177   1HA   GLY  22           HA2      GLY  22 -17.625  16.422  -0.624
  178   2HA   GLY  22           HA1      GLY  22 -16.856  15.029   0.137
  179    H    ASP  23           HN       ASP  23 -15.792  17.115   1.164
  180    HA   ASP  23           HA       ASP  23 -13.909  18.697  -0.185
  181   1HB   ASP  23           HB2      ASP  23 -14.344  17.814   2.589
  182   2HB   ASP  23           HB1      ASP  23 -12.661  18.191   2.224
  183    H    LYS  24           HN       LYS  24 -11.377  18.323   0.479
  184    HA   LYS  24           HA       LYS  24 -10.711  15.616  -0.610
  185   1HB   LYS  24           HB2      LYS  24  -8.748  17.876  -0.657
  186   2HB   LYS  24           HB1      LYS  24  -8.956  16.551  -1.803
  187   1HG   LYS  24           HG2      LYS  24 -11.290  17.694  -2.243
  188   2HG   LYS  24           HG1      LYS  24 -10.490  19.121  -1.582
  189   1HD   LYS  24           HD2      LYS  24  -8.610  18.704  -3.229
  190   2HD   LYS  24           HD1      LYS  24  -9.631  17.478  -3.977
  191   1HE   LYS  24           HE2      LYS  24 -10.681  20.266  -3.526
  192   2HE   LYS  24           HE1      LYS  24  -9.694  19.897  -4.942
  193   1HZ   LYS  24           HZ3      LYS  24 -11.260  18.056  -5.419
  194   2HZ   LYS  24           HZ2      LYS  24 -12.253  18.619  -4.161
  195   3HZ   LYS  24           HZ1      LYS  24 -11.966  19.595  -5.522
  196    H    HIS  25           HN       HIS  25  -8.187  15.223   0.045
  197    HA   HIS  25           HA       HIS  25  -6.723  14.678   1.783
  198   1HB   HIS  25           HB2      HIS  25  -6.343  16.931   2.255
  199   2HB   HIS  25           HB1      HIS  25  -8.006  17.221   2.745
  200    HD1  HIS  25           HD1      HIS  25  -4.700  16.097   4.034
  201    HD2  HIS  25           HD2      HIS  25  -8.621  16.346   5.431
  202    HE1  HIS  25           HE1      HIS  25  -4.585  15.803   6.548
  203    H    LYS  26           HN       LYS  26  -9.929  14.100   1.866
  204    HA   LYS  26           HA       LYS  26  -9.643  12.418   4.275
  205   1HB   LYS  26           HB2      LYS  26 -12.079  13.309   4.883
  206   2HB   LYS  26           HB1      LYS  26 -10.637  14.135   5.470
  207   1HG   LYS  26           HG2      LYS  26 -10.897  15.914   4.027
  208   2HG   LYS  26           HG1      LYS  26 -11.679  14.931   2.789
  209   1HD   LYS  26           HD2      LYS  26 -13.476  16.191   3.593
  210   2HD   LYS  26           HD1      LYS  26 -13.605  14.722   4.561
  211   1HE   LYS  26           HE2      LYS  26 -12.756  15.749   6.479
  212   2HE   LYS  26           HE1      LYS  26 -11.926  17.003   5.559
  213   1HZ   LYS  26           HZ3      LYS  26 -14.877  16.782   5.620
  214   2HZ   LYS  26           HZ2      LYS  26 -14.014  17.687   6.772
  215   3HZ   LYS  26           HZ1      LYS  26 -13.935  18.102   5.126
  216    H    LEU  27           HN       LEU  27 -11.017  10.606   4.238
  217    HA   LEU  27           HA       LEU  27 -12.794  10.357   1.843
  218   1HB   LEU  27           HB2      LEU  27 -10.422   9.014   2.065
  219   2HB   LEU  27           HB1      LEU  27 -11.526   7.871   2.834
  220    HG   LEU  27           HG       LEU  27 -13.049   8.353   0.758
  221   1HD1  LEU  27          HD13      LEU  27 -10.565   9.749   0.109
  222   2HD1  LEU  27          HD12      LEU  27 -11.010   8.566  -1.122
  223   3HD1  LEU  27          HD11      LEU  27 -12.141   9.845  -0.674
  224   1HD2  LEU  27          HD22      LEU  27 -10.546   6.665   0.841
  225   2HD2  LEU  27          HD21      LEU  27 -12.220   6.156   1.052
  226   3HD2  LEU  27          HD23      LEU  27 -11.633   6.611  -0.547
  227    H    LYS  28           HN       LYS  28 -13.545   7.644   2.630
  228    HA   LYS  28           HA       LYS  28 -14.746   8.013   5.315
  229   1HB   LYS  28           HB2      LYS  28 -16.193   8.225   2.771
  230   2HB   LYS  28           HB1      LYS  28 -16.891   7.038   3.874
  231   1HG   LYS  28           HG2      LYS  28 -17.368   8.627   5.500
  232   2HG   LYS  28           HG1      LYS  28 -16.091   9.714   4.957
  233   1HD   LYS  28           HD2      LYS  28 -17.810  10.869   4.005
  234   2HD   LYS  28           HD1      LYS  28 -17.683   9.644   2.741
  235   1HE   LYS  28           HE2      LYS  28 -19.366   8.265   3.924
  236   2HE   LYS  28           HE1      LYS  28 -19.515   9.520   5.156
  237   1HZ   LYS  28           HZ1      LYS  28 -19.784  10.692   2.618
  238   2HZ   LYS  28           HZ3      LYS  28 -20.831   9.361   2.704
  239   3HZ   LYS  28           HZ2      LYS  28 -20.934  10.595   3.867
  240    H    LYS  29           HN       LYS  29 -15.722   5.969   6.106
  241    HA   LYS  29           HA       LYS  29 -14.095   3.681   5.317
  242   1HB   LYS  29           HB2      LYS  29 -16.495   3.653   7.159
  243   2HB   LYS  29           HB1      LYS  29 -15.132   2.532   7.142
  244   1HG   LYS  29           HG2      LYS  29 -13.634   4.180   7.985
  245   2HG   LYS  29           HG1      LYS  29 -14.778   5.488   7.668
  246   1HD   LYS  29           HD2      LYS  29 -15.304   5.237   9.870
  247   2HD   LYS  29           HD1      LYS  29 -16.270   3.883   9.282
  248   1HE   LYS  29           HE2      LYS  29 -15.014   2.810  10.911
  249   2HE   LYS  29           HE1      LYS  29 -13.976   2.573   9.503
  250   1HZ   LYS  29           HZ3      LYS  29 -12.869   4.713  10.172
  251   2HZ   LYS  29           HZ2      LYS  29 -13.710   4.601  11.645
  252   3HZ   LYS  29           HZ1      LYS  29 -12.600   3.393  11.203
  253    H    SER  30           HN       SER  30 -17.159   4.961   4.424
  254    HA   SER  30           HA       SER  30 -18.252   2.415   3.473
  255   1HB   SER  30           HB2      SER  30 -19.963   3.919   4.017
  256   2HB   SER  30           HB1      SER  30 -19.104   5.298   3.338
  257    HG   SER  30           HG       SER  30 -20.168   3.117   1.856
  258    H    GLU  31           HN       GLU  31 -16.808   5.323   1.990
  259    HA   GLU  31           HA       GLU  31 -16.873   4.135  -0.685
  260   1HB   GLU  31           HB2      GLU  31 -16.892   6.670  -0.051
  261   2HB   GLU  31           HB1      GLU  31 -15.148   6.477   0.131
  262   1HG   GLU  31           HG2      GLU  31 -14.949   6.722  -2.099
  263   2HG   GLU  31           HG1      GLU  31 -15.811   5.197  -2.293
  264    H    LEU  32           HN       LEU  32 -14.799   4.107   2.078
  265    HA   LEU  32           HA       LEU  32 -12.392   3.332   0.609
  266   1HB   LEU  32           HB2      LEU  32 -11.964   4.356   2.718
  267   2HB   LEU  32           HB1      LEU  32 -13.169   3.363   3.534
  268    HG   LEU  32           HG       LEU  32 -11.802   1.422   3.430
  269   1HD1  LEU  32          HD12      LEU  32 -10.722   2.752   1.086
  270   2HD1  LEU  32          HD11      LEU  32  -9.428   2.158   2.125
  271   3HD1  LEU  32          HD13      LEU  32 -10.656   1.046   1.525
  272   1HD2  LEU  32          HD22      LEU  32 -10.224   3.921   4.040
  273   2HD2  LEU  32          HD21      LEU  32 -10.955   2.783   5.172
  274   3HD2  LEU  32          HD23      LEU  32  -9.519   2.318   4.259
  275    H    LYS  33           HN       LYS  33 -14.910   1.730   2.535
  276    HA   LYS  33           HA       LYS  33 -13.931  -0.953   2.286
  277   1HB   LYS  33           HB2      LYS  33 -15.834  -0.126   3.787
  278   2HB   LYS  33           HB1      LYS  33 -16.844  -0.116   2.350
  279   1HG   LYS  33           HG2      LYS  33 -15.405  -2.617   2.527
  280   2HG   LYS  33           HG1      LYS  33 -16.307  -2.325   4.016
  281   1HD   LYS  33           HD2      LYS  33 -18.362  -1.975   2.762
  282   2HD   LYS  33           HD1      LYS  33 -17.490  -2.099   1.232
  283   1HE   LYS  33           HE2      LYS  33 -18.107  -4.288   1.322
  284   2HE   LYS  33           HE1      LYS  33 -16.758  -4.438   2.449
  285   1HZ   LYS  33           HZ2      LYS  33 -18.475  -3.746   4.198
  286   2HZ   LYS  33           HZ1      LYS  33 -19.638  -4.175   3.036
  287   3HZ   LYS  33           HZ3      LYS  33 -18.536  -5.336   3.602
  288    H    GLU  34           HN       GLU  34 -16.111   1.025   0.377
  289    HA   GLU  34           HA       GLU  34 -16.682  -0.959  -1.632
  290   1HB   GLU  34           HB2      GLU  34 -17.177   1.911  -1.164
  291   2HB   GLU  34           HB1      GLU  34 -17.014   1.497  -2.866
  292   1HG   GLU  34           HG2      GLU  34 -18.610  -0.509  -1.586
  293   2HG   GLU  34           HG1      GLU  34 -19.252   1.079  -1.166
  294    H    LEU  35           HN       LEU  35 -14.202   1.469  -1.194
  295    HA   LEU  35           HA       LEU  35 -13.067   1.486  -3.803
  296   1HB   LEU  35           HB2      LEU  35 -12.488   2.692  -1.386
  297   2HB   LEU  35           HB1      LEU  35 -11.126   1.588  -1.587
  298    HG   LEU  35           HG       LEU  35 -10.549   3.693  -2.636
  299   1HD1  LEU  35          HD13      LEU  35 -11.292   1.508  -4.595
  300   2HD1  LEU  35          HD12      LEU  35 -10.353   2.927  -5.054
  301   3HD1  LEU  35          HD11      LEU  35  -9.718   1.801  -3.855
  302   1HD2  LEU  35          HD21      LEU  35 -12.975   4.389  -2.931
  303   2HD2  LEU  35          HD23      LEU  35 -11.924   4.756  -4.299
  304   3HD2  LEU  35          HD22      LEU  35 -13.012   3.370  -4.371
  305    H    ILE  36           HN       ILE  36 -12.555  -0.674  -1.029
  306    HA   ILE  36           HA       ILE  36 -10.542  -2.260  -2.445
  307    HB   ILE  36           HB       ILE  36 -11.944  -3.348  -0.051
  308   1HG1  ILE  36          HG12      ILE  36 -10.364  -0.778  -0.102
  309   2HG1  ILE  36          HG11      ILE  36 -11.874  -1.125   0.734
  310   1HG2  ILE  36          HG23      ILE  36  -9.799  -4.164  -1.389
  311   2HG2  ILE  36          HG22      ILE  36  -8.988  -2.981  -0.362
  312   3HG2  ILE  36          HG21      ILE  36  -9.879  -4.316   0.366
  313   1HD1  ILE  36          HD13      ILE  36 -10.654  -2.714   2.218
  314   2HD1  ILE  36          HD12      ILE  36  -9.146  -2.253   1.429
  315   3HD1  ILE  36          HD11      ILE  36 -10.055  -1.062   2.361
  316    H    ASN  37           HN       ASN  37 -13.784  -3.055  -1.145
  317    HA   ASN  37           HA       ASN  37 -13.999  -5.562  -2.447
  318   1HB   ASN  37           HB2      ASN  37 -15.441  -4.481  -0.557
  319   2HB   ASN  37           HB1      ASN  37 -16.412  -3.859  -1.895
  320   1HD2  ASN  37          HD22      ASN  37 -16.268  -7.932  -1.300
  321   2HD2  ASN  37          HD21      ASN  37 -14.986  -6.971  -0.741
  322    H    ASN  38           HN       ASN  38 -13.906  -2.560  -3.969
  323    HA   ASN  38           HA       ASN  38 -15.629  -3.564  -6.188
  324   1HB   ASN  38           HB2      ASN  38 -16.082  -1.282  -5.029
  325   2HB   ASN  38           HB1      ASN  38 -14.676  -0.720  -5.934
  326   1HD2  ASN  38          HD22      ASN  38 -16.353  -1.427  -9.141
  327   2HD2  ASN  38          HD21      ASN  38 -14.866  -1.773  -8.407
  328    H    GLU  39           HN       GLU  39 -12.656  -1.611  -5.725
  329    HA   GLU  39           HA       GLU  39 -11.734  -2.573  -8.378
  330   1HB   GLU  39           HB2      GLU  39 -10.714  -0.380  -6.554
  331   2HB   GLU  39           HB1      GLU  39  -9.977  -0.810  -8.098
  332   1HG   GLU  39           HG2      GLU  39 -11.434   0.590  -9.093
  333   2HG   GLU  39           HG1      GLU  39 -12.715  -0.540  -8.653
  334    H    LEU  40           HN       LEU  40 -11.665  -4.195  -5.776
  335    HA   LEU  40           HA       LEU  40  -8.819  -4.996  -6.082
  336   1HB   LEU  40           HB2      LEU  40  -9.020  -3.489  -4.070
  337   2HB   LEU  40           HB1      LEU  40 -10.115  -4.674  -3.362
  338    HG   LEU  40           HG       LEU  40  -7.766  -6.004  -4.355
  339   1HD1  LEU  40          HD11      LEU  40  -6.924  -3.582  -3.818
  340   2HD1  LEU  40          HD13      LEU  40  -7.122  -4.078  -2.137
  341   3HD1  LEU  40          HD12      LEU  40  -6.021  -4.962  -3.194
  342   1HD2  LEU  40          HD23      LEU  40  -9.536  -6.554  -2.501
  343   2HD2  LEU  40          HD22      LEU  40  -7.862  -7.058  -2.265
  344   3HD2  LEU  40          HD21      LEU  40  -8.472  -5.614  -1.456
  345    H    SER  41           HN       SER  41 -11.886  -5.814  -4.433
  346    HA   SER  41           HA       SER  41 -11.487  -8.512  -3.927
  347   1HB   SER  41           HB2      SER  41 -13.682  -6.800  -3.974
  348   2HB   SER  41           HB1      SER  41 -14.106  -8.054  -5.135
  349    HG   SER  41           HG       SER  41 -14.022  -9.543  -3.581
  350    H    HIS  42           HN       HIS  42 -11.753  -6.976  -7.032
  351    HA   HIS  42           HA       HIS  42 -12.680  -8.815  -8.812
  352   1HB   HIS  42           HB2      HIS  42 -10.858  -6.676  -8.939
  353   2HB   HIS  42           HB1      HIS  42 -10.041  -8.037  -9.713
  354    HD1  HIS  42           HD1      HIS  42 -13.273  -6.055  -9.909
  355    HD2  HIS  42           HD2      HIS  42 -11.060  -8.724 -12.227
  356    HE1  HIS  42           HE1      HIS  42 -14.385  -6.119 -12.185
  357    H    PHE  43           HN       PHE  43  -9.728  -9.186  -6.906
  358    HA   PHE  43           HA       PHE  43  -9.630 -12.013  -7.844
  359   1HB   PHE  43           HB2      PHE  43  -7.310 -11.972  -8.255
  360   2HB   PHE  43           HB1      PHE  43  -7.876 -10.460  -8.959
  361    HD1  PHE  43           HD1      PHE  43  -7.614  -8.308  -7.657
  362    HD2  PHE  43           HD2      PHE  43  -5.791 -11.997  -6.418
  363    HE1  PHE  43           HE1      PHE  43  -6.060  -7.050  -6.190
  364    HE2  PHE  43           HE2      PHE  43  -4.240 -10.739  -4.950
  365    HZ   PHE  43           HZ       PHE  43  -4.374  -8.265  -4.837
  366    H    LEU  44           HN       LEU  44  -9.914 -13.248  -6.070
  367    HA   LEU  44           HA       LEU  44  -8.247 -13.275  -3.814
  368   1HB   LEU  44           HB2      LEU  44  -9.791 -10.997  -3.678
  369   2HB   LEU  44           HB1      LEU  44 -10.743 -12.136  -2.733
  370    HG   LEU  44           HG       LEU  44  -8.855 -12.623  -1.294
  371   1HD1  LEU  44          HD13      LEU  44  -7.352 -11.688  -3.525
  372   2HD1  LEU  44          HD12      LEU  44  -6.971 -10.643  -2.159
  373   3HD1  LEU  44          HD11      LEU  44  -6.743 -12.386  -2.027
  374   1HD2  LEU  44          HD23      LEU  44 -10.229 -10.520  -0.922
  375   2HD2  LEU  44          HD22      LEU  44  -8.617 -10.487  -0.210
  376   3HD2  LEU  44          HD21      LEU  44  -8.934  -9.623  -1.715
  377    H    GLU  45           HN       GLU  45 -11.811 -13.288  -3.624
  378    HA   GLU  45           HA       GLU  45 -13.210 -15.051  -2.907
  379   1HB   GLU  45           HB2      GLU  45 -11.593 -16.170  -5.200
  380   2HB   GLU  45           HB1      GLU  45 -12.868 -17.111  -4.426
  381   1HG   GLU  45           HG2      GLU  45 -14.080 -14.655  -4.824
  382   2HG   GLU  45           HG1      GLU  45 -13.089 -14.844  -6.272
  383    H    GLU  46           HN       GLU  46 -10.524 -14.843  -1.515
  384    HA   GLU  46           HA       GLU  46 -10.593 -17.585  -0.370
  385   1HB   GLU  46           HB2      GLU  46  -8.188 -16.218  -1.563
  386   2HB   GLU  46           HB1      GLU  46  -8.003 -17.419  -0.284
  387   1HG   GLU  46           HG2      GLU  46  -9.816 -18.574  -2.076
  388   2HG   GLU  46           HG1      GLU  46  -8.596 -17.819  -3.102
  389    H    ILE  47           HN       ILE  47  -8.203 -15.018   0.159
  390    HA   ILE  47           HA       ILE  47  -7.695 -13.808   2.105
  391    HB   ILE  47           HB       ILE  47 -10.703 -14.033   2.251
  392   1HG1  ILE  47          HG12      ILE  47  -9.212 -11.463   2.109
  393   2HG1  ILE  47          HG11      ILE  47  -9.127 -12.503   0.686
  394   1HG2  ILE  47          HG23      ILE  47  -8.788 -12.773   4.223
  395   2HG2  ILE  47          HG22      ILE  47 -10.457 -12.220   4.060
  396   3HG2  ILE  47          HG21      ILE  47 -10.120 -13.879   4.555
  397   1HD1  ILE  47          HD11      ILE  47 -11.736 -11.777   2.037
  398   2HD1  ILE  47          HD13      ILE  47 -11.058 -10.848   0.702
  399   3HD1  ILE  47          HD12      ILE  47 -11.513 -12.533   0.458
  400    H    LYS  48           HN       LYS  48  -6.461 -15.099   3.425
  401    HA   LYS  48           HA       LYS  48  -7.865 -17.177   5.041
  402   1HB   LYS  48           HB2      LYS  48  -6.094 -18.211   3.850
  403   2HB   LYS  48           HB1      LYS  48  -4.997 -16.866   4.147
  404   1HG   LYS  48           HG2      LYS  48  -4.376 -18.708   5.608
  405   2HG   LYS  48           HG1      LYS  48  -5.069 -17.419   6.593
  406   1HD   LYS  48           HD2      LYS  48  -7.176 -18.561   6.755
  407   2HD   LYS  48           HD1      LYS  48  -6.690 -19.750   5.545
  408   1HE   LYS  48           HE2      LYS  48  -5.989 -21.037   7.262
  409   2HE   LYS  48           HE1      LYS  48  -4.670 -19.884   7.459
  410   1HZ   LYS  48           HZ3      LYS  48  -6.945 -18.789   8.643
  411   2HZ   LYS  48           HZ2      LYS  48  -6.816 -20.392   9.193
  412   3HZ   LYS  48           HZ1      LYS  48  -5.522 -19.312   9.403
  413    H    GLU  49           HN       GLU  49  -6.213 -14.140   5.224
  414    HA   GLU  49           HA       GLU  49  -5.604 -14.408   8.087
  415   1HB   GLU  49           HB2      GLU  49  -5.100 -12.406   5.968
  416   2HB   GLU  49           HB1      GLU  49  -5.413 -11.727   7.565
  417   1HG   GLU  49           HG2      GLU  49  -3.395 -13.922   7.019
  418   2HG   GLU  49           HG1      GLU  49  -2.989 -12.212   7.174
  419    H    GLN  50           HN       GLN  50  -7.996 -15.007   8.412
  420    HA   GLN  50           HA       GLN  50 -10.155 -13.273   8.095
  421   1HB   GLN  50           HB2      GLN  50 -10.532 -15.468   8.993
  422   2HB   GLN  50           HB1      GLN  50  -9.490 -15.147  10.378
  423   1HG   GLN  50           HG2      GLN  50 -11.054 -13.425  11.179
  424   2HG   GLN  50           HG1      GLN  50 -12.092 -13.706   9.780
  425   1HE2  GLN  50          HE22      GLN  50 -13.647 -15.799  12.336
  426   2HE2  GLN  50          HE21      GLN  50 -13.577 -14.169  11.868
  427    H    GLU  51           HN       GLU  51  -7.411 -12.912  10.200
  428    HA   GLU  51           HA       GLU  51  -8.722 -10.959  11.939
  429   1HB   GLU  51           HB2      GLU  51  -6.316 -12.469  11.996
  430   2HB   GLU  51           HB1      GLU  51  -5.859 -10.766  12.041
  431   1HG   GLU  51           HG2      GLU  51  -7.995 -10.813  13.770
  432   2HG   GLU  51           HG1      GLU  51  -7.252 -12.386  14.069
  433    H    VAL  52           HN       VAL  52  -6.395 -10.804   9.230
  434    HA   VAL  52           HA       VAL  52  -6.107  -7.934   9.392
  435    HB   VAL  52           HB       VAL  52  -5.533  -9.919   7.176
  436   1HG1  VAL  52          HG12      VAL  52  -5.398  -6.939   7.239
  437   2HG1  VAL  52          HG11      VAL  52  -4.066  -7.799   6.467
  438   3HG1  VAL  52          HG13      VAL  52  -5.715  -8.020   5.882
  439   1HG2  VAL  52          HG21      VAL  52  -4.188  -9.162   9.566
  440   2HG2  VAL  52          HG23      VAL  52  -3.598 -10.222   8.284
  441   3HG2  VAL  52          HG22      VAL  52  -3.273  -8.490   8.216
  442    H    VAL  53           HN       VAL  53  -8.189 -10.067   7.458
  443    HA   VAL  53           HA       VAL  53  -9.377  -7.795   6.055
  444    HB   VAL  53           HB       VAL  53 -10.338 -10.667   6.198
  445   1HG1  VAL  53          HG11      VAL  53 -11.907  -8.822   5.365
  446   2HG1  VAL  53          HG13      VAL  53 -10.779  -8.609   4.027
  447   3HG1  VAL  53          HG12      VAL  53 -11.607 -10.150   4.242
  448   1HG2  VAL  53          HG21      VAL  53  -8.197  -9.301   4.614
  449   2HG2  VAL  53          HG23      VAL  53  -8.240 -10.946   5.251
  450   3HG2  VAL  53          HG22      VAL  53  -9.167 -10.533   3.807
  451    H    ASP  54           HN       ASP  54 -10.093  -9.693   8.919
  452    HA   ASP  54           HA       ASP  54 -12.816  -8.620   9.130
  453   1HB   ASP  54           HB2      ASP  54 -12.147 -10.869  10.057
  454   2HB   ASP  54           HB1      ASP  54 -11.178 -10.022  11.263
  455    H    LYS  55           HN       LYS  55  -9.606  -7.696  10.068
  456    HA   LYS  55           HA       LYS  55 -10.440  -5.932  12.227
  457   1HB   LYS  55           HB2      LYS  55  -8.145  -6.828  12.125
  458   2HB   LYS  55           HB1      LYS  55  -7.882  -5.994  10.593
  459   1HG   LYS  55           HG2      LYS  55  -8.834  -4.354  12.895
  460   2HG   LYS  55           HG1      LYS  55  -7.159  -4.907  12.929
  461   1HD   LYS  55           HD2      LYS  55  -6.935  -4.011  10.560
  462   2HD   LYS  55           HD1      LYS  55  -8.507  -3.243  10.793
  463   1HE   LYS  55           HE2      LYS  55  -7.379  -1.510  11.704
  464   2HE   LYS  55           HE1      LYS  55  -7.111  -2.560  13.096
  465   1HZ   LYS  55           HZ3      LYS  55  -5.328  -2.753  10.768
  466   2HZ   LYS  55           HZ2      LYS  55  -5.107  -1.494  11.886
  467   3HZ   LYS  55           HZ1      LYS  55  -5.011  -3.113  12.394
  468    H    VAL  56           HN       VAL  56  -9.571  -5.477   8.787
  469    HA   VAL  56           HA       VAL  56 -10.211  -2.621   8.943
  470    HB   VAL  56           HB       VAL  56 -10.046  -2.890   6.362
  471   1HG1  VAL  56          HG11      VAL  56  -8.186  -2.431   8.359
  472   2HG1  VAL  56          HG13      VAL  56  -7.435  -3.710   7.404
  473   3HG1  VAL  56          HG12      VAL  56  -7.910  -2.197   6.632
  474   1HG2  VAL  56          HG21      VAL  56 -10.107  -5.574   7.019
  475   2HG2  VAL  56          HG23      VAL  56  -9.555  -4.916   5.481
  476   3HG2  VAL  56          HG22      VAL  56  -8.391  -5.279   6.754
  477    H    MET  57           HN       MET  57 -11.742  -5.591   7.880
  478    HA   MET  57           HA       MET  57 -14.056  -4.313   6.691
  479   1HB   MET  57           HB2      MET  57 -13.209  -6.701   6.271
  480   2HB   MET  57           HB1      MET  57 -13.933  -7.114   7.826
  481   1HG   MET  57           HG2      MET  57 -15.941  -7.292   6.837
  482   2HG   MET  57           HG1      MET  57 -15.847  -5.599   6.352
  483   1HE   MET  57           HE1      MET  57 -13.705  -5.180   4.957
  484   2HE   MET  57           HE3      MET  57 -12.925  -6.409   3.949
  485   3HE   MET  57           HE2      MET  57 -14.142  -5.338   3.256
  486    H    GLU  58           HN       GLU  58 -13.085  -5.215   9.921
  487    HA   GLU  58           HA       GLU  58 -15.779  -5.151  11.038
  488   1HB   GLU  58           HB2      GLU  58 -12.997  -5.230  12.157
  489   2HB   GLU  58           HB1      GLU  58 -14.310  -4.715  13.215
  490   1HG   GLU  58           HG2      GLU  58 -15.012  -7.082  11.650
  491   2HG   GLU  58           HG1      GLU  58 -13.602  -7.348  12.676
  492    H    THR  59           HN       THR  59 -13.025  -2.855  11.102
  493    HA   THR  59           HA       THR  59 -14.535  -0.751  12.363
  494    HB   THR  59           HB       THR  59 -12.233  -0.289  10.459
  495    HG1  THR  59           HG1      THR  59 -10.903  -1.177  11.835
  496   1HG2  THR  59          HG21      THR  59 -13.654   1.509  11.798
  497   2HG2  THR  59          HG23      THR  59 -12.605   1.014  13.126
  498   3HG2  THR  59          HG22      THR  59 -11.905   1.670  11.646
  499    H    LEU  60           HN       LEU  60 -14.309  -1.958   9.133
  500    HA   LEU  60           HA       LEU  60 -15.309   0.365   7.742
  501   1HB   LEU  60           HB2      LEU  60 -14.885  -2.528   7.157
  502   2HB   LEU  60           HB1      LEU  60 -16.026  -1.665   6.128
  503    HG   LEU  60           HG       LEU  60 -13.164  -0.842   6.686
  504   1HD1  LEU  60          HD12      LEU  60 -14.511  -2.389   4.535
  505   2HD1  LEU  60          HD11      LEU  60 -13.328  -1.190   4.012
  506   3HD1  LEU  60          HD13      LEU  60 -12.846  -2.480   5.113
  507   1HD2  LEU  60          HD22      LEU  60 -15.494   0.574   5.609
  508   2HD2  LEU  60          HD21      LEU  60 -13.936   1.216   6.127
  509   3HD2  LEU  60          HD23      LEU  60 -14.126   0.573   4.495
  510    H    ASP  61           HN       ASP  61 -16.875  -2.677   8.762
  511    HA   ASP  61           HA       ASP  61 -19.536  -1.694   8.123
  512   1HB   ASP  61           HB2      ASP  61 -18.373  -4.189   8.639
  513   2HB   ASP  61           HB1      ASP  61 -19.465  -3.919   9.999
  514    H    GLU  62           HN       GLU  62 -17.412  -1.221  10.731
  515    HA   GLU  62           HA       GLU  62 -19.371  -1.054  12.859
  516   1HB   GLU  62           HB2      GLU  62 -16.867  -1.360  13.157
  517   2HB   GLU  62           HB1      GLU  62 -16.692   0.345  12.742
  518   1HG   GLU  62           HG2      GLU  62 -18.141   0.978  14.616
  519   2HG   GLU  62           HG1      GLU  62 -18.395  -0.721  15.014
  520    H    ASP  63           HN       ASP  63 -17.989   1.254  10.566
  521    HA   ASP  63           HA       ASP  63 -20.238   3.077  11.070
  522   1HB   ASP  63           HB2      ASP  63 -17.379   3.844  11.715
  523   2HB   ASP  63           HB1      ASP  63 -18.680   5.018  11.508
  524    H    GLY  64           HN       GLY  64 -19.892   1.814   8.746
  525   1HA   GLY  64           HA2      GLY  64 -18.164   2.604   6.765
  526   2HA   GLY  64           HA1      GLY  64 -19.886   2.388   6.449
  527    H    ASP  65           HN       ASP  65 -20.563   4.633   8.329
  528    HA   ASP  65           HA       ASP  65 -20.131   6.808   6.371
  529   1HB   ASP  65           HB2      ASP  65 -22.382   6.176   7.571
  530   2HB   ASP  65           HB1      ASP  65 -21.714   7.112   8.908
  531    H    GLY  66           HN       GLY  66 -17.812   6.022   7.820
  532   1HA   GLY  66           HA2      GLY  66 -17.467   8.255   9.757
  533   2HA   GLY  66           HA1      GLY  66 -16.479   6.796   9.736
  534    H    GLU  67           HN       GLU  67 -15.096   9.122   9.716
  535    HA   GLU  67           HA       GLU  67 -14.405   9.626   6.854
  536   1HB   GLU  67           HB2      GLU  67 -14.083  11.239   9.379
  537   2HB   GLU  67           HB1      GLU  67 -13.085  11.580   7.965
  538   1HG   GLU  67           HG2      GLU  67 -15.020  12.013   6.602
  539   2HG   GLU  67           HG1      GLU  67 -16.107  11.418   7.858
  540    H    CYS  68           HN       CYS  68 -12.492   8.841   6.096
  541    HA   CYS  68           HA       CYS  68 -10.573   7.718   8.092
  542   1HB   CYS  68           HB2      CYS  68 -10.985   7.129   5.147
  543   2HB   CYS  68           HB1      CYS  68  -9.683   6.438   6.116
  544    HG   CYS  68           HG       CYS  68 -11.365   5.056   7.432
  545    H    ASP  69           HN       ASP  69  -8.200   7.829   7.250
  546    HA   ASP  69           HA       ASP  69  -7.740  10.615   6.264
  547   1HB   ASP  69           HB2      ASP  69  -5.887   8.797   7.839
  548   2HB   ASP  69           HB1      ASP  69  -5.561  10.472   7.392
  549    H    PHE  70           HN       PHE  70  -5.282  10.601   5.262
  550    HA   PHE  70           HA       PHE  70  -5.539   8.920   2.881
  551   1HB   PHE  70           HB2      PHE  70  -3.246  10.028   2.351
  552   2HB   PHE  70           HB1      PHE  70  -4.684  11.047   2.366
  553    HD1  PHE  70           HD2      PHE  70  -1.648  10.074   4.238
  554    HD2  PHE  70           HD1      PHE  70  -5.040  12.708   4.084
  555    HE1  PHE  70           HE2      PHE  70  -0.624  11.498   5.989
  556    HE2  PHE  70           HE1      PHE  70  -4.015  14.133   5.833
  557    HZ   PHE  70           HZ       PHE  70  -1.806  13.528   6.786
  558    H    GLN  71           HN       GLN  71  -3.515   9.013   5.777
  559    HA   GLN  71           HA       GLN  71  -1.769   6.858   4.834
  560   1HB   GLN  71           HB2      GLN  71  -2.176   8.122   7.565
  561   2HB   GLN  71           HB1      GLN  71  -0.989   6.857   7.239
  562   1HG   GLN  71           HG2      GLN  71  -0.443   8.617   5.222
  563   2HG   GLN  71           HG1      GLN  71  -0.940   9.717   6.509
  564   1HE2  GLN  71          HE21      GLN  71   0.830   6.581   6.698
  565   2HE2  GLN  71          HE22      GLN  71   2.179   7.221   7.502
  566    H    GLU  72           HN       GLU  72  -4.779   7.139   6.581
  567    HA   GLU  72           HA       GLU  72  -4.693   4.414   7.623
  568   1HB   GLU  72           HB2      GLU  72  -6.621   6.683   7.625
  569   2HB   GLU  72           HB1      GLU  72  -7.320   5.070   7.750
  570   1HG   GLU  72           HG2      GLU  72  -5.020   5.197   9.456
  571   2HG   GLU  72           HG1      GLU  72  -6.054   6.586   9.801
  572    H    PHE  73           HN       PHE  73  -6.517   6.064   5.024
  573    HA   PHE  73           HA       PHE  73  -7.750   3.697   3.999
  574   1HB   PHE  73           HB2      PHE  73  -8.680   5.733   3.239
  575   2HB   PHE  73           HB1      PHE  73  -7.104   6.402   2.824
  576    HD1  PHE  73           HD2      PHE  73  -5.882   5.583   0.808
  577    HD2  PHE  73           HD1      PHE  73  -9.878   4.305   1.721
  578    HE1  PHE  73           HE2      PHE  73  -6.144   4.747  -1.514
  579    HE2  PHE  73           HE1      PHE  73 -10.139   3.468  -0.597
  580    HZ   PHE  73           HZ       PHE  73  -8.273   3.689  -2.216
  581    H    MET  74           HN       MET  74  -4.529   4.942   3.758
  582    HA   MET  74           HA       MET  74  -3.818   3.404   1.371
  583   1HB   MET  74           HB2      MET  74  -2.644   5.469   2.962
  584   2HB   MET  74           HB1      MET  74  -1.514   4.122   2.907
  585   1HG   MET  74           HG2      MET  74  -2.837   4.854   0.346
  586   2HG   MET  74           HG1      MET  74  -1.630   5.981   0.963
  587   1HE   MET  74           HE2      MET  74  -2.481   3.556  -1.110
  588   2HE   MET  74           HE1      MET  74  -1.033   2.712  -1.657
  589   3HE   MET  74           HE3      MET  74  -2.011   2.038  -0.346
  590    H    ALA  75           HN       ALA  75  -2.874   3.204   4.820
  591    HA   ALA  75           HA       ALA  75  -1.588   0.653   4.517
  592   1HB   ALA  75           HB1      ALA  75  -1.287   2.322   6.432
  593   2HB   ALA  75           HB3      ALA  75  -2.813   1.715   7.075
  594   3HB   ALA  75           HB2      ALA  75  -1.432   0.629   6.904
  595    H    PHE  76           HN       PHE  76  -4.884   1.581   4.652
  596    HA   PHE  76           HA       PHE  76  -5.910  -0.929   5.731
  597   1HB   PHE  76           HB2      PHE  76  -6.977   1.627   5.012
  598   2HB   PHE  76           HB1      PHE  76  -7.862   0.399   4.113
  599    HD1  PHE  76           HD2      PHE  76  -6.362   0.633   7.554
  600    HD2  PHE  76           HD1      PHE  76  -9.815  -0.276   5.166
  601    HE1  PHE  76           HE2      PHE  76  -7.624   0.038   9.604
  602    HE2  PHE  76           HE1      PHE  76 -11.076  -0.872   7.216
  603    HZ   PHE  76           HZ       PHE  76  -9.980  -0.715   9.435
  604    H    VAL  77           HN       VAL  77  -5.411   0.470   2.510
  605    HA   VAL  77           HA       VAL  77  -6.647  -1.712   1.073
  606    HB   VAL  77           HB       VAL  77  -4.628   0.381   0.213
  607   1HG1  VAL  77          HG13      VAL  77  -5.247  -1.986  -1.108
  608   2HG1  VAL  77          HG12      VAL  77  -6.338  -0.812  -1.844
  609   3HG1  VAL  77          HG11      VAL  77  -4.598  -0.530  -1.861
  610   1HG2  VAL  77          HG21      VAL  77  -7.525   0.332   0.626
  611   2HG2  VAL  77          HG23      VAL  77  -6.451   1.710   0.393
  612   3HG2  VAL  77          HG22      VAL  77  -7.085   0.842  -1.005
  613    H    SER  78           HN       SER  78  -3.444  -1.158   2.386
  614    HA   SER  78           HA       SER  78  -2.183  -3.262   0.815
  615   1HB   SER  78           HB2      SER  78  -0.239  -2.862   2.178
  616   2HB   SER  78           HB1      SER  78  -0.972  -1.298   1.835
  617    HG   SER  78           HG       SER  78  -0.943  -1.115   3.933
  618    H    MET  79           HN       MET  79  -3.451  -3.058   4.156
  619    HA   MET  79           HA       MET  79  -2.619  -5.620   5.018
  620   1HB   MET  79           HB2      MET  79  -5.289  -4.446   5.781
  621   2HB   MET  79           HB1      MET  79  -4.179  -5.391   6.769
  622   1HG   MET  79           HG2      MET  79  -2.742  -3.112   5.882
  623   2HG   MET  79           HG1      MET  79  -4.308  -2.543   6.463
  624   1HE   MET  79           HE3      MET  79  -3.844  -1.321   8.337
  625   2HE   MET  79           HE2      MET  79  -5.034  -2.463   8.955
  626   3HE   MET  79           HE1      MET  79  -3.643  -2.029   9.947
  627    H    VAL  80           HN       VAL  80  -5.646  -4.674   3.364
  628    HA   VAL  80           HA       VAL  80  -6.693  -7.350   3.324
  629    HB   VAL  80           HB       VAL  80  -8.277  -6.415   1.634
  630   1HG1  VAL  80          HG11      VAL  80  -8.297  -6.086   4.267
  631   2HG1  VAL  80          HG13      VAL  80  -8.062  -4.393   3.833
  632   3HG1  VAL  80          HG12      VAL  80  -9.480  -5.263   3.251
  633   1HG2  VAL  80          HG22      VAL  80  -6.631  -3.900   2.025
  634   2HG2  VAL  80          HG21      VAL  80  -6.721  -4.848   0.542
  635   3HG2  VAL  80          HG23      VAL  80  -8.149  -4.001   1.136
  636    H    THR  81           HN       THR  81  -4.977  -5.408   0.845
  637    HA   THR  81           HA       THR  81  -5.109  -7.465  -1.165
  638    HB   THR  81           HB       THR  81  -2.837  -5.498  -1.030
  639    HG1  THR  81           HG1      THR  81  -5.577  -4.993  -1.289
  640   1HG2  THR  81          HG21      THR  81  -3.329  -7.277  -2.890
  641   2HG2  THR  81          HG23      THR  81  -4.585  -6.144  -3.390
  642   3HG2  THR  81          HG22      THR  81  -2.897  -5.636  -3.366
  643    H    THR  82           HN       THR  82  -3.429  -7.351   1.750
  644    HA   THR  82           HA       THR  82  -1.584  -9.492   0.777
  645    HB   THR  82           HB       THR  82   0.095  -8.664   2.418
  646    HG1  THR  82           HG1      THR  82  -1.680  -7.524   3.609
  647   1HG2  THR  82          HG23      THR  82  -0.833  -7.197   0.040
  648   2HG2  THR  82          HG22      THR  82   0.180  -6.247   1.127
  649   3HG2  THR  82          HG21      THR  82   0.786  -7.762   0.456
  650    H    ALA  83           HN       ALA  83  -4.271  -9.131   2.402
  651    HA   ALA  83           HA       ALA  83  -4.021  -9.919   5.047
  652   1HB   ALA  83           HB1      ALA  83  -6.139  -9.688   3.462
  653   2HB   ALA  83           HB3      ALA  83  -5.964 -11.439   3.346
  654   3HB   ALA  83           HB2      ALA  83  -6.212 -10.679   4.919
  655    H    CYS  84           HN       CYS  84  -4.360 -12.297   2.375
  656    HA   CYS  84           HA       CYS  84  -2.156 -13.891   2.808
  657   1HB   CYS  84           HB2      CYS  84  -3.993 -14.055   5.080
  658   2HB   CYS  84           HB1      CYS  84  -3.650 -15.630   4.368
  659    HG   CYS  84           HG       CYS  84  -1.798 -14.538   6.208
  660    H    HIS  85           HN       HIS  85  -2.985 -16.476   2.674
  661    HA   HIS  85           HA       HIS  85  -4.021 -18.049   1.286
  662   1HB   HIS  85           HB2      HIS  85  -6.084 -16.263   2.024
  663   2HB   HIS  85           HB1      HIS  85  -6.245 -16.501   0.285
  664    HD1  HIS  85           HD1      HIS  85  -4.967 -19.486   0.484
  665    HD2  HIS  85           HD2      HIS  85  -8.288 -18.030   2.545
  666    HE1  HIS  85           HE1      HIS  85  -6.350 -21.505   1.125
  667    H    GLU  86           HN       GLU  86  -5.230 -15.225  -0.517
  668    HA   GLU  86           HA       GLU  86  -4.049 -16.191  -2.967
  669   1HB   GLU  86           HB2      GLU  86  -5.908 -14.176  -2.214
  670   2HB   GLU  86           HB1      GLU  86  -4.607 -13.367  -3.088
  671   1HG   GLU  86           HG2      GLU  86  -6.252 -14.083  -4.711
  672   2HG   GLU  86           HG1      GLU  86  -4.830 -15.112  -4.891
  673    H    PHE  87           HN       PHE  87  -1.795 -16.427  -2.399
  674    HA   PHE  87           HA       PHE  87  -0.348 -13.830  -2.074
  675   1HB   PHE  87           HB2      PHE  87  -0.156 -15.586  -0.227
  676   2HB   PHE  87           HB1      PHE  87   0.721 -16.580  -1.390
  677    HD1  PHE  87           HD2      PHE  87   0.763 -12.877  -0.856
  678    HD2  PHE  87           HD1      PHE  87   2.967 -16.562  -0.707
  679    HE1  PHE  87           HE2      PHE  87   2.840 -11.615  -0.361
  680    HE2  PHE  87           HE1      PHE  87   5.043 -15.302  -0.211
  681    HZ   PHE  87           HZ       PHE  87   4.979 -12.828  -0.039
  682    H    PHE  88           HN       PHE  88   0.129 -13.293  -4.192
  683    HA   PHE  88           HA       PHE  88   0.916 -13.553  -6.402
  684   1HB   PHE  88           HB2      PHE  88   3.050 -15.205  -5.049
  685   2HB   PHE  88           HB1      PHE  88   3.226 -14.133  -6.440
  686    HD1  PHE  88           HD2      PHE  88   1.429 -11.896  -5.283
  687    HD2  PHE  88           HD1      PHE  88   4.721 -14.129  -3.657
  688    HE1  PHE  88           HE2      PHE  88   1.945 -10.016  -3.750
  689    HE2  PHE  88           HE1      PHE  88   5.235 -12.250  -2.122
  690    HZ   PHE  88           HZ       PHE  88   3.847 -10.194  -2.168
  691    H    GLU  89           HN       GLU  89  -1.049 -15.129  -6.596
  692    HA   GLU  89           HA       GLU  89  -0.140 -17.934  -7.005
  693   1HB   GLU  89           HB2      GLU  89  -2.311 -17.150  -5.713
  694   2HB   GLU  89           HB1      GLU  89  -2.986 -17.056  -7.340
  695   1HG   GLU  89           HG2      GLU  89  -3.465 -19.264  -6.806
  696   2HG   GLU  89           HG1      GLU  89  -1.896 -19.455  -7.588
  697    H    HIS  90           HN       HIS  90   0.572 -15.738  -8.864
  698    HA   HIS  90           HA       HIS  90   0.689 -15.428 -11.188
  699   1HB   HIS  90           HB2      HIS  90   1.210 -17.749 -11.383
  700   2HB   HIS  90           HB1      HIS  90  -0.444 -18.227 -11.019
  701    HD1  HIS  90           HD1      HIS  90   0.985 -15.786 -13.593
  702    HD2  HIS  90           HD2      HIS  90  -1.529 -19.103 -13.393
  703    HE1  HIS  90           HE1      HIS  90   0.123 -16.176 -15.943
  704    H    GLU  91           HN       GLU  91  -1.991 -15.118  -9.478
  705    HA   GLU  91           HA       GLU  91  -3.568 -14.276 -11.852
  706   1HB   GLU  91           HB2      GLU  91  -4.292 -16.391  -9.922
  707   2HB   GLU  91           HB1      GLU  91  -5.553 -15.188 -10.200
  708   1HG   GLU  91           HG2      GLU  91  -4.091 -16.386 -12.539
  709   2HG   GLU  91           HG1      GLU  91  -5.411 -17.276 -11.780
  710   1H    MET   0           HT1      MET   0 -11.011  -4.231 -14.202
  711   2H    MET   0           HT3      MET   0 -10.213  -5.379 -15.163
  712   3H    MET   0           HT2      MET   0  -9.671  -5.073 -13.582
  713    HA   MET   0           HA       MET   0  -8.184  -3.741 -14.567
  714   1HB   MET   0           HB2      MET   0  -9.044  -4.662 -16.804
  715   2HB   MET   0           HB1      MET   0 -10.069  -3.228 -16.874
  716   1HG   MET   0           HG2      MET   0  -7.240  -2.696 -16.212
  717   2HG   MET   0           HG1      MET   0  -7.515  -3.323 -17.838
  718   1HE   MET   0           HE2      MET   0  -7.589  -1.892 -19.608
  719   2HE   MET   0           HE1      MET   0  -7.775  -0.142 -19.543
  720   3HE   MET   0           HE3      MET   0  -6.457  -0.929 -18.663
  721    H    SER   1           HN       SER   1  -8.976  -2.471 -12.664
  722    HA   SER   1           HA       SER   1 -10.477  -0.038 -13.548
  723   1HB   SER   1           HB2      SER   1 -11.232   0.197 -11.221
  724   2HB   SER   1           HB1      SER   1 -11.695  -1.378 -11.857
  725    HG   SER   1           HG       SER   1 -10.739  -1.945 -10.028
  726    H    GLU   2           HN       GLU   2  -9.878   1.496 -11.237
  727    HA   GLU   2           HA       GLU   2  -7.185   2.365 -11.932
  728   1HB   GLU   2           HB2      GLU   2  -9.440   3.582 -10.828
  729   2HB   GLU   2           HB1      GLU   2  -8.290   3.528  -9.495
  730   1HG   GLU   2           HG2      GLU   2  -7.757   5.548 -10.590
  731   2HG   GLU   2           HG1      GLU   2  -6.567   4.411 -11.226
  732    H    LEU   3           HN       LEU   3  -8.577   1.598  -8.727
  733    HA   LEU   3           HA       LEU   3  -6.099   1.198  -7.415
  734   1HB   LEU   3           HB2      LEU   3  -8.322   1.397  -6.285
  735   2HB   LEU   3           HB1      LEU   3  -8.714  -0.225  -6.843
  736    HG   LEU   3           HG       LEU   3  -6.507  -0.944  -5.700
  737   1HD1  LEU   3          HD12      LEU   3  -6.947   1.827  -4.578
  738   2HD1  LEU   3          HD11      LEU   3  -6.073   0.591  -3.672
  739   3HD1  LEU   3          HD13      LEU   3  -5.463   1.133  -5.236
  740   1HD2  LEU   3          HD21      LEU   3  -9.130  -0.896  -4.874
  741   2HD2  LEU   3          HD23      LEU   3  -7.822  -1.695  -4.000
  742   3HD2  LEU   3          HD22      LEU   3  -8.322  -0.065  -3.545
  743    H    GLU   4           HN       GLU   4  -8.313  -1.298  -8.660
  744    HA   GLU   4           HA       GLU   4  -6.834  -3.579  -8.188
  745   1HB   GLU   4           HB2      GLU   4  -9.083  -3.384  -9.390
  746   2HB   GLU   4           HB1      GLU   4  -8.160  -3.094 -10.866
  747   1HG   GLU   4           HG2      GLU   4  -7.172  -5.397  -9.351
  748   2HG   GLU   4           HG1      GLU   4  -8.848  -5.587  -9.862
  749    H    LYS   5           HN       LYS   5  -6.189  -1.146 -10.672
  750    HA   LYS   5           HA       LYS   5  -4.083  -2.767 -11.907
  751   1HB   LYS   5           HB2      LYS   5  -5.587  -0.694 -12.819
  752   2HB   LYS   5           HB1      LYS   5  -4.108   0.159 -12.376
  753   1HG   LYS   5           HG2      LYS   5  -3.324  -0.509 -14.396
  754   2HG   LYS   5           HG1      LYS   5  -3.137  -2.093 -13.644
  755   1HD   LYS   5           HD2      LYS   5  -5.082  -2.931 -14.598
  756   2HD   LYS   5           HD1      LYS   5  -5.811  -1.333 -14.765
  757   1HE   LYS   5           HE2      LYS   5  -5.211  -1.582 -16.956
  758   2HE   LYS   5           HE1      LYS   5  -3.638  -1.041 -16.370
  759   1HZ   LYS   5           HZ3      LYS   5  -4.368  -3.897 -16.302
  760   2HZ   LYS   5           HZ2      LYS   5  -3.761  -3.196 -17.725
  761   3HZ   LYS   5           HZ1      LYS   5  -2.826  -3.194 -16.308
  762    H    ALA   6           HN       ALA   6  -4.221  -0.011  -9.665
  763    HA   ALA   6           HA       ALA   6  -1.312   0.203  -9.525
  764   1HB   ALA   6           HB2      ALA   6  -3.223   1.997  -9.055
  765   2HB   ALA   6           HB1      ALA   6  -3.095   1.357  -7.416
  766   3HB   ALA   6           HB3      ALA   6  -1.683   2.065  -8.198
  767    H    MET   7           HN       MET   7  -3.710  -0.484  -6.960
  768    HA   MET   7           HA       MET   7  -2.021  -1.467  -5.002
  769   1HB   MET   7           HB2      MET   7  -4.433  -1.229  -4.653
  770   2HB   MET   7           HB1      MET   7  -4.747  -2.548  -5.785
  771   1HG   MET   7           HG2      MET   7  -4.858  -3.521  -3.605
  772   2HG   MET   7           HG1      MET   7  -3.301  -4.011  -4.271
  773   1HE   MET   7           HE2      MET   7  -1.459  -4.115  -3.031
  774   2HE   MET   7           HE1      MET   7  -0.986  -2.572  -3.736
  775   3HE   MET   7           HE3      MET   7  -0.753  -2.867  -2.008
  776    H    VAL   8           HN       VAL   8  -3.554  -3.419  -7.564
  777    HA   VAL   8           HA       VAL   8  -2.206  -5.848  -6.872
  778    HB   VAL   8           HB       VAL   8  -3.218  -5.025  -9.607
  779   1HG1  VAL   8          HG11      VAL   8  -2.757  -7.709  -8.270
  780   2HG1  VAL   8          HG13      VAL   8  -3.562  -7.494  -9.825
  781   3HG1  VAL   8          HG12      VAL   8  -1.864  -7.054  -9.642
  782   1HG2  VAL   8          HG23      VAL   8  -4.791  -4.854  -7.506
  783   2HG2  VAL   8          HG22      VAL   8  -5.371  -5.671  -8.957
  784   3HG2  VAL   8          HG21      VAL   8  -4.782  -6.617  -7.590
  785    H    ALA   9           HN       ALA   9  -1.348  -3.221  -9.112
  786    HA   ALA   9           HA       ALA   9   0.878  -4.436 -10.367
  787   1HB   ALA   9           HB3      ALA   9   0.163  -1.600  -9.678
  788   2HB   ALA   9           HB2      ALA   9   1.770  -1.955 -10.314
  789   3HB   ALA   9           HB1      ALA   9   0.338  -2.352 -11.265
  790    H    LEU  10           HN       LEU  10   0.662  -2.797  -7.214
  791    HA   LEU  10           HA       LEU  10   3.435  -2.795  -6.603
  792   1HB   LEU  10           HB2      LEU  10   1.089  -2.102  -5.260
  793   2HB   LEU  10           HB1      LEU  10   1.762  -3.412  -4.288
  794    HG   LEU  10           HG       LEU  10   3.622  -1.282  -5.260
  795   1HD1  LEU  10          HD12      LEU  10   1.485  -0.952  -3.167
  796   2HD1  LEU  10          HD11      LEU  10   3.032  -0.125  -2.988
  797   3HD1  LEU  10          HD13      LEU  10   2.019   0.194  -4.396
  798   1HD2  LEU  10          HD21      LEU  10   3.540  -3.433  -3.293
  799   2HD2  LEU  10          HD23      LEU  10   4.932  -2.569  -3.943
  800   3HD2  LEU  10          HD22      LEU  10   4.047  -1.907  -2.567
  801    H    ILE  11           HN       ILE  11   0.946  -5.271  -5.918
  802    HA   ILE  11           HA       ILE  11   2.573  -7.155  -4.605
  803    HB   ILE  11           HB       ILE  11   0.201  -7.430  -6.451
  804   1HG1  ILE  11          HG12      ILE  11  -0.774  -8.359  -4.306
  805   2HG1  ILE  11          HG11      ILE  11   0.734  -7.916  -3.507
  806   1HG2  ILE  11          HG21      ILE  11   2.121  -9.528  -5.659
  807   2HG2  ILE  11          HG23      ILE  11   0.438  -9.910  -5.298
  808   3HG2  ILE  11          HG22      ILE  11   0.922  -9.532  -6.951
  809   1HD1  ILE  11          HD13      ILE  11   0.400  -5.563  -4.177
  810   2HD1  ILE  11          HD12      ILE  11  -1.111  -6.005  -4.973
  811   3HD1  ILE  11          HD11      ILE  11  -0.961  -6.147  -3.221
  812    H    ASP  12           HN       ASP  12   2.377  -6.313  -8.007
  813    HA   ASP  12           HA       ASP  12   3.792  -8.528  -9.105
  814   1HB   ASP  12           HB2      ASP  12   2.564  -6.691 -10.367
  815   2HB   ASP  12           HB1      ASP  12   3.968  -5.668 -10.083
  816    H    VAL  13           HN       VAL  13   5.070  -5.286  -8.285
  817    HA   VAL  13           HA       VAL  13   7.781  -5.746  -8.702
  818    HB   VAL  13           HB       VAL  13   6.424  -4.156  -6.508
  819   1HG1  VAL  13          HG12      VAL  13   9.187  -4.919  -6.761
  820   2HG1  VAL  13          HG11      VAL  13   9.035  -3.184  -7.041
  821   3HG1  VAL  13          HG13      VAL  13   8.437  -3.889  -5.540
  822   1HG2  VAL  13          HG21      VAL  13   7.235  -3.702  -9.317
  823   2HG2  VAL  13          HG23      VAL  13   5.978  -2.909  -8.368
  824   3HG2  VAL  13          HG22      VAL  13   7.660  -2.406  -8.199
  825    H    PHE  14           HN       PHE  14   5.878  -6.635  -5.830
  826    HA   PHE  14           HA       PHE  14   8.054  -7.575  -4.254
  827   1HB   PHE  14           HB2      PHE  14   5.695  -7.208  -3.453
  828   2HB   PHE  14           HB1      PHE  14   5.245  -8.705  -4.272
  829    HD1  PHE  14           HD1      PHE  14   6.593 -10.833  -3.681
  830    HD2  PHE  14           HD2      PHE  14   6.599  -7.270  -1.283
  831    HE1  PHE  14           HE1      PHE  14   7.405 -12.145  -1.739
  832    HE2  PHE  14           HE2      PHE  14   7.411  -8.581   0.662
  833    HZ   PHE  14           HZ       PHE  14   7.813 -11.018   0.433
  834    H    HIS  15           HN       HIS  15   5.825  -9.481  -6.322
  835    HA   HIS  15           HA       HIS  15   7.358 -11.906  -6.028
  836   1HB   HIS  15           HB2      HIS  15   4.887 -11.581  -6.797
  837   2HB   HIS  15           HB1      HIS  15   5.590 -11.347  -8.399
  838    HD1  HIS  15           HD1      HIS  15   4.282 -13.691  -8.902
  839    HD2  HIS  15           HD2      HIS  15   7.590 -13.922  -6.374
  840    HE1  HIS  15           HE1      HIS  15   4.953 -16.131  -8.823
  841    H    GLN  16           HN       GLN  16   8.088  -9.079  -7.657
  842    HA   GLN  16           HA       GLN  16   9.476 -10.402  -9.907
  843   1HB   GLN  16           HB2      GLN  16   8.338  -7.864  -9.516
  844   2HB   GLN  16           HB1      GLN  16  10.079  -7.583  -9.567
  845   1HG   GLN  16           HG2      GLN  16   9.550  -7.512 -11.831
  846   2HG   GLN  16           HG1      GLN  16   9.983  -9.213 -11.637
  847   1HE2  GLN  16          HE22      GLN  16   6.725 -10.387 -12.334
  848   2HE2  GLN  16          HE21      GLN  16   8.325 -10.786 -11.928
  849    H    TYR  17           HN       TYR  17  10.262  -8.558  -6.969
  850    HA   TYR  17           HA       TYR  17  13.134  -8.779  -7.412
  851   1HB   TYR  17           HB2      TYR  17  11.399  -7.796  -5.153
  852   2HB   TYR  17           HB1      TYR  17  13.139  -7.992  -4.931
  853    HD1  TYR  17           HD1      TYR  17  10.669  -6.490  -7.326
  854    HD2  TYR  17           HD2      TYR  17  14.564  -6.239  -5.534
  855    HE1  TYR  17           HE1      TYR  17  11.055  -4.324  -8.473
  856    HE2  TYR  17           HE2      TYR  17  14.950  -4.074  -6.682
  857    HH   TYR  17           HH       TYR  17  13.492  -3.043  -9.200
  858    H    SER  18           HN       SER  18  10.921 -10.188  -4.958
  859    HA   SER  18           HA       SER  18  13.005 -12.139  -4.224
  860   1HB   SER  18           HB2      SER  18  11.814 -11.442  -2.333
  861   2HB   SER  18           HB1      SER  18  10.271 -11.441  -3.181
  862    HG   SER  18           HG       SER  18  11.832 -13.697  -2.433
  863    H    GLY  19           HN       GLY  19  11.475 -12.097  -6.909
  864   1HA   GLY  19           HA2      GLY  19  10.648 -14.959  -6.806
  865   2HA   GLY  19           HA1      GLY  19   9.806 -13.782  -7.813
  866    H    ARG  20           HN       ARG  20  13.282 -13.731  -7.390
  867    HA   ARG  20           HA       ARG  20  13.779 -15.149  -9.908
  868   1HB   ARG  20           HB2      ARG  20  14.736 -13.252 -11.092
  869   2HB   ARG  20           HB1      ARG  20  13.076 -12.863 -10.638
  870   1HG   ARG  20           HG2      ARG  20  13.834 -11.557  -8.741
  871   2HG   ARG  20           HG1      ARG  20  15.504 -12.062  -9.011
  872   1HD   ARG  20           HD2      ARG  20  14.658 -11.012 -11.474
  873   2HD   ARG  20           HD1      ARG  20  14.026  -9.900 -10.260
  874    HE   ARG  20           HE       ARG  20  16.252  -9.287  -9.728
  875   1HH1  ARG  20          HH21      ARG  20  17.431 -11.983  -9.348
  876   2HH1  ARG  20          HH22      ARG  20  18.549 -12.099 -10.666
  877   1HH2  ARG  20          HH11      ARG  20  17.126  -9.483 -12.448
  878   2HH2  ARG  20          HH12      ARG  20  18.377 -10.683 -12.422
  879    H    GLU  21           HN       GLU  21  15.013 -13.277  -7.177
  880    HA   GLU  21           HA       GLU  21  17.722 -14.399  -7.680
  881   1HB   GLU  21           HB2      GLU  21  18.244 -12.800  -5.664
  882   2HB   GLU  21           HB1      GLU  21  17.986 -12.119  -7.269
  883   1HG   GLU  21           HG2      GLU  21  15.838 -11.347  -6.741
  884   2HG   GLU  21           HG1      GLU  21  15.656 -12.477  -5.400
  885    H    GLY  22           HN       GLY  22  16.838 -13.543  -4.424
  886   1HA   GLY  22           HA2      GLY  22  17.566 -16.150  -3.440
  887   2HA   GLY  22           HA1      GLY  22  16.844 -14.859  -2.480
  888    H    ASP  23           HN       ASP  23  15.810 -17.050  -1.665
  889    HA   ASP  23           HA       ASP  23  13.856 -18.452  -3.108
  890   1HB   ASP  23           HB2      ASP  23  14.424 -17.914  -0.272
  891   2HB   ASP  23           HB1      ASP  23  12.723 -18.241  -0.602
  892    H    LYS  24           HN       LYS  24  11.359 -18.156  -2.288
  893    HA   LYS  24           HA       LYS  24  10.667 -15.334  -3.008
  894   1HB   LYS  24           HB2      LYS  24   8.686 -17.568  -3.239
  895   2HB   LYS  24           HB1      LYS  24   8.852 -16.114  -4.223
  896   1HG   LYS  24           HG2      LYS  24  11.156 -17.201  -4.906
  897   2HG   LYS  24           HG1      LYS  24  10.375 -18.696  -4.386
  898   1HD   LYS  24           HD2      LYS  24   8.425 -18.078  -5.882
  899   2HD   LYS  24           HD1      LYS  24   9.421 -16.772  -6.523
  900   1HE   LYS  24           HE2      LYS  24  10.467 -19.597  -6.464
  901   2HE   LYS  24           HE1      LYS  24   9.420 -19.057  -7.777
  902   1HZ   LYS  24           HZ3      LYS  24  10.978 -17.174  -8.100
  903   2HZ   LYS  24           HZ2      LYS  24  12.023 -17.888  -6.966
  904   3HZ   LYS  24           HZ1      LYS  24  11.665 -18.692  -8.420
  905    H    HIS  25           HN       HIS  25   8.178 -15.019  -2.194
  906    HA   HIS  25           HA       HIS  25   6.799 -14.684  -0.339
  907   1HB   HIS  25           HB2      HIS  25   6.423 -16.978  -0.126
  908   2HB   HIS  25           HB1      HIS  25   8.103 -17.330   0.248
  909    HD1  HIS  25           HD1      HIS  25   4.868 -16.363   1.814
  910    HD2  HIS  25           HD2      HIS  25   8.846 -16.789   2.990
  911    HE1  HIS  25           HE1      HIS  25   4.870 -16.374   4.348
  912    H    LYS  26           HN       LYS  26  10.009 -14.129  -0.334
  913    HA   LYS  26           HA       LYS  26   9.847 -12.753   2.273
  914   1HB   LYS  26           HB2      LYS  26  12.301 -13.716   2.654
  915   2HB   LYS  26           HB1      LYS  26  10.880 -14.603   3.203
  916   1HG   LYS  26           HG2      LYS  26  11.061 -16.194   1.545
  917   2HG   LYS  26           HG1      LYS  26  11.793 -15.071   0.399
  918   1HD   LYS  26           HD2      LYS  26  13.614 -16.422   0.961
  919   2HD   LYS  26           HD1      LYS  26  13.798 -15.083   2.094
  920   1HE   LYS  26           HE2      LYS  26  13.030 -16.332   3.909
  921   2HE   LYS  26           HE1      LYS  26  12.149 -17.465   2.883
  922   1HZ   LYS  26           HZ3      LYS  26  15.101 -17.259   2.837
  923   2HZ   LYS  26           HZ2      LYS  26  14.284 -18.295   3.907
  924   3HZ   LYS  26           HZ1      LYS  26  14.128 -18.507   2.229
  925    H    LEU  27           HN       LEU  27  11.231 -10.951   2.391
  926    HA   LEU  27           HA       LEU  27  12.900 -10.417  -0.034
  927   1HB   LEU  27           HB2      LEU  27  10.551  -9.106   0.459
  928   2HB   LEU  27           HB1      LEU  27  11.697  -8.068   1.309
  929    HG   LEU  27           HG       LEU  27  13.122  -8.296  -0.878
  930   1HD1  LEU  27          HD13      LEU  27  10.600  -9.599  -1.578
  931   2HD1  LEU  27          HD12      LEU  27  10.998  -8.276  -2.674
  932   3HD1  LEU  27          HD11      LEU  27  12.138  -9.603  -2.439
  933   1HD2  LEU  27          HD22      LEU  27  10.637  -6.626  -0.477
  934   2HD2  LEU  27          HD21      LEU  27  12.325  -6.151  -0.282
  935   3HD2  LEU  27          HD23      LEU  27  11.662  -6.408  -1.897
  936    H    LYS  28           HN       LYS  28  13.706  -7.822   1.041
  937    HA   LYS  28           HA       LYS  28  15.026  -8.517   3.603
  938   1HB   LYS  28           HB2      LYS  28  16.354  -8.422   0.987
  939   2HB   LYS  28           HB1      LYS  28  17.111  -7.381   2.192
  940   1HG   LYS  28           HG2      LYS  28  17.649  -9.155   3.591
  941   2HG   LYS  28           HG1      LYS  28  16.340 -10.166   2.978
  942   1HD   LYS  28           HD2      LYS  28  18.004 -11.201   1.816
  943   2HD   LYS  28           HD1      LYS  28  17.830  -9.831   0.717
  944   1HE   LYS  28           HE2      LYS  28  19.576  -8.610   1.980
  945   2HE   LYS  28           HE1      LYS  28  19.771 -10.005   3.042
  946   1HZ   LYS  28           HZ1      LYS  28  19.916 -10.860   0.371
  947   2HZ   LYS  28           HZ3      LYS  28  20.975  -9.552   0.569
  948   3HZ   LYS  28           HZ2      LYS  28  21.121 -10.920   1.568
  949    H    LYS  29           HN       LYS  29  16.053  -6.587   4.590
  950    HA   LYS  29           HA       LYS  29  14.409  -4.216   4.161
  951   1HB   LYS  29           HB2      LYS  29  16.891  -4.418   5.879
  952   2HB   LYS  29           HB1      LYS  29  15.538  -3.300   6.062
  953   1HG   LYS  29           HG2      LYS  29  14.066  -5.035   6.766
  954   2HG   LYS  29           HG1      LYS  29  15.185  -6.297   6.241
  955   1HD   LYS  29           HD2      LYS  29  15.812  -6.317   8.431
  956   2HD   LYS  29           HD1      LYS  29  16.762  -4.904   7.967
  957   1HE   LYS  29           HE2      LYS  29  15.588  -4.032   9.770
  958   2HE   LYS  29           HE1      LYS  29  14.490  -3.625   8.451
  959   1HZ   LYS  29           HZ3      LYS  29  13.398  -5.826   8.905
  960   2HZ   LYS  29           HZ2      LYS  29  14.305  -5.898  10.340
  961   3HZ   LYS  29           HZ1      LYS  29  13.185  -4.641  10.100
  962    H    SER  30           HN       SER  30  17.420  -5.385   2.978
  963    HA   SER  30           HA       SER  30  18.488  -2.746   2.294
  964   1HB   SER  30           HB2      SER  30  20.211  -4.309   2.573
  965   2HB   SER  30           HB1      SER  30  19.312  -5.592   1.771
  966    HG   SER  30           HG       SER  30  20.324  -3.251   0.517
  967    H    GLU  31           HN       GLU  31  16.957  -5.449   0.538
  968    HA   GLU  31           HA       GLU  31  16.909  -3.945  -1.975
  969   1HB   GLU  31           HB2      GLU  31  16.937  -6.538  -1.654
  970   2HB   GLU  31           HB1      GLU  31  15.204  -6.364  -1.369
  971   1HG   GLU  31           HG2      GLU  31  14.903  -6.336  -3.602
  972   2HG   GLU  31           HG1      GLU  31  15.767  -4.800  -3.650
  973    H    LEU  32           HN       LEU  32  14.962  -4.247   0.865
  974    HA   LEU  32           HA       LEU  32  12.497  -3.293  -0.387
  975   1HB   LEU  32           HB2      LEU  32  12.157  -4.566   1.599
  976   2HB   LEU  32           HB1      LEU  32  13.407  -3.683   2.473
  977    HG   LEU  32           HG       LEU  32  12.052  -1.740   2.669
  978   1HD1  LEU  32          HD12      LEU  32  10.855  -2.773   0.233
  979   2HD1  LEU  32          HD11      LEU  32   9.614  -2.306   1.394
  980   3HD1  LEU  32          HD13      LEU  32  10.824  -1.133   0.878
  981   1HD2  LEU  32          HD22      LEU  32  10.483  -4.290   3.044
  982   2HD2  LEU  32          HD21      LEU  32  11.274  -3.301   4.269
  983   3HD2  LEU  32          HD23      LEU  32   9.802  -2.724   3.487
  984    H    LYS  33           HN       LYS  33  15.113  -1.944   1.602
  985    HA   LYS  33           HA       LYS  33  14.146   0.751   1.725
  986   1HB   LYS  33           HB2      LYS  33  16.107  -0.255   3.025
  987   2HB   LYS  33           HB1      LYS  33  17.051  -0.093   1.552
  988   1HG   LYS  33           HG2      LYS  33  15.641   2.371   2.097
  989   2HG   LYS  33           HG1      LYS  33  16.609   1.898   3.496
  990   1HD   LYS  33           HD2      LYS  33  18.601   1.697   2.116
  991   2HD   LYS  33           HD1      LYS  33  17.661   2.010   0.656
  992   1HE   LYS  33           HE2      LYS  33  18.299   4.169   0.981
  993   2HE   LYS  33           HE1      LYS  33  17.003   4.184   2.179
  994   1HZ   LYS  33           HZ2      LYS  33  18.792   3.281   3.750
  995   2HZ   LYS  33           HZ1      LYS  33  19.904   3.846   2.596
  996   3HZ   LYS  33           HZ3      LYS  33  18.839   4.931   3.348
  997    H    GLU  34           HN       GLU  34  16.221  -0.985  -0.509
  998    HA   GLU  34           HA       GLU  34  16.716   1.228  -2.286
  999   1HB   GLU  34           HB2      GLU  34  17.208  -1.679  -2.193
 1000   2HB   GLU  34           HB1      GLU  34  16.972  -1.061  -3.823
 1001   1HG   GLU  34           HG2      GLU  34  18.639   0.770  -2.385
 1002   2HG   GLU  34           HG1      GLU  34  19.288  -0.858  -2.190
 1003    H    LEU  35           HN       LEU  35  14.239  -1.231  -2.033
 1004    HA   LEU  35           HA       LEU  35  12.986  -0.928  -4.570
 1005   1HB   LEU  35           HB2      LEU  35  12.509  -2.419  -2.291
 1006   2HB   LEU  35           HB1      LEU  35  11.147  -1.293  -2.295
 1007    HG   LEU  35           HG       LEU  35  10.507  -3.255  -3.564
 1008   1HD1  LEU  35          HD13      LEU  35  11.176  -0.849  -5.275
 1009   2HD1  LEU  35          HD12      LEU  35  10.207  -2.200  -5.860
 1010   3HD1  LEU  35          HD11      LEU  35   9.636  -1.227  -4.505
 1011   1HD2  LEU  35          HD21      LEU  35  12.912  -3.915  -4.053
 1012   2HD2  LEU  35          HD23      LEU  35  11.797  -4.111  -5.405
 1013   3HD2  LEU  35          HD22      LEU  35  12.890  -2.729  -5.358
 1014    H    ILE  36           HN       ILE  36  12.617   0.879  -1.533
 1015    HA   ILE  36           HA       ILE  36  10.555   2.631  -2.651
 1016    HB   ILE  36           HB       ILE  36  12.073   3.418  -0.211
 1017   1HG1  ILE  36          HG12      ILE  36  10.471   0.876  -0.501
 1018   2HG1  ILE  36          HG11      ILE  36  12.021   1.116   0.300
 1019   1HG2  ILE  36          HG23      ILE  36   9.876   4.394  -1.339
 1020   2HG2  ILE  36          HG22      ILE  36   9.104   3.097  -0.427
 1021   3HG2  ILE  36          HG21      ILE  36  10.037   4.332   0.416
 1022   1HD1  ILE  36          HD13      ILE  36  10.882   2.515   2.023
 1023   2HD1  ILE  36          HD12      ILE  36   9.336   2.157   1.253
 1024   3HD1  ILE  36          HD11      ILE  36  10.277   0.860   1.991
 1025    H    ASN  37           HN       ASN  37  13.859   3.255  -1.416
 1026    HA   ASN  37           HA       ASN  37  14.034   5.901  -2.412
 1027   1HB   ASN  37           HB2      ASN  37  15.553   4.596  -0.737
 1028   2HB   ASN  37           HB1      ASN  37  16.456   4.138  -2.183
 1029   1HD2  ASN  37          HD22      ASN  37  16.371   8.109  -1.093
 1030   2HD2  ASN  37          HD21      ASN  37  15.109   7.090  -0.595
 1031    H    ASN  38           HN       ASN  38  13.849   3.106  -4.281
 1032    HA   ASN  38           HA       ASN  38  15.478   4.369  -6.439
 1033   1HB   ASN  38           HB2      ASN  38  15.965   1.962  -5.588
 1034   2HB   ASN  38           HB1      ASN  38  14.514   1.517  -6.488
 1035   1HD2  ASN  38          HD22      ASN  38  16.050   2.605  -9.661
 1036   2HD2  ASN  38          HD21      ASN  38  14.600   2.862  -8.822
 1037    H    GLU  39           HN       GLU  39  12.514   2.379  -6.080
 1038    HA   GLU  39           HA       GLU  39  11.478   3.660  -8.552
 1039   1HB   GLU  39           HB2      GLU  39  10.525   1.264  -6.962
 1040   2HB   GLU  39           HB1      GLU  39   9.722   1.880  -8.407
 1041   1HG   GLU  39           HG2      GLU  39  11.123   0.609  -9.630
 1042   2HG   GLU  39           HG1      GLU  39  12.430   1.673  -9.116
 1043    H    LEU  40           HN       LEU  40  11.541   4.954  -5.771
 1044    HA   LEU  40           HA       LEU  40   8.690   5.793  -5.846
 1045   1HB   LEU  40           HB2      LEU  40   8.971   4.052  -4.043
 1046   2HB   LEU  40           HB1      LEU  40  10.106   5.140  -3.248
 1047    HG   LEU  40           HG       LEU  40   7.724   6.586  -3.964
 1048   1HD1  LEU  40          HD11      LEU  40   6.889   4.120  -3.686
 1049   2HD1  LEU  40          HD13      LEU  40   7.168   4.406  -1.968
 1050   3HD1  LEU  40          HD12      LEU  40   6.026   5.415  -2.858
 1051   1HD2  LEU  40          HD23      LEU  40   9.582   6.902  -2.140
 1052   2HD2  LEU  40          HD22      LEU  40   7.925   7.379  -1.767
 1053   3HD2  LEU  40          HD21      LEU  40   8.559   5.844  -1.169
 1054    H    SER  41           HN       SER  41  11.835   6.398  -4.254
 1055    HA   SER  41           HA       SER  41  11.481   9.015  -3.406
 1056   1HB   SER  41           HB2      SER  41  13.660   7.318  -3.761
 1057   2HB   SER  41           HB1      SER  41  14.040   8.703  -4.780
 1058    HG   SER  41           HG       SER  41  14.038   9.991  -3.055
 1059    H    HIS  42           HN       HIS  42  11.595   7.866  -6.684
 1060    HA   HIS  42           HA       HIS  42  12.454   9.907  -8.269
 1061   1HB   HIS  42           HB2      HIS  42  10.610   7.803  -8.571
 1062   2HB   HIS  42           HB1      HIS  42   9.772   9.250  -9.136
 1063    HD1  HIS  42           HD1      HIS  42  12.975   7.298  -9.719
 1064    HD2  HIS  42           HD2      HIS  42  10.679  10.234 -11.590
 1065    HE1  HIS  42           HE1      HIS  42  13.982   7.637 -12.017
 1066    H    PHE  43           HN       PHE  43   9.594  10.050  -6.198
 1067    HA   PHE  43           HA       PHE  43   9.476  12.969  -6.780
 1068   1HB   PHE  43           HB2      PHE  43   7.140  12.984  -7.085
 1069   2HB   PHE  43           HB1      PHE  43   7.663  11.567  -7.993
 1070    HD1  PHE  43           HD1      PHE  43   7.443   9.274  -6.951
 1071    HD2  PHE  43           HD2      PHE  43   5.706  12.790  -5.191
 1072    HE1  PHE  43           HE1      PHE  43   5.947   7.851  -5.577
 1073    HE2  PHE  43           HE2      PHE  43   4.214  11.365  -3.817
 1074    HZ   PHE  43           HZ       PHE  43   4.332   8.897  -4.011
 1075    H    LEU  44           HN       LEU  44   9.850  13.980  -4.885
 1076    HA   LEU  44           HA       LEU  44   8.287  13.737  -2.567
 1077   1HB   LEU  44           HB2      LEU  44   9.819  11.455  -2.779
 1078   2HB   LEU  44           HB1      LEU  44  10.821  12.468  -1.747
 1079    HG   LEU  44           HG       LEU  44   9.006  12.781  -0.176
 1080   1HD1  LEU  44          HD13      LEU  44   7.394  12.127  -2.431
 1081   2HD1  LEU  44          HD12      LEU  44   7.068  10.925  -1.187
 1082   3HD1  LEU  44          HD11      LEU  44   6.858  12.640  -0.834
 1083   1HD2  LEU  44          HD23      LEU  44  10.377  10.645  -0.126
 1084   2HD2  LEU  44          HD22      LEU  44   8.798  10.530   0.652
 1085   3HD2  LEU  44          HD21      LEU  44   9.041   9.856  -0.959
 1086    H    GLU  45           HN       GLU  45  11.857  13.719  -2.540
 1087    HA   GLU  45           HA       GLU  45  13.300  15.376  -1.681
 1088   1HB   GLU  45           HB2      GLU  45  11.591  16.769  -3.744
 1089   2HB   GLU  45           HB1      GLU  45  12.906  17.607  -2.922
 1090   1HG   GLU  45           HG2      GLU  45  14.080  15.215  -3.670
 1091   2HG   GLU  45           HG1      GLU  45  13.025  15.581  -5.037
 1092    H    GLU  46           HN       GLU  46  10.678  15.008  -0.201
 1093    HA   GLU  46           HA       GLU  46  10.821  17.590   1.262
 1094   1HB   GLU  46           HB2      GLU  46   8.354  16.384   0.025
 1095   2HB   GLU  46           HB1      GLU  46   8.236  17.421   1.447
 1096   1HG   GLU  46           HG2      GLU  46   9.976  18.781  -0.274
 1097   2HG   GLU  46           HG1      GLU  46   8.704  18.159  -1.326
 1098    H    ILE  47           HN       ILE  47   8.437  14.985   1.587
 1099    HA   ILE  47           HA       ILE  47   8.009  13.548   3.393
 1100    HB   ILE  47           HB       ILE  47  11.023  13.746   3.425
 1101   1HG1  ILE  47          HG12      ILE  47   9.506  11.216   3.042
 1102   2HG1  ILE  47          HG11      ILE  47   9.364  12.421   1.761
 1103   1HG2  ILE  47          HG23      ILE  47   9.189  12.260   5.316
 1104   2HG2  ILE  47          HG22      ILE  47  10.843  11.728   5.010
 1105   3HG2  ILE  47          HG21      ILE  47  10.543  13.316   5.718
 1106   1HD1  ILE  47          HD11      ILE  47  12.027  11.531   2.891
 1107   2HD1  ILE  47          HD13      ILE  47  11.281  10.771   1.487
 1108   3HD1  ILE  47          HD12      ILE  47  11.739  12.473   1.428
 1109    H    LYS  48           HN       LYS  48   6.847  14.672   4.914
 1110    HA   LYS  48           HA       LYS  48   8.338  16.534   6.705
 1111   1HB   LYS  48           HB2      LYS  48   6.523  17.709   5.731
 1112   2HB   LYS  48           HB1      LYS  48   5.431  16.341   5.913
 1113   1HG   LYS  48           HG2      LYS  48   4.891  17.994   7.612
 1114   2HG   LYS  48           HG1      LYS  48   5.616  16.595   8.402
 1115   1HD   LYS  48           HD2      LYS  48   7.739  17.702   8.604
 1116   2HD   LYS  48           HD1      LYS  48   7.208  19.030   7.569
 1117   1HE   LYS  48           HE2      LYS  48   6.595  20.101   9.462
 1118   2HE   LYS  48           HE1      LYS  48   5.278  18.935   9.578
 1119   1HZ   LYS  48           HZ3      LYS  48   7.595  17.699  10.514
 1120   2HZ   LYS  48           HZ2      LYS  48   7.504  19.224  11.260
 1121   3HZ   LYS  48           HZ1      LYS  48   6.212  18.129  11.397
 1122    H    GLU  49           HN       GLU  49   6.672  13.502   6.594
 1123    HA   GLU  49           HA       GLU  49   6.196  13.422   9.493
 1124   1HB   GLU  49           HB2      GLU  49   5.580  11.693   7.171
 1125   2HB   GLU  49           HB1      GLU  49   5.961  10.825   8.659
 1126   1HG   GLU  49           HG2      GLU  49   3.937  13.075   8.477
 1127   2HG   GLU  49           HG1      GLU  49   3.525  11.359   8.441
 1128    H    GLN  50           HN       GLN  50   8.605  13.971   9.778
 1129    HA   GLN  50           HA       GLN  50  10.733  12.284   9.153
 1130   1HB   GLN  50           HB2      GLN  50  11.168  14.352  10.293
 1131   2HB   GLN  50           HB1      GLN  50  10.187  13.868  11.675
 1132   1HG   GLN  50           HG2      GLN  50  11.773  12.058  12.188
 1133   2HG   GLN  50           HG1      GLN  50  12.748  12.504  10.787
 1134   1HE2  GLN  50          HE22      GLN  50  14.433  14.268  13.504
 1135   2HE2  GLN  50          HE21      GLN  50  14.330  12.707  12.846
 1136    H    GLU  51           HN       GLU  51   8.085  11.676  11.322
 1137    HA   GLU  51           HA       GLU  51   9.458   9.524  12.751
 1138   1HB   GLU  51           HB2      GLU  51   7.069  11.021  13.101
 1139   2HB   GLU  51           HB1      GLU  51   6.602   9.326  12.959
 1140   1HG   GLU  51           HG2      GLU  51   8.813   9.158  14.581
 1141   2HG   GLU  51           HG1      GLU  51   8.098  10.685  15.103
 1142    H    VAL  52           HN       VAL  52   7.009   9.705  10.153
 1143    HA   VAL  52           HA       VAL  52   6.707   6.836   9.978
 1144    HB   VAL  52           HB       VAL  52   6.048   9.076   8.048
 1145   1HG1  VAL  52          HG12      VAL  52   5.892   6.110   7.755
 1146   2HG1  VAL  52          HG11      VAL  52   4.533   7.062   7.156
 1147   3HG1  VAL  52          HG13      VAL  52   6.156   7.348   6.527
 1148   1HG2  VAL  52          HG21      VAL  52   4.807   8.038  10.388
 1149   2HG2  VAL  52          HG23      VAL  52   4.168   9.247   9.273
 1150   3HG2  VAL  52          HG22      VAL  52   3.826   7.537   9.011
 1151    H    VAL  53           HN       VAL  53   8.716   9.183   8.224
 1152    HA   VAL  53           HA       VAL  53   9.820   7.096   6.502
 1153    HB   VAL  53           HB       VAL  53  10.810   9.927   6.948
 1154   1HG1  VAL  53          HG11      VAL  53  12.324   8.193   5.826
 1155   2HG1  VAL  53          HG13      VAL  53  11.136   8.147   4.524
 1156   3HG1  VAL  53          HG12      VAL  53  11.985   9.648   4.888
 1157   1HG2  VAL  53          HG21      VAL  53   8.589   8.768   5.310
 1158   2HG2  VAL  53          HG23      VAL  53   8.673  10.323   6.138
 1159   3HG2  VAL  53          HG22      VAL  53   9.531  10.087   4.615
 1160    H    ASP  54           HN       ASP  54  10.681   8.632   9.540
 1161    HA   ASP  54           HA       ASP  54  13.402   7.533   9.493
 1162   1HB   ASP  54           HB2      ASP  54  12.794   9.654  10.716
 1163   2HB   ASP  54           HB1      ASP  54  11.872   8.669  11.853
 1164    H    LYS  55           HN       LYS  55  10.231   6.510  10.459
 1165    HA   LYS  55           HA       LYS  55  11.147   4.495  12.346
 1166   1HB   LYS  55           HB2      LYS  55   8.857   5.402  12.460
 1167   2HB   LYS  55           HB1      LYS  55   8.519   4.761  10.851
 1168   1HG   LYS  55           HG2      LYS  55   9.561   2.851  12.891
 1169   2HG   LYS  55           HG1      LYS  55   7.894   3.399  13.071
 1170   1HD   LYS  55           HD2      LYS  55   7.556   2.798  10.622
 1171   2HD   LYS  55           HD1      LYS  55   9.131   2.005  10.688
 1172   1HE   LYS  55           HE2      LYS  55   8.032   0.177  11.432
 1173   2HE   LYS  55           HE1      LYS  55   7.835   1.049  12.953
 1174   1HZ   LYS  55           HZ3      LYS  55   5.950   1.528  10.750
 1175   2HZ   LYS  55           HZ2      LYS  55   5.770   0.144  11.715
 1176   3HZ   LYS  55           HZ1      LYS  55   5.710   1.688  12.420
 1177    H    VAL  56           HN       VAL  56  10.120   4.464   8.922
 1178    HA   VAL  56           HA       VAL  56  10.744   1.608   8.699
 1179    HB   VAL  56           HB       VAL  56  10.464   2.188   6.180
 1180   1HG1  VAL  56          HG11      VAL  56   8.692   1.494   8.190
 1181   2HG1  VAL  56          HG13      VAL  56   7.910   2.883   7.433
 1182   3HG1  VAL  56          HG12      VAL  56   8.337   1.473   6.463
 1183   1HG2  VAL  56          HG21      VAL  56  10.577   4.773   7.155
 1184   2HG2  VAL  56          HG23      VAL  56   9.950   4.307   5.576
 1185   3HG2  VAL  56          HG22      VAL  56   8.847   4.515   6.935
 1186    H    MET  57           HN       MET  57  12.248   4.682   7.934
 1187    HA   MET  57           HA       MET  57  14.495   3.552   6.494
 1188   1HB   MET  57           HB2      MET  57  13.649   5.974   6.406
 1189   2HB   MET  57           HB1      MET  57  14.448   6.195   7.966
 1190   1HG   MET  57           HG2      MET  57  16.410   6.486   6.914
 1191   2HG   MET  57           HG1      MET  57  16.280   4.866   6.231
 1192   1HE   MET  57           HE1      MET  57  14.074   4.623   4.894
 1193   2HE   MET  57           HE3      MET  57  13.259   5.968   4.082
 1194   3HE   MET  57           HE2      MET  57  14.434   4.987   3.209
 1195    H    GLU  58           HN       GLU  58  13.679   4.057   9.850
 1196    HA   GLU  58           HA       GLU  58  16.421   3.853  10.827
 1197   1HB   GLU  58           HB2      GLU  58  13.693   3.801  12.074
 1198   2HB   GLU  58           HB1      GLU  58  15.048   3.158  13.001
 1199   1HG   GLU  58           HG2      GLU  58  15.697   5.695  11.704
 1200   2HG   GLU  58           HG1      GLU  58  14.339   5.838  12.818
 1201    H    THR  59           HN       THR  59  13.655   1.570  10.739
 1202    HA   THR  59           HA       THR  59  15.203  -0.674  11.664
 1203    HB   THR  59           HB       THR  59  12.815  -0.895   9.826
 1204    HG1  THR  59           HG1      THR  59  11.555  -0.179  11.359
 1205   1HG2  THR  59          HG21      THR  59  14.281  -2.846  10.870
 1206   2HG2  THR  59          HG23      THR  59  13.297  -2.514  12.295
 1207   3HG2  THR  59          HG22      THR  59  12.525  -2.983  10.780
 1208    H    LEU  60           HN       LEU  60  14.840   0.917   8.618
 1209    HA   LEU  60           HA       LEU  60  15.758  -1.222   6.911
 1210   1HB   LEU  60           HB2      LEU  60  15.332   1.721   6.702
 1211   2HB   LEU  60           HB1      LEU  60  16.418   0.988   5.524
 1212    HG   LEU  60           HG       LEU  60  13.578   0.108   6.109
 1213   1HD1  LEU  60          HD12      LEU  60  14.837   1.903   4.102
 1214   2HD1  LEU  60          HD11      LEU  60  13.623   0.778   3.493
 1215   3HD1  LEU  60          HD13      LEU  60  13.203   1.927   4.763
 1216   1HD2  LEU  60          HD22      LEU  60  15.846  -1.171   4.762
 1217   2HD2  LEU  60          HD21      LEU  60  14.307  -1.867   5.270
 1218   3HD2  LEU  60          HD23      LEU  60  14.428  -1.031   3.720
 1219    H    ASP  61           HN       ASP  61  17.393   1.670   8.220
 1220    HA   ASP  61           HA       ASP  61  20.016   0.766   7.344
 1221   1HB   ASP  61           HB2      ASP  61  18.896   3.182   8.212
 1222   2HB   ASP  61           HB1      ASP  61  20.046   2.748   9.478
 1223    H    GLU  62           HN       GLU  62  18.009  -0.015   9.970
 1224    HA   GLU  62           HA       GLU  62  20.060  -0.444  11.970
 1225   1HB   GLU  62           HB2      GLU  62  17.574  -0.171  12.417
 1226   2HB   GLU  62           HB1      GLU  62  17.367  -1.813  11.808
 1227   1HG   GLU  62           HG2      GLU  62  18.894  -2.672  13.522
 1228   2HG   GLU  62           HG1      GLU  62  19.180  -1.034  14.111
 1229    H    ASP  63           HN       ASP  63  18.557  -2.453   9.478
 1230    HA   ASP  63           HA       ASP  63  20.813  -4.329   9.654
 1231   1HB   ASP  63           HB2      ASP  63  17.979  -5.163  10.332
 1232   2HB   ASP  63           HB1      ASP  63  19.261  -6.306   9.925
 1233    H    GLY  64           HN       GLY  64  20.371  -2.794   7.519
 1234   1HA   GLY  64           HA2      GLY  64  18.549  -3.333   5.538
 1235   2HA   GLY  64           HA1      GLY  64  20.256  -3.083   5.173
 1236    H    ASP  65           HN       ASP  65  21.001  -5.541   6.733
 1237    HA   ASP  65           HA       ASP  65  20.462  -7.461   4.547
 1238   1HB   ASP  65           HB2      ASP  65  22.771  -6.984   5.710
 1239   2HB   ASP  65           HB1      ASP  65  22.157  -8.076   6.953
 1240    H    GLY  66           HN       GLY  66  18.217  -6.853   6.186
 1241   1HA   GLY  66           HA2      GLY  66  17.943  -9.304   7.851
 1242   2HA   GLY  66           HA1      GLY  66  16.967  -7.850   8.054
 1243    H    GLU  67           HN       GLU  67  15.567 -10.153   7.815
 1244    HA   GLU  67           HA       GLU  67  14.742 -10.305   4.949
 1245   1HB   GLU  67           HB2      GLU  67  14.522 -12.211   7.272
 1246   2HB   GLU  67           HB1      GLU  67  13.459 -12.377   5.874
 1247   1HG   GLU  67           HG2      GLU  67  15.326 -12.645   4.381
 1248   2HG   GLU  67           HG1      GLU  67  16.473 -12.208   5.649
 1249    H    CYS  68           HN       CYS  68  12.803  -9.429   4.381
 1250    HA   CYS  68           HA       CYS  68  10.984  -8.553   6.584
 1251   1HB   CYS  68           HB2      CYS  68  11.268  -7.611   3.717
 1252   2HB   CYS  68           HB1      CYS  68  10.017  -7.041   4.822
 1253    HG   CYS  68           HG       CYS  68  11.768  -5.831   6.217
 1254    H    ASP  69           HN       ASP  69   8.577  -8.555   5.846
 1255    HA   ASP  69           HA       ASP  69   8.050 -11.200   4.550
 1256   1HB   ASP  69           HB2      ASP  69   6.285  -9.582   6.418
 1257   2HB   ASP  69           HB1      ASP  69   5.925 -11.188   5.787
 1258    H    PHE  70           HN       PHE  70   5.550 -11.058   3.672
 1259    HA   PHE  70           HA       PHE  70   5.711  -9.101   1.504
 1260   1HB   PHE  70           HB2      PHE  70   3.388 -10.131   0.950
 1261   2HB   PHE  70           HB1      PHE  70   4.817 -11.146   0.774
 1262    HD1  PHE  70           HD2      PHE  70   1.877 -10.403   2.889
 1263    HD2  PHE  70           HD1      PHE  70   5.237 -13.005   2.260
 1264    HE1  PHE  70           HE2      PHE  70   0.921 -12.027   4.500
 1265    HE2  PHE  70           HE1      PHE  70   4.282 -14.630   3.869
 1266    HZ   PHE  70           HZ       PHE  70   2.124 -14.141   4.989
 1267    H    GLN  71           HN       GLN  71   3.820  -9.539   4.458
 1268    HA   GLN  71           HA       GLN  71   2.049  -7.283   3.864
 1269   1HB   GLN  71           HB2      GLN  71   2.571  -8.869   6.400
 1270   2HB   GLN  71           HB1      GLN  71   1.381  -7.572   6.287
 1271   1HG   GLN  71           HG2      GLN  71   0.729  -9.074   4.099
 1272   2HG   GLN  71           HG1      GLN  71   1.274 -10.323   5.217
 1273   1HE2  GLN  71          HE22      GLN  71  -1.776  -7.958   6.648
 1274   2HE2  GLN  71          HE21      GLN  71  -0.459  -7.228   5.865
 1275    H    GLU  72           HN       GLU  72   5.134  -7.781   5.423
 1276    HA   GLU  72           HA       GLU  72   5.117  -5.202   6.791
 1277   1HB   GLU  72           HB2      GLU  72   7.025  -7.459   6.429
 1278   2HB   GLU  72           HB1      GLU  72   7.742  -5.874   6.716
 1279   1HG   GLU  72           HG2      GLU  72   5.520  -6.203   8.498
 1280   2HG   GLU  72           HG1      GLU  72   6.558  -7.626   8.624
 1281    H    PHE  73           HN       PHE  73   6.808  -6.528   3.930
 1282    HA   PHE  73           HA       PHE  73   8.012  -4.058   3.144
 1283   1HB   PHE  73           HB2      PHE  73   8.891  -5.988   2.100
 1284   2HB   PHE  73           HB1      PHE  73   7.293  -6.598   1.680
 1285    HD1  PHE  73           HD2      PHE  73   5.986  -5.538  -0.163
 1286    HD2  PHE  73           HD1      PHE  73  10.028  -4.389   0.714
 1287    HE1  PHE  73           HE2      PHE  73   6.150  -4.428  -2.376
 1288    HE2  PHE  73           HE1      PHE  73  10.192  -3.277  -1.496
 1289    HZ   PHE  73           HZ       PHE  73   8.252  -3.296  -3.042
 1290    H    MET  74           HN       MET  74   4.774  -5.256   2.902
 1291    HA   MET  74           HA       MET  74   3.966  -3.439   0.754
 1292   1HB   MET  74           HB2      MET  74   2.851  -5.678   2.136
 1293   2HB   MET  74           HB1      MET  74   1.730  -4.331   2.298
 1294   1HG   MET  74           HG2      MET  74   2.929  -4.751  -0.393
 1295   2HG   MET  74           HG1      MET  74   1.743  -5.942   0.139
 1296   1HE   MET  74           HE2      MET  74   2.517  -3.284  -1.662
 1297   2HE   MET  74           HE1      MET  74   1.052  -2.377  -2.035
 1298   3HE   MET  74           HE3      MET  74   2.095  -1.870  -0.699
 1299    H    ALA  75           HN       ALA  75   3.182  -3.657   4.243
 1300    HA   ALA  75           HA       ALA  75   1.903  -1.085   4.311
 1301   1HB   ALA  75           HB1      ALA  75   1.677  -2.973   6.021
 1302   2HB   ALA  75           HB3      ALA  75   3.235  -2.451   6.662
 1303   3HB   ALA  75           HB2      ALA  75   1.857  -1.350   6.688
 1304    H    PHE  76           HN       PHE  76   5.195  -2.030   4.180
 1305    HA   PHE  76           HA       PHE  76   6.289   0.328   5.508
 1306   1HB   PHE  76           HB2      PHE  76   7.302  -2.124   4.435
 1307   2HB   PHE  76           HB1      PHE  76   8.154  -0.798   3.651
 1308    HD1  PHE  76           HD2      PHE  76   6.811  -1.445   7.104
 1309    HD2  PHE  76           HD1      PHE  76  10.159  -0.259   4.687
 1310    HE1  PHE  76           HE2      PHE  76   8.169  -1.106   9.151
 1311    HE2  PHE  76           HE1      PHE  76  11.515   0.080   6.735
 1312    HZ   PHE  76           HZ       PHE  76  10.521  -0.344   8.966
 1313    H    VAL  77           HN       VAL  77   5.633  -0.668   2.167
 1314    HA   VAL  77           HA       VAL  77   6.819   1.670   0.949
 1315    HB   VAL  77           HB       VAL  77   4.746  -0.299  -0.065
 1316   1HG1  VAL  77          HG13      VAL  77   5.325   2.209  -1.116
 1317   2HG1  VAL  77          HG12      VAL  77   6.373   1.131  -2.037
 1318   3HG1  VAL  77          HG11      VAL  77   4.630   0.858  -2.009
 1319   1HG2  VAL  77          HG21      VAL  77   7.660  -0.307   0.217
 1320   2HG2  VAL  77          HG23      VAL  77   6.567  -1.645  -0.132
 1321   3HG2  VAL  77          HG22      VAL  77   7.143  -0.614  -1.440
 1322    H    SER  78           HN       SER  78   3.676   0.967   2.333
 1323    HA   SER  78           HA       SER  78   2.361   3.250   1.087
 1324   1HB   SER  78           HB2      SER  78   0.478   2.691   2.480
 1325   2HB   SER  78           HB1      SER  78   1.183   1.179   1.917
 1326    HG   SER  78           HG       SER  78   1.246   0.742   3.976
 1327    H    MET  79           HN       MET  79   3.778   2.639   4.318
 1328    HA   MET  79           HA       MET  79   3.005   5.079   5.521
 1329   1HB   MET  79           HB2      MET  79   5.697   3.813   6.012
 1330   2HB   MET  79           HB1      MET  79   4.641   4.636   7.157
 1331   1HG   MET  79           HG2      MET  79   3.148   2.484   6.069
 1332   2HG   MET  79           HG1      MET  79   4.735   1.845   6.504
 1333   1HE   MET  79           HE3      MET  79   4.347   0.405   8.234
 1334   2HE   MET  79           HE2      MET  79   5.571   1.461   8.931
 1335   3HE   MET  79           HE1      MET  79   4.224   0.915   9.925
 1336    H    VAL  80           HN       VAL  80   5.947   4.333   3.628
 1337    HA   VAL  80           HA       VAL  80   7.012   6.992   3.863
 1338    HB   VAL  80           HB       VAL  80   8.510   6.265   2.001
 1339   1HG1  VAL  80          HG11      VAL  80   8.647   5.619   4.572
 1340   2HG1  VAL  80          HG13      VAL  80   8.380   3.992   3.945
 1341   3HG1  VAL  80          HG12      VAL  80   9.777   4.923   3.409
 1342   1HG2  VAL  80          HG22      VAL  80   6.863   3.726   2.160
 1343   2HG2  VAL  80          HG21      VAL  80   6.895   4.846   0.799
 1344   3HG2  VAL  80          HG23      VAL  80   8.340   3.929   1.221
 1345    H    THR  81           HN       THR  81   5.170   5.369   1.249
 1346    HA   THR  81           HA       THR  81   5.227   7.654  -0.501
 1347    HB   THR  81           HB       THR  81   2.948   5.692  -0.501
 1348    HG1  THR  81           HG1      THR  81   5.669   5.215  -0.944
 1349   1HG2  THR  81          HG21      THR  81   3.370   7.682  -2.148
 1350   2HG2  THR  81          HG23      THR  81   4.592   6.616  -2.842
 1351   3HG2  THR  81          HG22      THR  81   2.903   6.114  -2.800
 1352    H    THR  82           HN       THR  82   3.680   7.192   2.454
 1353    HA   THR  82           HA       THR  82   1.810   9.438   1.833
 1354    HB   THR  82           HB       THR  82   0.201   8.421   3.440
 1355    HG1  THR  82           HG1      THR  82   2.019   7.141   4.398
 1356   1HG2  THR  82          HG23      THR  82   1.008   7.253   0.860
 1357   2HG2  THR  82          HG22      THR  82   0.038   6.180   1.869
 1358   3HG2  THR  82          HG21      THR  82  -0.586   7.768   1.415
 1359    H    ALA  83           HN       ALA  83   4.565   8.879   3.277
 1360    HA   ALA  83           HA       ALA  83   4.441   9.339   6.007
 1361   1HB   ALA  83           HB1      ALA  83   6.483   9.296   4.310
 1362   2HB   ALA  83           HB3      ALA  83   6.317  11.049   4.415
 1363   3HB   ALA  83           HB2      ALA  83   6.629  10.104   5.871
 1364    H    CYS  84           HN       CYS  84   4.678  12.023   3.631
 1365    HA   CYS  84           HA       CYS  84   2.507  13.558   4.354
 1366   1HB   CYS  84           HB2      CYS  84   4.446  13.440   6.543
 1367   2HB   CYS  84           HB1      CYS  84   4.085  15.091   6.044
 1368    HG   CYS  84           HG       CYS  84   2.310  13.788   7.820
 1369    H    HIS  85           HN       HIS  85   3.350  16.137   4.498
 1370    HA   HIS  85           HA       HIS  85   4.334  17.866   3.264
 1371   1HB   HIS  85           HB2      HIS  85   6.414  15.997   3.684
 1372   2HB   HIS  85           HB1      HIS  85   6.499  16.446   1.982
 1373    HD1  HIS  85           HD1      HIS  85   5.254  19.386   2.599
 1374    HD2  HIS  85           HD2      HIS  85   8.654  17.684   4.313
 1375    HE1  HIS  85           HE1      HIS  85   6.682  21.310   3.417
 1376    H    GLU  86           HN       GLU  86   5.438  15.278   1.078
 1377    HA   GLU  86           HA       GLU  86   4.156  16.538  -1.180
 1378   1HB   GLU  86           HB2      GLU  86   6.030  14.442  -0.763
 1379   2HB   GLU  86           HB1      GLU  86   4.685  13.747  -1.668
 1380   1HG   GLU  86           HG2      GLU  86   6.261  14.651  -3.266
 1381   2HG   GLU  86           HG1      GLU  86   4.840  15.698  -3.255
 1382    H    PHE  87           HN       PHE  87   1.931  16.707  -0.484
 1383    HA   PHE  87           HA       PHE  87   0.480  14.094  -0.411
 1384   1HB   PHE  87           HB2      PHE  87   0.386  15.614   1.644
 1385   2HB   PHE  87           HB1      PHE  87  -0.535  16.742   0.650
 1386    HD1  PHE  87           HD2      PHE  87  -0.582  13.001   0.734
 1387    HD2  PHE  87           HD1      PHE  87  -2.748  16.647   1.430
 1388    HE1  PHE  87           HE2      PHE  87  -2.644  11.695   1.165
 1389    HE2  PHE  87           HE1      PHE  87  -4.811  15.341   1.864
 1390    HZ   PHE  87           HZ       PHE  87  -4.758  12.865   1.732
 1391    H    PHE  88           HN       PHE  88  -0.098  13.820  -2.553
 1392    HA   PHE  88           HA       PHE  88  -0.982  14.347  -4.675
 1393   1HB   PHE  88           HB2      PHE  88  -3.039  15.827  -3.036
 1394   2HB   PHE  88           HB1      PHE  88  -3.285  14.934  -4.537
 1395    HD1  PHE  88           HD2      PHE  88  -1.456  12.568  -3.744
 1396    HD2  PHE  88           HD1      PHE  88  -4.652  14.596  -1.709
 1397    HE1  PHE  88           HE2      PHE  88  -1.916  10.517  -2.427
 1398    HE2  PHE  88           HE1      PHE  88  -5.112  12.544  -0.391
 1399    HZ   PHE  88           HZ       PHE  88  -3.744  10.505  -0.751
 1400    H    GLU  89           HN       GLU  89   0.987  15.931  -4.768
 1401    HA   GLU  89           HA       GLU  89   0.080  18.766  -4.792
 1402   1HB   GLU  89           HB2      GLU  89   2.303  17.825  -3.708
 1403   2HB   GLU  89           HB1      GLU  89   2.902  17.929  -5.363
 1404   1HG   GLU  89           HG2      GLU  89   3.423  20.057  -4.587
 1405   2HG   GLU  89           HG1      GLU  89   1.820  20.343  -5.267
 1406    H    HIS  90           HN       HIS  90  -0.732  16.814  -6.869
 1407    HA   HIS  90           HA       HIS  90  -0.956  16.789  -9.205
 1408   1HB   HIS  90           HB2      HIS  90  -1.469  19.117  -9.093
 1409   2HB   HIS  90           HB1      HIS  90   0.205  19.544  -8.751
 1410    HD1  HIS  90           HD1      HIS  90  -1.358  17.438 -11.532
 1411    HD2  HIS  90           HD2      HIS  90   1.188  20.700 -11.048
 1412    HE1  HIS  90           HE1      HIS  90  -0.601  18.107 -13.855
 1413    H    GLU  91           HN       GLU  91   1.795  16.268  -7.672
 1414    HA   GLU  91           HA       GLU  91   3.256  15.716 -10.200
 1415   1HB   GLU  91           HB2      GLU  91   4.083  17.580  -8.063
 1416   2HB   GLU  91           HB1      GLU  91   5.321  16.417  -8.542
 1417   1HG   GLU  91           HG2      GLU  91   3.764  17.893 -10.650
 1418   2HG   GLU  91           HG1      GLU  91   5.124  18.681  -9.849
   
  No H/Q in entry =        1418
  Start of MODEL    5
    1   1H    MET   0           HT2      MET   0   6.660   4.408 -13.135
    2   2H    MET   0           HT1      MET   0   7.328   5.926 -13.509
    3   3H    MET   0           HT3      MET   0   5.955   5.378 -14.338
    4    HA   MET   0           HA       MET   0   7.227   4.466 -15.882
    5   1HB   MET   0           HB2      MET   0   9.549   5.196 -14.072
    6   2HB   MET   0           HB1      MET   0   9.670   4.771 -15.779
    7   1HG   MET   0           HG2      MET   0   7.707   6.889 -15.262
    8   2HG   MET   0           HG1      MET   0   9.347   7.339 -14.791
    9   1HE   MET   0           HE1      MET   0   7.923   8.903 -16.607
   10   2HE   MET   0           HE3      MET   0   9.636   9.273 -16.845
   11   3HE   MET   0           HE2      MET   0   8.593   8.991 -18.235
   12    H    SER   1           HN       SER   1   8.758   3.560 -12.765
   13    HA   SER   1           HA       SER   1   9.255   0.844 -13.725
   14   1HB   SER   1           HB2      SER   1   9.833   0.518 -11.216
   15   2HB   SER   1           HB1      SER   1  10.859   1.589 -12.167
   16    HG   SER   1           HG       SER   1  10.366   2.871 -10.528
   17    H    GLU   2           HN       GLU   2   8.517  -0.910 -11.886
   18    HA   GLU   2           HA       GLU   2   5.653  -1.109 -12.190
   19   1HB   GLU   2           HB2      GLU   2   7.353  -2.679 -10.241
   20   2HB   GLU   2           HB1      GLU   2   5.835  -3.175 -10.989
   21   1HG   GLU   2           HG2      GLU   2   8.521  -2.808 -12.338
   22   2HG   GLU   2           HG1      GLU   2   7.588  -4.297 -12.186
   23    H    LEU   3           HN       LEU   3   7.777  -0.203  -9.499
   24    HA   LEU   3           HA       LEU   3   5.545   0.074  -7.628
   25   1HB   LEU   3           HB2      LEU   3   8.062  -0.430  -7.121
   26   2HB   LEU   3           HB1      LEU   3   8.253   1.319  -7.227
   27    HG   LEU   3           HG       LEU   3   6.219   1.416  -5.609
   28   1HD1  LEU   3          HD13      LEU   3   6.766  -1.453  -5.798
   29   2HD1  LEU   3          HD12      LEU   3   6.782  -0.869  -4.134
   30   3HD1  LEU   3          HD11      LEU   3   5.357  -0.620  -5.140
   31   1HD2  LEU   3          HD22      LEU   3   9.065   1.125  -5.211
   32   2HD2  LEU   3          HD21      LEU   3   7.916   2.103  -4.295
   33   3HD2  LEU   3          HD23      LEU   3   8.199   0.420  -3.846
   34    H    GLU   4           HN       GLU   4   7.757   2.360  -9.268
   35    HA   GLU   4           HA       GLU   4   6.555   4.729  -8.284
   36   1HB   GLU   4           HB2      GLU   4   8.699   4.689  -9.532
   37   2HB   GLU   4           HB1      GLU   4   7.820   4.300 -11.011
   38   1HG   GLU   4           HG2      GLU   4   6.459   6.425 -10.593
   39   2HG   GLU   4           HG1      GLU   4   7.664   6.837  -9.373
   40    H    LYS   5           HN       LYS   5   5.712   2.794 -11.169
   41    HA   LYS   5           HA       LYS   5   3.568   4.636 -11.898
   42   1HB   LYS   5           HB2      LYS   5   4.941   2.901 -13.371
   43   2HB   LYS   5           HB1      LYS   5   3.642   1.809 -12.886
   44   1HG   LYS   5           HG2      LYS   5   2.533   2.702 -14.659
   45   2HG   LYS   5           HG1      LYS   5   2.229   4.053 -13.564
   46   1HD   LYS   5           HD2      LYS   5   3.881   5.381 -14.520
   47   2HD   LYS   5           HD1      LYS   5   4.798   3.993 -15.110
   48   1HE   LYS   5           HE2      LYS   5   2.987   3.531 -16.754
   49   2HE   LYS   5           HE1      LYS   5   2.147   4.980 -16.203
   50   1HZ   LYS   5           HZ3      LYS   5   4.897   4.934 -17.324
   51   2HZ   LYS   5           HZ2      LYS   5   3.502   5.372 -18.188
   52   3HZ   LYS   5           HZ1      LYS   5   4.018   6.314 -16.872
   53    H    ALA   6           HN       ALA   6   3.797   1.515 -10.218
   54    HA   ALA   6           HA       ALA   6   0.893   1.294  -9.921
   55   1HB   ALA   6           HB3      ALA   6   2.359  -0.711 -10.024
   56   2HB   ALA   6           HB2      ALA   6   3.116  -0.214  -8.511
   57   3HB   ALA   6           HB1      ALA   6   1.411  -0.665  -8.537
   58    H    MET   7           HN       MET   7   3.410   1.345  -7.400
   59    HA   MET   7           HA       MET   7   1.934   2.022  -5.192
   60   1HB   MET   7           HB2      MET   7   4.386   1.702  -5.153
   61   2HB   MET   7           HB1      MET   7   4.604   3.261  -5.958
   62   1HG   MET   7           HG2      MET   7   4.906   3.733  -3.653
   63   2HG   MET   7           HG1      MET   7   3.259   4.259  -4.000
   64   1HE   MET   7           HE1      MET   7   1.184   2.857  -3.661
   65   2HE   MET   7           HE3      MET   7   0.977   2.225  -2.022
   66   3HE   MET   7           HE2      MET   7   1.555   3.872  -2.270
   67    H    VAL   8           HN       VAL   8   3.228   4.354  -7.551
   68    HA   VAL   8           HA       VAL   8   1.990   6.629  -6.269
   69    HB   VAL   8           HB       VAL   8   2.882   6.395  -9.155
   70   1HG1  VAL   8          HG12      VAL   8   2.215   8.630  -7.264
   71   2HG1  VAL   8          HG11      VAL   8   3.435   8.895  -8.513
   72   3HG1  VAL   8          HG13      VAL   8   1.791   8.446  -8.966
   73   1HG2  VAL   8          HG22      VAL   8   4.663   5.667  -7.590
   74   2HG2  VAL   8          HG21      VAL   8   5.063   7.214  -8.338
   75   3HG2  VAL   8          HG23      VAL   8   4.465   7.166  -6.680
   76    H    ALA   9           HN       ALA   9   1.014   4.492  -8.943
   77    HA   ALA   9           HA       ALA   9  -1.224   5.934  -9.870
   78   1HB   ALA   9           HB1      ALA   9  -0.848   2.939  -9.562
   79   2HB   ALA   9           HB3      ALA   9  -2.191   3.676 -10.437
   80   3HB   ALA   9           HB2      ALA   9  -0.536   3.906 -11.003
   81    H    LEU  10           HN       LEU  10  -0.989   3.679  -7.120
   82    HA   LEU  10           HA       LEU  10  -3.696   3.699  -6.317
   83   1HB   LEU  10           HB2      LEU  10  -1.283   2.738  -5.273
   84   2HB   LEU  10           HB1      LEU  10  -1.871   3.864  -4.049
   85    HG   LEU  10           HG       LEU  10  -3.769   1.894  -5.281
   86   1HD1  LEU  10          HD11      LEU  10  -1.407   1.113  -3.966
   87   2HD1  LEU  10          HD13      LEU  10  -2.690   0.960  -2.763
   88   3HD1  LEU  10          HD12      LEU  10  -2.816   0.108  -4.301
   89   1HD2  LEU  10          HD21      LEU  10  -3.715   3.805  -3.084
   90   2HD2  LEU  10          HD23      LEU  10  -5.096   2.988  -3.811
   91   3HD2  LEU  10          HD22      LEU  10  -4.182   2.199  -2.525
   92    H    ILE  11           HN       ILE  11  -1.043   5.859  -5.256
   93    HA   ILE  11           HA       ILE  11  -2.518   7.602  -3.630
   94    HB   ILE  11           HB       ILE  11  -0.280   8.256  -5.578
   95   1HG1  ILE  11          HG12      ILE  11   0.346   6.610  -3.879
   96   2HG1  ILE  11          HG11      ILE  11   1.104   8.160  -3.505
   97   1HG2  ILE  11          HG22      ILE  11  -1.950  10.067  -4.327
   98   2HG2  ILE  11          HG21      ILE  11  -0.612   9.932  -3.188
   99   3HG2  ILE  11          HG23      ILE  11  -0.301  10.405  -4.858
  100   1HD1  ILE  11          HD11      ILE  11  -1.376   8.303  -2.238
  101   2HD1  ILE  11          HD13      ILE  11  -0.850   6.643  -1.960
  102   3HD1  ILE  11          HD12      ILE  11   0.173   7.989  -1.456
  103    H    ASP  12           HN       ASP  12  -2.354   7.395  -7.139
  104    HA   ASP  12           HA       ASP  12  -3.701   9.832  -7.768
  105   1HB   ASP  12           HB2      ASP  12  -2.512   7.976  -9.272
  106   2HB   ASP  12           HB1      ASP  12  -4.164   7.380  -9.422
  107    H    VAL  13           HN       VAL  13  -4.950   6.527  -7.202
  108    HA   VAL  13           HA       VAL  13  -7.657   6.915  -7.730
  109    HB   VAL  13           HB       VAL  13  -6.375   5.371  -5.459
  110   1HG1  VAL  13          HG11      VAL  13  -8.762   5.997  -4.986
  111   2HG1  VAL  13          HG13      VAL  13  -9.223   5.189  -6.484
  112   3HG1  VAL  13          HG12      VAL  13  -8.518   4.258  -5.163
  113   1HG2  VAL  13          HG21      VAL  13  -6.551   4.946  -8.253
  114   2HG2  VAL  13          HG23      VAL  13  -6.003   3.799  -7.032
  115   3HG2  VAL  13          HG22      VAL  13  -7.700   3.832  -7.510
  116    H    PHE  14           HN       PHE  14  -5.823   7.983  -4.886
  117    HA   PHE  14           HA       PHE  14  -8.064   8.889  -3.354
  118   1HB   PHE  14           HB2      PHE  14  -5.405   8.756  -2.852
  119   2HB   PHE  14           HB1      PHE  14  -5.555  10.478  -3.203
  120    HD1  PHE  14           HD2      PHE  14  -7.076  11.911  -1.868
  121    HD2  PHE  14           HD1      PHE  14  -6.422   7.780  -0.888
  122    HE1  PHE  14           HE2      PHE  14  -8.063  12.288   0.376
  123    HE2  PHE  14           HE1      PHE  14  -7.409   8.156   1.355
  124    HZ   PHE  14           HZ       PHE  14  -8.231  10.410   1.988
  125    H    HIS  15           HN       HIS  15  -5.989  10.583  -5.719
  126    HA   HIS  15           HA       HIS  15  -7.388  13.095  -5.506
  127   1HB   HIS  15           HB2      HIS  15  -5.129  12.966  -6.456
  128   2HB   HIS  15           HB1      HIS  15  -5.724  11.960  -7.777
  129    HD1  HIS  15           HD1      HIS  15  -7.264  15.136  -6.336
  130    HD2  HIS  15           HD2      HIS  15  -5.689  13.712  -9.925
  131    HE1  HIS  15           HE1      HIS  15  -7.651  16.954  -8.057
  132    H    GLN  16           HN       GLN  16  -8.372  10.131  -6.741
  133    HA   GLN  16           HA       GLN  16 -10.085  11.286  -8.857
  134   1HB   GLN  16           HB2      GLN  16  -8.815   9.020  -8.986
  135   2HB   GLN  16           HB1      GLN  16 -10.109   8.409  -7.953
  136   1HG   GLN  16           HG2      GLN  16 -11.429   8.189  -9.755
  137   2HG   GLN  16           HG1      GLN  16 -11.325   9.930 -10.032
  138   1HE2  GLN  16          HE22      GLN  16  -9.431   9.459 -12.952
  139   2HE2  GLN  16          HE21      GLN  16 -10.564  10.390 -12.097
  140    H    TYR  17           HN       TYR  17 -10.598   9.167  -6.004
  141    HA   TYR  17           HA       TYR  17 -13.444   9.745  -5.939
  142   1HB   TYR  17           HB2      TYR  17 -11.576   8.419  -3.955
  143   2HB   TYR  17           HB1      TYR  17 -13.316   8.567  -3.701
  144    HD1  TYR  17           HD2      TYR  17 -10.796   7.313  -6.174
  145    HD2  TYR  17           HD1      TYR  17 -14.781   6.967  -4.601
  146    HE1  TYR  17           HE2      TYR  17 -11.172   5.294  -7.566
  147    HE2  TYR  17           HE1      TYR  17 -15.156   4.948  -5.993
  148    HH   TYR  17           HH       TYR  17 -14.334   3.662  -7.620
  149    H    SER  18           HN       SER  18 -10.847  10.474  -3.572
  150    HA   SER  18           HA       SER  18 -12.452  12.418  -2.172
  151   1HB   SER  18           HB2      SER  18 -10.326  11.126  -1.379
  152   2HB   SER  18           HB1      SER  18  -9.440  12.435  -2.155
  153    HG   SER  18           HG       SER  18 -11.051  13.783  -0.863
  154    H    GLY  19           HN       GLY  19 -10.965  12.545  -5.186
  155   1HA   GLY  19           HA2      GLY  19 -10.199  15.370  -5.089
  156   2HA   GLY  19           HA1      GLY  19 -10.199  14.346  -6.524
  157    H    ARG  20           HN       ARG  20 -13.127  13.997  -4.921
  158    HA   ARG  20           HA       ARG  20 -14.545  15.429  -7.020
  159   1HB   ARG  20           HB2      ARG  20 -15.565  14.103  -4.486
  160   2HB   ARG  20           HB1      ARG  20 -16.580  14.691  -5.803
  161   1HG   ARG  20           HG2      ARG  20 -14.491  13.014  -6.872
  162   2HG   ARG  20           HG1      ARG  20 -15.343  12.153  -5.590
  163   1HD   ARG  20           HD2      ARG  20 -17.473  12.507  -6.660
  164   2HD   ARG  20           HD1      ARG  20 -16.753  13.600  -7.844
  165    HE   ARG  20           HE       ARG  20 -15.411  11.495  -8.568
  166   1HH1  ARG  20          HH11      ARG  20 -17.549  10.379  -6.361
  167   2HH1  ARG  20          HH12      ARG  20 -18.465   9.370  -7.431
  168   1HH2  ARG  20          HH21      ARG  20 -17.021  10.662 -10.307
  169   2HH2  ARG  20          HH22      ARG  20 -18.167   9.532  -9.666
  170    H    GLU  21           HN       GLU  21 -15.898  15.811  -3.842
  171    HA   GLU  21           HA       GLU  21 -14.821  18.483  -3.402
  172   1HB   GLU  21           HB2      GLU  21 -17.062  19.604  -3.634
  173   2HB   GLU  21           HB1      GLU  21 -16.381  19.047  -5.164
  174   1HG   GLU  21           HG2      GLU  21 -18.036  17.531  -5.482
  175   2HG   GLU  21           HG1      GLU  21 -18.010  17.019  -3.795
  176    H    GLY  22           HN       GLY  22 -16.739  19.527  -1.739
  177   1HA   GLY  22           HA2      GLY  22 -17.704  19.301   0.393
  178   2HA   GLY  22           HA1      GLY  22 -17.928  17.587   0.035
  179    H    ASP  23           HN       ASP  23 -16.251  16.112   0.595
  180    HA   ASP  23           HA       ASP  23 -14.305  17.231   2.561
  181   1HB   ASP  23           HB2      ASP  23 -14.164  14.559   2.977
  182   2HB   ASP  23           HB1      ASP  23 -15.324  15.597   3.804
  183    H    LYS  24           HN       LYS  24 -12.561  17.765   1.246
  184    HA   LYS  24           HA       LYS  24 -11.525  15.657  -0.588
  185   1HB   LYS  24           HB2      LYS  24 -11.830  17.857  -1.607
  186   2HB   LYS  24           HB1      LYS  24 -10.852  18.606  -0.345
  187   1HG   LYS  24           HG2      LYS  24  -8.876  17.828  -1.220
  188   2HG   LYS  24           HG1      LYS  24  -9.612  16.347  -1.836
  189   1HD   LYS  24           HD2      LYS  24 -10.783  17.750  -3.575
  190   2HD   LYS  24           HD1      LYS  24  -9.820  19.124  -3.032
  191   1HE   LYS  24           HE2      LYS  24  -8.544  16.518  -3.880
  192   2HE   LYS  24           HE1      LYS  24  -8.899  17.803  -5.034
  193   1HZ   LYS  24           HZ2      LYS  24  -7.651  19.300  -3.427
  194   2HZ   LYS  24           HZ1      LYS  24  -7.066  17.872  -2.719
  195   3HZ   LYS  24           HZ3      LYS  24  -6.726  18.210  -4.345
  196    H    HIS  25           HN       HIS  25  -9.272  15.076  -0.476
  197    HA   HIS  25           HA       HIS  25  -7.212  14.694   0.594
  198   1HB   HIS  25           HB2      HIS  25  -7.406  17.222   1.094
  199   2HB   HIS  25           HB1      HIS  25  -7.994  16.730   2.683
  200    HD1  HIS  25           HD1      HIS  25  -5.743  17.776   3.675
  201    HD2  HIS  25           HD2      HIS  25  -5.219  14.449   1.215
  202    HE1  HIS  25           HE1      HIS  25  -3.383  16.949   4.078
  203    H    LYS  26           HN       LYS  26 -10.197  14.002   1.687
  204    HA   LYS  26           HA       LYS  26  -9.098  12.326   3.886
  205   1HB   LYS  26           HB2      LYS  26 -10.915  12.870   5.367
  206   2HB   LYS  26           HB1      LYS  26 -10.236  14.400   4.811
  207   1HG   LYS  26           HG2      LYS  26 -12.016  14.739   3.258
  208   2HG   LYS  26           HG1      LYS  26 -12.588  13.081   3.444
  209   1HD   LYS  26           HD2      LYS  26 -12.447  14.697   5.932
  210   2HD   LYS  26           HD1      LYS  26 -13.689  15.167   4.773
  211   1HE   LYS  26           HE2      LYS  26 -14.196  12.591   4.686
  212   2HE   LYS  26           HE1      LYS  26 -13.363  12.564   6.238
  213   1HZ   LYS  26           HZ2      LYS  26 -15.452  14.573   5.763
  214   2HZ   LYS  26           HZ1      LYS  26 -15.907  12.980   6.139
  215   3HZ   LYS  26           HZ3      LYS  26 -14.951  13.866   7.223
  216    H    LEU  27           HN       LEU  27 -10.044  10.279   3.999
  217    HA   LEU  27           HA       LEU  27 -11.957   9.646   1.799
  218   1HB   LEU  27           HB2      LEU  27  -9.610   8.335   2.834
  219   2HB   LEU  27           HB1      LEU  27 -11.003   7.269   3.018
  220    HG   LEU  27           HG       LEU  27  -9.778   7.095   0.791
  221   1HD1  LEU  27          HD11      LEU  27 -12.146   6.363   1.193
  222   2HD1  LEU  27          HD13      LEU  27 -12.684   7.953   0.652
  223   3HD1  LEU  27          HD12      LEU  27 -11.844   6.878  -0.467
  224   1HD2  LEU  27          HD21      LEU  27 -10.148   9.910   0.885
  225   2HD2  LEU  27          HD23      LEU  27  -9.440   8.964  -0.424
  226   3HD2  LEU  27          HD22      LEU  27 -11.170   9.309  -0.420
  227    H    LYS  28           HN       LYS  28 -12.988   7.252   2.791
  228    HA   LYS  28           HA       LYS  28 -14.112   7.812   5.461
  229   1HB   LYS  28           HB2      LYS  28 -15.492   8.494   3.065
  230   2HB   LYS  28           HB1      LYS  28 -16.296   7.080   3.750
  231   1HG   LYS  28           HG2      LYS  28 -16.913   8.187   5.674
  232   2HG   LYS  28           HG1      LYS  28 -15.526   9.278   5.617
  233   1HD   LYS  28           HD2      LYS  28 -16.556  10.739   4.148
  234   2HD   LYS  28           HD1      LYS  28 -17.563   9.476   3.437
  235   1HE   LYS  28           HE2      LYS  28 -18.823   9.364   5.622
  236   2HE   LYS  28           HE1      LYS  28 -17.919  10.785   6.147
  237   1HZ   LYS  28           HZ1      LYS  28 -19.286  10.872   3.556
  238   2HZ   LYS  28           HZ3      LYS  28 -20.223  11.017   4.963
  239   3HZ   LYS  28           HZ2      LYS  28 -18.973  12.128   4.657
  240    H    LYS  29           HN       LYS  29 -15.432   5.898   6.208
  241    HA   LYS  29           HA       LYS  29 -14.076   3.426   5.460
  242   1HB   LYS  29           HB2      LYS  29 -16.510   3.785   7.231
  243   2HB   LYS  29           HB1      LYS  29 -15.413   2.403   7.207
  244   1HG   LYS  29           HG2      LYS  29 -13.624   3.678   8.119
  245   2HG   LYS  29           HG1      LYS  29 -14.449   5.205   7.801
  246   1HD   LYS  29           HD2      LYS  29 -15.522   5.110   9.776
  247   2HD   LYS  29           HD1      LYS  29 -16.110   3.484   9.421
  248   1HE   LYS  29           HE2      LYS  29 -14.754   2.826  11.116
  249   2HE   LYS  29           HE1      LYS  29 -13.448   3.028   9.947
  250   1HZ   LYS  29           HZ3      LYS  29 -13.594   5.494  10.731
  251   2HZ   LYS  29           HZ2      LYS  29 -14.296   4.811  12.119
  252   3HZ   LYS  29           HZ1      LYS  29 -12.729   4.356  11.643
  253    H    SER  30           HN       SER  30 -17.090   5.007   4.695
  254    HA   SER  30           HA       SER  30 -18.361   2.649   3.544
  255   1HB   SER  30           HB2      SER  30 -20.142   4.059   3.028
  256   2HB   SER  30           HB1      SER  30 -19.418   4.928   4.377
  257    HG   SER  30           HG       SER  30 -18.376   6.264   2.917
  258    H    GLU  31           HN       GLU  31 -16.427   5.354   2.285
  259    HA   GLU  31           HA       GLU  31 -16.668   4.339  -0.473
  260   1HB   GLU  31           HB2      GLU  31 -16.395   6.844   0.344
  261   2HB   GLU  31           HB1      GLU  31 -14.679   6.434   0.373
  262   1HG   GLU  31           HG2      GLU  31 -14.583   6.072  -1.928
  263   2HG   GLU  31           HG1      GLU  31 -16.314   5.746  -2.048
  264    H    LEU  32           HN       LEU  32 -14.669   3.965   2.294
  265    HA   LEU  32           HA       LEU  32 -12.311   3.036   0.823
  266   1HB   LEU  32           HB2      LEU  32 -11.833   3.950   2.974
  267   2HB   LEU  32           HB1      LEU  32 -13.133   3.034   3.738
  268    HG   LEU  32           HG       LEU  32 -11.942   0.944   3.381
  269   1HD1  LEU  32          HD11      LEU  32 -10.897   1.867   1.189
  270   2HD1  LEU  32          HD13      LEU  32  -9.623   2.496   2.233
  271   3HD1  LEU  32          HD12      LEU  32  -9.931   0.760   2.162
  272   1HD2  LEU  32          HD21      LEU  32 -11.342   2.496   5.330
  273   2HD2  LEU  32          HD23      LEU  32 -10.140   1.273   4.917
  274   3HD2  LEU  32          HD22      LEU  32  -9.911   2.944   4.401
  275    H    LYS  33           HN       LYS  33 -15.197   1.739   2.313
  276    HA   LYS  33           HA       LYS  33 -14.480  -1.044   2.270
  277   1HB   LYS  33           HB2      LYS  33 -16.489   0.180   3.421
  278   2HB   LYS  33           HB1      LYS  33 -17.298  -0.045   1.874
  279   1HG   LYS  33           HG2      LYS  33 -15.912  -2.433   2.966
  280   2HG   LYS  33           HG1      LYS  33 -17.348  -1.903   3.847
  281   1HD   LYS  33           HD2      LYS  33 -17.371  -2.202   0.845
  282   2HD   LYS  33           HD1      LYS  33 -17.699  -3.572   1.906
  283   1HE   LYS  33           HE2      LYS  33 -19.161  -1.026   2.454
  284   2HE   LYS  33           HE1      LYS  33 -19.660  -1.967   1.048
  285   1HZ   LYS  33           HZ2      LYS  33 -19.441  -3.890   2.865
  286   2HZ   LYS  33           HZ1      LYS  33 -19.885  -2.596   3.874
  287   3HZ   LYS  33           HZ3      LYS  33 -20.886  -3.043   2.580
  288    H    GLU  34           HN       GLU  34 -16.155   1.087  -0.021
  289    HA   GLU  34           HA       GLU  34 -16.569  -0.976  -2.005
  290   1HB   GLU  34           HB2      GLU  34 -17.457   0.746  -3.338
  291   2HB   GLU  34           HB1      GLU  34 -17.721   1.369  -1.710
  292   1HG   GLU  34           HG2      GLU  34 -15.810   2.806  -1.849
  293   2HG   GLU  34           HG1      GLU  34 -15.275   2.056  -3.350
  294    H    LEU  35           HN       LEU  35 -14.161   1.524  -1.445
  295    HA   LEU  35           HA       LEU  35 -12.563   1.380  -3.708
  296   1HB   LEU  35           HB2      LEU  35 -12.307   2.446  -1.161
  297   2HB   LEU  35           HB1      LEU  35 -10.985   1.272  -1.234
  298    HG   LEU  35           HG       LEU  35 -10.239   3.469  -2.065
  299   1HD1  LEU  35          HD11      LEU  35  -9.929   1.005  -3.331
  300   2HD1  LEU  35          HD13      LEU  35 -10.327   2.108  -4.647
  301   3HD1  LEU  35          HD12      LEU  35  -8.944   2.442  -3.605
  302   1HD2  LEU  35          HD22      LEU  35 -12.787   3.263  -3.512
  303   2HD2  LEU  35          HD21      LEU  35 -11.851   4.696  -3.086
  304   3HD2  LEU  35          HD23      LEU  35 -11.443   3.774  -4.534
  305    H    ILE  36           HN       ILE  36 -12.564  -0.887  -0.943
  306    HA   ILE  36           HA       ILE  36 -10.497  -2.558  -2.163
  307    HB   ILE  36           HB       ILE  36 -12.268  -3.677  -0.051
  308   1HG1  ILE  36          HG12      ILE  36 -10.593  -1.186   0.280
  309   2HG1  ILE  36          HG11      ILE  36 -12.233  -1.498   0.850
  310   1HG2  ILE  36          HG23      ILE  36  -9.888  -4.391  -1.144
  311   2HG2  ILE  36          HG22      ILE  36  -9.325  -3.448   0.236
  312   3HG2  ILE  36          HG21      ILE  36 -10.378  -4.842   0.490
  313   1HD1  ILE  36          HD12      ILE  36  -9.764  -2.927   1.875
  314   2HD1  ILE  36          HD11      ILE  36 -10.556  -1.579   2.694
  315   3HD1  ILE  36          HD13      ILE  36 -11.410  -3.110   2.484
  316    H    ASN  37           HN       ASN  37 -13.947  -3.141  -1.373
  317    HA   ASN  37           HA       ASN  37 -14.030  -5.509  -3.044
  318   1HB   ASN  37           HB2      ASN  37 -15.489  -5.109  -1.022
  319   2HB   ASN  37           HB1      ASN  37 -16.380  -3.923  -1.978
  320   1HD2  ASN  37          HD22      ASN  37 -16.711  -7.908  -2.963
  321   2HD2  ASN  37          HD21      ASN  37 -15.347  -7.380  -2.103
  322    H    ASN  38           HN       ASN  38 -15.818  -2.408  -3.332
  323    HA   ASN  38           HA       ASN  38 -16.848  -2.822  -5.896
  324   1HB   ASN  38           HB2      ASN  38 -17.485  -0.890  -4.538
  325   2HB   ASN  38           HB1      ASN  38 -15.865  -0.212  -4.705
  326   1HD2  ASN  38          HD22      ASN  38 -16.357   0.811  -8.101
  327   2HD2  ASN  38          HD21      ASN  38 -15.171   0.374  -6.971
  328    H    GLU  39           HN       GLU  39 -13.545  -1.984  -5.008
  329    HA   GLU  39           HA       GLU  39 -12.897  -1.619  -7.892
  330   1HB   GLU  39           HB2      GLU  39 -12.034  -0.253  -5.635
  331   2HB   GLU  39           HB1      GLU  39 -10.677  -1.316  -6.015
  332   1HG   GLU  39           HG2      GLU  39 -10.090   0.183  -7.596
  333   2HG   GLU  39           HG1      GLU  39 -11.502  -0.357  -8.502
  334    H    LEU  40           HN       LEU  40 -11.083  -3.097  -5.177
  335    HA   LEU  40           HA       LEU  40  -9.816  -4.993  -6.943
  336   1HB   LEU  40           HB2      LEU  40 -10.009  -4.937  -3.917
  337   2HB   LEU  40           HB1      LEU  40  -8.907  -5.944  -4.853
  338    HG   LEU  40           HG       LEU  40  -8.982  -2.914  -4.870
  339   1HD1  LEU  40          HD11      LEU  40  -8.035  -3.930  -2.803
  340   2HD1  LEU  40          HD13      LEU  40  -6.895  -4.838  -3.797
  341   3HD1  LEU  40          HD12      LEU  40  -6.815  -3.077  -3.748
  342   1HD2  LEU  40          HD22      LEU  40  -7.590  -4.974  -6.528
  343   2HD2  LEU  40          HD21      LEU  40  -8.161  -3.367  -6.980
  344   3HD2  LEU  40          HD23      LEU  40  -6.663  -3.545  -6.068
  345    H    SER  41           HN       SER  41 -11.100  -6.416  -4.043
  346    HA   SER  41           HA       SER  41 -12.537  -8.246  -3.748
  347   1HB   SER  41           HB2      SER  41 -14.132  -6.435  -4.649
  348   2HB   SER  41           HB1      SER  41 -14.003  -7.264  -6.196
  349    HG   SER  41           HG       SER  41 -14.469  -9.199  -4.678
  350    H    HIS  42           HN       HIS  42 -10.281  -8.190  -5.927
  351    HA   HIS  42           HA       HIS  42 -11.242 -10.284  -7.761
  352   1HB   HIS  42           HB2      HIS  42  -8.945  -8.471  -7.608
  353   2HB   HIS  42           HB1      HIS  42  -8.491 -10.108  -8.086
  354    HD1  HIS  42           HD1      HIS  42 -10.927  -7.356  -9.072
  355    HD2  HIS  42           HD2      HIS  42  -9.152 -10.754 -10.711
  356    HE1  HIS  42           HE1      HIS  42 -11.584  -7.399 -11.518
  357    H    PHE  43           HN       PHE  43  -8.487 -10.063  -5.466
  358    HA   PHE  43           HA       PHE  43  -8.035 -12.888  -5.409
  359   1HB   PHE  43           HB2      PHE  43  -7.419 -10.824  -3.267
  360   2HB   PHE  43           HB1      PHE  43  -6.698 -12.430  -3.392
  361    HD1  PHE  43           HD2      PHE  43  -6.143 -12.763  -6.212
  362    HD2  PHE  43           HD1      PHE  43  -5.775  -9.243  -3.778
  363    HE1  PHE  43           HE2      PHE  43  -4.428 -11.869  -7.766
  364    HE2  PHE  43           HE1      PHE  43  -4.058  -8.349  -5.331
  365    HZ   PHE  43           HZ       PHE  43  -3.385  -9.662  -7.324
  366    H    LEU  44           HN       LEU  44  -8.520 -11.858  -2.183
  367    HA   LEU  44           HA       LEU  44  -9.912 -12.846  -0.554
  368   1HB   LEU  44           HB2      LEU  44 -11.236 -10.950  -2.109
  369   2HB   LEU  44           HB1      LEU  44 -12.363 -12.306  -2.036
  370    HG   LEU  44           HG       LEU  44 -11.431 -12.168   0.558
  371   1HD1  LEU  44          HD13      LEU  44 -10.303 -10.006  -0.032
  372   2HD1  LEU  44          HD12      LEU  44 -11.884  -9.335  -0.430
  373   3HD1  LEU  44          HD11      LEU  44 -11.529  -9.829   1.225
  374   1HD2  LEU  44          HD22      LEU  44 -13.864 -11.063  -0.841
  375   2HD2  LEU  44          HD21      LEU  44 -13.733 -12.509   0.159
  376   3HD2  LEU  44          HD23      LEU  44 -13.682 -10.911   0.906
  377    H    GLU  45           HN       GLU  45  -9.497 -15.086  -0.746
  378    HA   GLU  45           HA       GLU  45 -11.417 -16.590  -2.478
  379   1HB   GLU  45           HB2      GLU  45  -8.716 -17.466  -1.405
  380   2HB   GLU  45           HB1      GLU  45  -9.783 -18.444  -2.413
  381   1HG   GLU  45           HG2      GLU  45  -9.436 -15.900  -3.680
  382   2HG   GLU  45           HG1      GLU  45  -7.845 -16.529  -3.257
  383    H    GLU  46           HN       GLU  46  -9.464 -17.672   0.273
  384    HA   GLU  46           HA       GLU  46 -11.997 -18.472   1.622
  385   1HB   GLU  46           HB2      GLU  46 -10.871 -20.480   1.372
  386   2HB   GLU  46           HB1      GLU  46  -9.287 -19.709   1.361
  387   1HG   GLU  46           HG2      GLU  46  -9.102 -19.743   3.643
  388   2HG   GLU  46           HG1      GLU  46 -10.839 -19.559   3.892
  389    H    ILE  47           HN       ILE  47  -9.220 -16.462   1.748
  390    HA   ILE  47           HA       ILE  47  -8.681 -14.754   3.266
  391    HB   ILE  47           HB       ILE  47 -10.947 -15.735   5.015
  392   1HG1  ILE  47          HG12      ILE  47 -11.183 -13.643   2.842
  393   2HG1  ILE  47          HG11      ILE  47 -11.591 -15.335   2.553
  394   1HG2  ILE  47          HG22      ILE  47  -9.135 -13.420   4.907
  395   2HG2  ILE  47          HG21      ILE  47 -10.836 -12.978   5.057
  396   3HG2  ILE  47          HG23      ILE  47 -10.093 -14.037   6.254
  397   1HD1  ILE  47          HD12      ILE  47 -12.753 -14.017   4.971
  398   2HD1  ILE  47          HD11      ILE  47 -13.427 -13.591   3.398
  399   3HD1  ILE  47          HD13      ILE  47 -13.440 -15.271   3.937
  400    H    LYS  48           HN       LYS  48  -6.718 -15.560   3.967
  401    HA   LYS  48           HA       LYS  48  -6.665 -17.707   5.997
  402   1HB   LYS  48           HB2      LYS  48  -4.971 -17.830   4.265
  403   2HB   LYS  48           HB1      LYS  48  -4.466 -16.169   4.580
  404   1HG   LYS  48           HG2      LYS  48  -3.497 -16.724   6.650
  405   2HG   LYS  48           HG1      LYS  48  -4.394 -18.240   6.766
  406   1HD   LYS  48           HD2      LYS  48  -2.939 -18.436   4.372
  407   2HD   LYS  48           HD1      LYS  48  -1.814 -17.734   5.535
  408   1HE   LYS  48           HE2      LYS  48  -1.624 -20.127   5.722
  409   2HE   LYS  48           HE1      LYS  48  -2.495 -19.561   7.148
  410   1HZ   LYS  48           HZ2      LYS  48  -4.420 -19.990   5.238
  411   2HZ   LYS  48           HZ1      LYS  48  -3.368 -21.317   5.092
  412   3HZ   LYS  48           HZ3      LYS  48  -4.093 -20.970   6.586
  413    H    GLU  49           HN       GLU  49  -5.743 -14.277   5.673
  414    HA   GLU  49           HA       GLU  49  -5.093 -14.098   8.532
  415   1HB   GLU  49           HB2      GLU  49  -4.909 -12.307   6.162
  416   2HB   GLU  49           HB1      GLU  49  -5.167 -11.517   7.715
  417   1HG   GLU  49           HG2      GLU  49  -3.019 -13.607   7.306
  418   2HG   GLU  49           HG1      GLU  49  -2.727 -11.886   7.048
  419    H    GLN  50           HN       GLN  50  -7.415 -14.933   8.956
  420    HA   GLN  50           HA       GLN  50  -9.746 -13.472   8.443
  421   1HB   GLN  50           HB2      GLN  50  -9.374 -15.708   9.764
  422   2HB   GLN  50           HB1      GLN  50  -9.283 -14.648  11.171
  423   1HG   GLN  50           HG2      GLN  50 -11.514 -14.303  11.169
  424   2HG   GLN  50           HG1      GLN  50 -11.525 -13.957   9.439
  425   1HE2  GLN  50          HE22      GLN  50 -11.891 -17.915  10.545
  426   2HE2  GLN  50          HE21      GLN  50 -10.904 -16.889  11.470
  427    H    GLU  51           HN       GLU  51  -7.088 -12.668  10.542
  428    HA   GLU  51           HA       GLU  51  -8.590 -10.676  12.067
  429   1HB   GLU  51           HB2      GLU  51  -6.096 -11.969  12.325
  430   2HB   GLU  51           HB1      GLU  51  -5.726 -10.257  12.101
  431   1HG   GLU  51           HG2      GLU  51  -7.416  -9.727  13.887
  432   2HG   GLU  51           HG1      GLU  51  -7.576 -11.461  14.180
  433    H    VAL  52           HN       VAL  52  -6.417 -10.653   9.262
  434    HA   VAL  52           HA       VAL  52  -6.255  -7.768   9.134
  435    HB   VAL  52           HB       VAL  52  -5.848  -9.777   6.896
  436   1HG1  VAL  52          HG11      VAL  52  -5.851  -6.969   6.909
  437   2HG1  VAL  52          HG13      VAL  52  -4.147  -7.428   6.929
  438   3HG1  VAL  52          HG12      VAL  52  -5.204  -8.020   5.648
  439   1HG2  VAL  52          HG23      VAL  52  -4.523  -9.988   9.169
  440   2HG2  VAL  52          HG22      VAL  52  -3.662 -10.105   7.634
  441   3HG2  VAL  52          HG21      VAL  52  -3.637  -8.595   8.546
  442    H    VAL  53           HN       VAL  53  -8.298 -10.196   7.510
  443    HA   VAL  53           HA       VAL  53  -9.713  -8.136   6.003
  444    HB   VAL  53           HB       VAL  53 -10.328 -11.073   6.467
  445   1HG1  VAL  53          HG12      VAL  53 -11.689  -8.925   4.851
  446   2HG1  VAL  53          HG11      VAL  53 -11.761 -10.612   4.339
  447   3HG1  VAL  53          HG13      VAL  53 -12.411 -10.140   5.909
  448   1HG2  VAL  53          HG21      VAL  53  -8.428  -9.729   4.821
  449   2HG2  VAL  53          HG23      VAL  53  -8.826 -11.448   4.828
  450   3HG2  VAL  53          HG22      VAL  53  -9.694 -10.346   3.760
  451    H    ASP  54           HN       ASP  54 -10.226  -9.918   9.010
  452    HA   ASP  54           HA       ASP  54 -12.943  -8.875   9.325
  453   1HB   ASP  54           HB2      ASP  54 -11.083 -10.227  11.305
  454   2HB   ASP  54           HB1      ASP  54 -12.765  -9.814  11.631
  455    H    LYS  55           HN       LYS  55  -9.725  -7.793   9.981
  456    HA   LYS  55           HA       LYS  55 -10.522  -5.883  12.042
  457   1HB   LYS  55           HB2      LYS  55  -8.236  -6.810  12.007
  458   2HB   LYS  55           HB1      LYS  55  -7.966  -6.096  10.415
  459   1HG   LYS  55           HG2      LYS  55  -7.062  -4.743  12.366
  460   2HG   LYS  55           HG1      LYS  55  -8.153  -3.868  11.291
  461   1HD   LYS  55           HD2      LYS  55  -9.976  -4.061  12.811
  462   2HD   LYS  55           HD1      LYS  55  -9.140  -5.279  13.775
  463   1HE   LYS  55           HE2      LYS  55  -8.922  -3.256  15.012
  464   2HE   LYS  55           HE1      LYS  55  -7.363  -3.480  14.216
  465   1HZ   LYS  55           HZ1      LYS  55  -8.874  -2.114  12.399
  466   2HZ   LYS  55           HZ3      LYS  55  -9.283  -1.397  13.880
  467   3HZ   LYS  55           HZ2      LYS  55  -7.658  -1.458  13.388
  468    H    VAL  56           HN       VAL  56  -9.545  -5.659   8.599
  469    HA   VAL  56           HA       VAL  56 -10.110  -2.812   8.532
  470    HB   VAL  56           HB       VAL  56  -9.945  -3.201   6.013
  471   1HG1  VAL  56          HG11      VAL  56  -8.051  -2.505   7.514
  472   2HG1  VAL  56          HG13      VAL  56  -7.628  -4.210   7.683
  473   3HG1  VAL  56          HG12      VAL  56  -7.529  -3.431   6.104
  474   1HG2  VAL  56          HG21      VAL  56 -10.169  -5.912   6.896
  475   2HG2  VAL  56          HG23      VAL  56 -10.025  -5.312   5.247
  476   3HG2  VAL  56          HG22      VAL  56  -8.576  -5.697   6.174
  477    H    MET  57           HN       MET  57 -11.847  -5.748   7.634
  478    HA   MET  57           HA       MET  57 -14.098  -4.343   6.461
  479   1HB   MET  57           HB2      MET  57 -13.463  -6.759   6.011
  480   2HB   MET  57           HB1      MET  57 -14.045  -7.136   7.634
  481   1HG   MET  57           HG2      MET  57 -15.767  -7.534   5.857
  482   2HG   MET  57           HG1      MET  57 -16.281  -6.363   7.071
  483   1HE   MET  57           HE3      MET  57 -14.413  -7.023   4.066
  484   2HE   MET  57           HE2      MET  57 -15.479  -6.357   2.833
  485   3HE   MET  57           HE1      MET  57 -14.063  -5.443   3.350
  486    H    GLU  58           HN       GLU  58 -13.132  -5.186   9.707
  487    HA   GLU  58           HA       GLU  58 -15.833  -4.919  10.817
  488   1HB   GLU  58           HB2      GLU  58 -13.078  -5.234  11.960
  489   2HB   GLU  58           HB1      GLU  58 -14.355  -4.602  12.999
  490   1HG   GLU  58           HG2      GLU  58 -15.753  -6.553  12.542
  491   2HG   GLU  58           HG1      GLU  58 -14.550  -7.180  11.415
  492    H    THR  59           HN       THR  59 -12.900  -2.854  10.728
  493    HA   THR  59           HA       THR  59 -14.180  -0.617  12.033
  494    HB   THR  59           HB       THR  59 -11.950  -0.349  10.011
  495    HG1  THR  59           HG1      THR  59 -10.538  -0.913  11.695
  496   1HG2  THR  59          HG23      THR  59 -13.215   1.494  11.559
  497   2HG2  THR  59          HG22      THR  59 -11.914   1.003  12.643
  498   3HG2  THR  59          HG21      THR  59 -11.535   1.641  11.043
  499    H    LEU  60           HN       LEU  60 -14.273  -1.959   8.873
  500    HA   LEU  60           HA       LEU  60 -15.170   0.413   7.460
  501   1HB   LEU  60           HB2      LEU  60 -14.925  -2.517   6.906
  502   2HB   LEU  60           HB1      LEU  60 -16.011  -1.587   5.883
  503    HG   LEU  60           HG       LEU  60 -13.103  -0.915   6.410
  504   1HD1  LEU  60          HD13      LEU  60 -14.532  -2.406   4.238
  505   2HD1  LEU  60          HD12      LEU  60 -13.142  -1.409   3.805
  506   3HD1  LEU  60          HD11      LEU  60 -12.957  -2.726   4.963
  507   1HD2  LEU  60          HD21      LEU  60 -15.292   0.661   5.471
  508   2HD2  LEU  60          HD23      LEU  60 -13.589   1.112   5.556
  509   3HD2  LEU  60          HD22      LEU  60 -14.227   0.351   4.099
  510    H    ASP  61           HN       ASP  61 -16.846  -2.596   8.403
  511    HA   ASP  61           HA       ASP  61 -19.478  -1.418   8.020
  512   1HB   ASP  61           HB2      ASP  61 -18.385  -4.028   8.347
  513   2HB   ASP  61           HB1      ASP  61 -19.554  -3.787   9.647
  514    H    GLU  62           HN       GLU  62 -17.185  -1.113  10.436
  515    HA   GLU  62           HA       GLU  62 -19.006  -1.131  12.721
  516   1HB   GLU  62           HB2      GLU  62 -16.702  -1.686  13.154
  517   2HB   GLU  62           HB1      GLU  62 -16.145  -0.199  12.384
  518   1HG   GLU  62           HG2      GLU  62 -17.199   1.150  14.119
  519   2HG   GLU  62           HG1      GLU  62 -17.897  -0.293  14.858
  520    H    ASP  63           HN       ASP  63 -17.159   1.417  11.035
  521    HA   ASP  63           HA       ASP  63 -19.314   3.324  11.852
  522   1HB   ASP  63           HB2      ASP  63 -16.701   3.365  12.779
  523   2HB   ASP  63           HB1      ASP  63 -16.676   4.538  11.462
  524    H    GLY  64           HN       GLY  64 -19.443   2.048   9.392
  525   1HA   GLY  64           HA2      GLY  64 -18.167   2.982   7.155
  526   2HA   GLY  64           HA1      GLY  64 -19.916   2.757   7.183
  527    H    ASP  65           HN       ASP  65 -20.252   4.844   9.275
  528    HA   ASP  65           HA       ASP  65 -20.176   7.175   7.450
  529   1HB   ASP  65           HB2      ASP  65 -22.270   6.585   8.706
  530   2HB   ASP  65           HB1      ASP  65 -21.417   6.938  10.208
  531    H    GLY  66           HN       GLY  66 -17.639   6.370   8.403
  532   1HA   GLY  66           HA2      GLY  66 -17.011   8.567  10.319
  533   2HA   GLY  66           HA1      GLY  66 -16.139   7.035  10.317
  534    H    GLU  67           HN       GLU  67 -14.519   9.150  10.050
  535    HA   GLU  67           HA       GLU  67 -14.019   9.385   7.108
  536   1HB   GLU  67           HB2      GLU  67 -12.687  11.451   7.785
  537   2HB   GLU  67           HB1      GLU  67 -14.437  11.571   7.989
  538   1HG   GLU  67           HG2      GLU  67 -14.311  11.555  10.281
  539   2HG   GLU  67           HG1      GLU  67 -12.894  10.505  10.299
  540    H    CYS  68           HN       CYS  68 -11.819   9.239   6.397
  541    HA   CYS  68           HA       CYS  68  -9.916   8.077   8.385
  542   1HB   CYS  68           HB2      CYS  68 -11.147   6.673   6.279
  543   2HB   CYS  68           HB1      CYS  68  -9.508   7.014   5.720
  544    HG   CYS  68           HG       CYS  68  -8.627   5.881   7.962
  545    H    ASP  69           HN       ASP  69  -7.687   7.839   6.853
  546    HA   ASP  69           HA       ASP  69  -7.312  10.586   5.714
  547   1HB   ASP  69           HB2      ASP  69  -5.376   8.917   7.345
  548   2HB   ASP  69           HB1      ASP  69  -4.955  10.431   6.542
  549    H    PHE  70           HN       PHE  70  -5.191  10.560   4.298
  550    HA   PHE  70           HA       PHE  70  -5.630   8.596   2.212
  551   1HB   PHE  70           HB2      PHE  70  -3.428   9.653   1.311
  552   2HB   PHE  70           HB1      PHE  70  -4.861  10.676   1.408
  553    HD1  PHE  70           HD2      PHE  70  -1.666   9.803   3.085
  554    HD2  PHE  70           HD1      PHE  70  -4.972  12.541   2.911
  555    HE1  PHE  70           HE2      PHE  70  -0.457  11.362   4.587
  556    HE2  PHE  70           HE1      PHE  70  -3.762  14.099   4.413
  557    HZ   PHE  70           HZ       PHE  70  -1.505  13.510   5.251
  558    H    GLN  71           HN       GLN  71  -3.347   8.941   4.870
  559    HA   GLN  71           HA       GLN  71  -1.659   6.743   3.924
  560   1HB   GLN  71           HB2      GLN  71  -0.293   7.201   5.758
  561   2HB   GLN  71           HB1      GLN  71  -1.030   8.776   5.478
  562   1HG   GLN  71           HG2      GLN  71  -1.488   8.625   7.720
  563   2HG   GLN  71           HG1      GLN  71  -2.881   7.711   7.140
  564   1HE2  GLN  71          HE22      GLN  71   0.294   5.372   8.319
  565   2HE2  GLN  71          HE21      GLN  71   0.581   6.719   7.328
  566    H    GLU  72           HN       GLU  72  -4.423   7.147   6.056
  567    HA   GLU  72           HA       GLU  72  -4.201   4.534   7.302
  568   1HB   GLU  72           HB2      GLU  72  -6.213   6.728   7.191
  569   2HB   GLU  72           HB1      GLU  72  -6.835   5.116   7.544
  570   1HG   GLU  72           HG2      GLU  72  -4.455   5.472   9.073
  571   2HG   GLU  72           HG1      GLU  72  -5.459   6.906   9.304
  572    H    PHE  73           HN       PHE  73  -6.463   5.812   4.840
  573    HA   PHE  73           HA       PHE  73  -7.546   3.298   4.087
  574   1HB   PHE  73           HB2      PHE  73  -8.820   4.760   2.915
  575   2HB   PHE  73           HB1      PHE  73  -7.636   6.039   3.150
  576    HD1  PHE  73           HD1      PHE  73  -5.658   6.188   1.553
  577    HD2  PHE  73           HD2      PHE  73  -9.065   3.676   0.811
  578    HE1  PHE  73           HE1      PHE  73  -5.032   6.048  -0.843
  579    HE2  PHE  73           HE2      PHE  73  -8.436   3.538  -1.585
  580    HZ   PHE  73           HZ       PHE  73  -6.422   4.724  -2.411
  581    H    MET  74           HN       MET  74  -4.511   4.824   3.382
  582    HA   MET  74           HA       MET  74  -3.810   3.278   1.052
  583   1HB   MET  74           HB2      MET  74  -2.444   5.094   2.959
  584   2HB   MET  74           HB1      MET  74  -1.404   3.915   2.162
  585   1HG   MET  74           HG2      MET  74  -3.289   5.134   0.302
  586   2HG   MET  74           HG1      MET  74  -2.263   6.338   1.084
  587   1HE   MET  74           HE1      MET  74  -2.857   3.495  -0.929
  588   2HE   MET  74           HE3      MET  74  -2.137   4.376  -2.283
  589   3HE   MET  74           HE2      MET  74  -1.362   2.920  -1.663
  590    H    ALA  75           HN       ALA  75  -2.801   2.971   4.475
  591    HA   ALA  75           HA       ALA  75  -1.515   0.423   4.044
  592   1HB   ALA  75           HB1      ALA  75  -1.041   1.991   5.963
  593   2HB   ALA  75           HB3      ALA  75  -2.604   1.539   6.647
  594   3HB   ALA  75           HB2      ALA  75  -1.339   0.324   6.460
  595    H    PHE  76           HN       PHE  76  -4.778   1.389   4.358
  596    HA   PHE  76           HA       PHE  76  -5.778  -1.143   5.431
  597   1HB   PHE  76           HB2      PHE  76  -6.884   1.463   4.630
  598   2HB   PHE  76           HB1      PHE  76  -7.923   0.100   4.210
  599    HD1  PHE  76           HD1      PHE  76  -5.906   1.462   7.063
  600    HD2  PHE  76           HD2      PHE  76  -9.321  -0.834   5.833
  601    HE1  PHE  76           HE1      PHE  76  -6.645   1.293   9.426
  602    HE2  PHE  76           HE2      PHE  76 -10.062  -1.002   8.192
  603    HZ   PHE  76           HZ       PHE  76  -8.725   0.060   9.991
  604    H    VAL  77           HN       VAL  77  -5.447   0.387   2.253
  605    HA   VAL  77           HA       VAL  77  -6.851  -1.705   0.815
  606    HB   VAL  77           HB       VAL  77  -4.832   0.346  -0.157
  607   1HG1  VAL  77          HG11      VAL  77  -5.636  -1.870  -1.506
  608   2HG1  VAL  77          HG13      VAL  77  -6.938  -0.761  -1.934
  609   3HG1  VAL  77          HG12      VAL  77  -5.264  -0.339  -2.298
  610   1HG2  VAL  77          HG23      VAL  77  -7.162   0.969   0.989
  611   2HG2  VAL  77          HG22      VAL  77  -6.591   1.828  -0.442
  612   3HG2  VAL  77          HG21      VAL  77  -7.787   0.540  -0.603
  613    H    SER  78           HN       SER  78  -3.561  -1.264   1.921
  614    HA   SER  78           HA       SER  78  -2.435  -3.275   0.136
  615   1HB   SER  78           HB2      SER  78  -1.292  -2.146   2.704
  616   2HB   SER  78           HB1      SER  78  -0.402  -3.011   1.454
  617    HG   SER  78           HG       SER  78  -0.208  -1.163   0.491
  618    H    MET  79           HN       MET  79  -3.203  -3.237   3.641
  619    HA   MET  79           HA       MET  79  -2.427  -5.869   4.231
  620   1HB   MET  79           HB2      MET  79  -4.800  -4.361   5.356
  621   2HB   MET  79           HB1      MET  79  -3.991  -5.730   6.109
  622   1HG   MET  79           HG2      MET  79  -1.961  -3.863   5.470
  623   2HG   MET  79           HG1      MET  79  -3.270  -2.945   6.218
  624   1HE   MET  79           HE3      MET  79  -4.672  -3.977   7.824
  625   2HE   MET  79           HE2      MET  79  -4.300  -5.323   8.897
  626   3HE   MET  79           HE1      MET  79  -3.862  -3.682   9.369
  627    H    VAL  80           HN       VAL  80  -5.622  -4.740   3.076
  628    HA   VAL  80           HA       VAL  80  -6.850  -7.311   3.102
  629    HB   VAL  80           HB       VAL  80  -8.361  -6.220   1.322
  630   1HG1  VAL  80          HG11      VAL  80  -8.720  -6.301   3.837
  631   2HG1  VAL  80          HG13      VAL  80  -7.996  -4.693   3.910
  632   3HG1  VAL  80          HG12      VAL  80  -9.495  -4.946   3.017
  633   1HG2  VAL  80          HG22      VAL  80  -6.173  -4.389   1.339
  634   2HG2  VAL  80          HG21      VAL  80  -7.664  -4.285   0.405
  635   3HG2  VAL  80          HG23      VAL  80  -7.575  -3.549   2.005
  636    H    THR  81           HN       THR  81  -5.006  -5.631   0.540
  637    HA   THR  81           HA       THR  81  -5.487  -7.683  -1.438
  638    HB   THR  81           HB       THR  81  -2.964  -6.091  -1.538
  639    HG1  THR  81           HG1      THR  81  -3.949  -4.226  -1.604
  640   1HG2  THR  81          HG21      THR  81  -5.137  -6.990  -3.416
  641   2HG2  THR  81          HG23      THR  81  -4.019  -5.707  -3.885
  642   3HG2  THR  81          HG22      THR  81  -3.405  -7.315  -3.494
  643    H    THR  82           HN       THR  82  -3.637  -7.661   1.391
  644    HA   THR  82           HA       THR  82  -1.891  -9.842   0.327
  645    HB   THR  82           HB       THR  82  -0.724  -9.247   2.678
  646    HG1  THR  82           HG1      THR  82  -0.834  -6.772   2.478
  647   1HG2  THR  82          HG22      THR  82   0.033  -9.109   0.151
  648   2HG2  THR  82          HG21      THR  82  -0.189  -7.376   0.399
  649   3HG2  THR  82          HG23      THR  82   0.953  -8.273   1.401
  650    H    ALA  83           HN       ALA  83  -4.688  -9.386   2.023
  651    HA   ALA  83           HA       ALA  83  -4.194 -11.425   4.092
  652   1HB   ALA  83           HB3      ALA  83  -6.037  -9.309   3.756
  653   2HB   ALA  83           HB2      ALA  83  -6.988 -10.795   3.706
  654   3HB   ALA  83           HB1      ALA  83  -5.961 -10.452   5.097
  655    H    CYS  84           HN       CYS  84  -3.965 -12.146   1.207
  656    HA   CYS  84           HA       CYS  84  -6.058 -14.282   1.179
  657   1HB   CYS  84           HB2      CYS  84  -4.883 -13.079  -1.329
  658   2HB   CYS  84           HB1      CYS  84  -6.354 -14.039  -1.156
  659    HG   CYS  84           HG       CYS  84  -6.626 -11.249  -1.265
  660    H    HIS  85           HN       HIS  85  -5.205 -15.958  -0.691
  661    HA   HIS  85           HA       HIS  85  -2.449 -16.678   0.202
  662   1HB   HIS  85           HB2      HIS  85  -4.187 -18.588  -1.311
  663   2HB   HIS  85           HB1      HIS  85  -3.023 -18.912  -0.030
  664    HD1  HIS  85           HD1      HIS  85  -6.576 -17.858  -0.608
  665    HD2  HIS  85           HD2      HIS  85  -4.048 -18.620   2.614
  666    HE1  HIS  85           HE1      HIS  85  -8.047 -17.939   1.451
  667    H    GLU  86           HN       GLU  86  -4.496 -16.500  -2.713
  668    HA   GLU  86           HA       GLU  86  -2.027 -16.682  -4.374
  669   1HB   GLU  86           HB2      GLU  86  -4.950 -17.164  -4.896
  670   2HB   GLU  86           HB1      GLU  86  -3.868 -16.798  -6.240
  671   1HG   GLU  86           HG2      GLU  86  -3.342 -18.994  -6.254
  672   2HG   GLU  86           HG1      GLU  86  -2.463 -18.691  -4.757
  673    H    PHE  87           HN       PHE  87  -1.434 -14.432  -3.802
  674    HA   PHE  87           HA       PHE  87  -3.193 -12.393  -5.092
  675   1HB   PHE  87           HB2      PHE  87  -1.603 -10.795  -3.794
  676   2HB   PHE  87           HB1      PHE  87  -2.821 -11.688  -2.881
  677    HD1  PHE  87           HD2      PHE  87   0.758 -11.740  -3.934
  678    HD2  PHE  87           HD1      PHE  87  -2.202 -13.237  -1.198
  679    HE1  PHE  87           HE2      PHE  87   2.541 -12.791  -2.574
  680    HE2  PHE  87           HE1      PHE  87  -0.412 -14.286   0.158
  681    HZ   PHE  87           HZ       PHE  87   1.960 -14.065  -0.532
  682    H    PHE  88           HN       PHE  88  -0.405 -14.193  -5.661
  683    HA   PHE  88           HA       PHE  88   0.882 -12.049  -7.263
  684   1HB   PHE  88           HB2      PHE  88   1.741 -14.821  -6.416
  685   2HB   PHE  88           HB1      PHE  88   2.599 -13.935  -7.672
  686    HD1  PHE  88           HD1      PHE  88   1.885 -11.157  -6.150
  687    HD2  PHE  88           HD2      PHE  88   3.814 -14.842  -5.060
  688    HE1  PHE  88           HE1      PHE  88   3.181  -9.962  -4.414
  689    HE2  PHE  88           HE2      PHE  88   5.110 -13.641  -3.322
  690    HZ   PHE  88           HZ       PHE  88   4.794 -11.203  -2.999
  691    H    GLU  89           HN       GLU  89   0.157 -15.497  -7.746
  692    HA   GLU  89           HA       GLU  89  -1.525 -15.153  -9.995
  693   1HB   GLU  89           HB2      GLU  89   1.255 -14.693 -10.470
  694   2HB   GLU  89           HB1      GLU  89   0.765 -16.152 -11.328
  695   1HG   GLU  89           HG2      GLU  89  -1.246 -14.060 -11.564
  696   2HG   GLU  89           HG1      GLU  89   0.322 -13.516 -12.164
  697    H    HIS  90           HN       HIS  90   1.312 -17.275  -9.571
  698    HA   HIS  90           HA       HIS  90  -0.205 -19.658 -10.104
  699   1HB   HIS  90           HB2      HIS  90   1.796 -20.844  -9.692
  700   2HB   HIS  90           HB1      HIS  90   2.348 -19.285 -10.300
  701    HD1  HIS  90           HD1      HIS  90   2.448 -17.460  -8.012
  702    HD2  HIS  90           HD2      HIS  90   3.341 -21.504  -7.521
  703    HE1  HIS  90           HE1      HIS  90   3.834 -17.635  -5.901
  704    H    GLU  91           HN       GLU  91   0.541 -21.442  -8.086
  705    HA   GLU  91           HA       GLU  91  -1.132 -20.447  -5.816
  706   1HB   GLU  91           HB2      GLU  91  -0.776 -23.139  -7.100
  707   2HB   GLU  91           HB1      GLU  91  -1.246 -23.052  -5.401
  708   1HG   GLU  91           HG2      GLU  91  -3.192 -21.704  -5.952
  709   2HG   GLU  91           HG1      GLU  91  -2.690 -21.609  -7.640
  710   1H    MET   0           HT2      MET   0  -7.148  -2.673 -13.264
  711   2H    MET   0           HT1      MET   0  -7.843  -4.134 -13.787
  712   3H    MET   0           HT3      MET   0  -6.503  -3.491 -14.607
  713    HA   MET   0           HA       MET   0  -7.837  -2.396 -15.967
  714   1HB   MET   0           HB2      MET   0 -10.081  -3.339 -14.152
  715   2HB   MET   0           HB1      MET   0 -10.274  -2.711 -15.789
  716   1HG   MET   0           HG2      MET   0  -8.305  -4.878 -15.624
  717   2HG   MET   0           HG1      MET   0  -9.924  -5.378 -15.135
  718   1HE   MET   0           HE1      MET   0  -8.593  -6.713 -17.192
  719   2HE   MET   0           HE3      MET   0 -10.318  -7.052 -17.392
  720   3HE   MET   0           HE2      MET   0  -9.335  -6.602 -18.786
  721    H    SER   1           HN       SER   1  -9.221  -1.874 -12.695
  722    HA   SER   1           HA       SER   1  -9.743   0.940 -13.296
  723   1HB   SER   1           HB2      SER   1 -10.207   0.958 -10.740
  724   2HB   SER   1           HB1      SER   1 -11.280   0.012 -11.767
  725    HG   SER   1           HG       SER   1 -10.724  -1.459 -10.320
  726    H    GLU   2           HN       GLU   2  -8.912   2.458 -11.294
  727    HA   GLU   2           HA       GLU   2  -6.065   2.689 -11.706
  728   1HB   GLU   2           HB2      GLU   2  -7.666   4.012  -9.502
  729   2HB   GLU   2           HB1      GLU   2  -6.181   4.594 -10.255
  730   1HG   GLU   2           HG2      GLU   2  -8.926   4.394 -11.508
  731   2HG   GLU   2           HG1      GLU   2  -7.978   5.854 -11.222
  732    H    LEU   3           HN       LEU   3  -8.071   1.465  -9.045
  733    HA   LEU   3           HA       LEU   3  -5.761   0.962  -7.330
  734   1HB   LEU   3           HB2      LEU   3  -8.250   1.400  -6.648
  735   2HB   LEU   3           HB1      LEU   3  -8.453  -0.324  -6.955
  736    HG   LEU   3           HG       LEU   3  -6.353  -0.615  -5.455
  737   1HD1  LEU   3          HD13      LEU   3  -6.889   2.256  -5.273
  738   2HD1  LEU   3          HD12      LEU   3  -6.837   1.475  -3.693
  739   3HD1  LEU   3          HD11      LEU   3  -5.459   1.348  -4.784
  740   1HD2  LEU   3          HD22      LEU   3  -9.177  -0.373  -4.897
  741   2HD2  LEU   3          HD21      LEU   3  -7.997  -1.455  -4.159
  742   3HD2  LEU   3          HD23      LEU   3  -8.249   0.161  -3.496
  743    H    GLU   4           HN       GLU   4  -8.058  -1.110  -9.130
  744    HA   GLU   4           HA       GLU   4  -6.828  -3.579  -8.497
  745   1HB   GLU   4           HB2      GLU   4  -9.026  -3.388  -9.629
  746   2HB   GLU   4           HB1      GLU   4  -8.211  -2.823 -11.090
  747   1HG   GLU   4           HG2      GLU   4  -6.848  -4.985 -10.997
  748   2HG   GLU   4           HG1      GLU   4  -8.000  -5.541  -9.781
  749    H    LYS   5           HN       LYS   5  -6.103  -1.310 -11.164
  750    HA   LYS   5           HA       LYS   5  -4.005  -3.051 -12.209
  751   1HB   LYS   5           HB2      LYS   5  -5.431  -1.149 -13.395
  752   2HB   LYS   5           HB1      LYS   5  -4.103  -0.127 -12.842
  753   1HG   LYS   5           HG2      LYS   5  -3.081  -0.799 -14.760
  754   2HG   LYS   5           HG1      LYS   5  -2.737  -2.273 -13.852
  755   1HD   LYS   5           HD2      LYS   5  -4.440  -3.473 -14.884
  756   2HD   LYS   5           HD1      LYS   5  -5.372  -2.022 -15.258
  757   1HE   LYS   5           HE2      LYS   5  -3.633  -1.368 -16.918
  758   2HE   LYS   5           HE1      LYS   5  -2.778  -2.874 -16.585
  759   1HZ   LYS   5           HZ3      LYS   5  -5.576  -2.690 -17.562
  760   2HZ   LYS   5           HZ2      LYS   5  -4.225  -3.021 -18.538
  761   3HZ   LYS   5           HZ1      LYS   5  -4.687  -4.114 -17.321
  762    H    ALA   6           HN       ALA   6  -4.139  -0.160 -10.153
  763    HA   ALA   6           HA       ALA   6  -1.225   0.022  -9.967
  764   1HB   ALA   6           HB3      ALA   6  -2.681   2.025  -9.759
  765   2HB   ALA   6           HB2      ALA   6  -3.373   1.350  -8.284
  766   3HB   ALA   6           HB1      ALA   6  -1.668   1.800  -8.334
  767    H    MET   7           HN       MET   7  -3.628  -0.332  -7.357
  768    HA   MET   7           HA       MET   7  -2.058  -1.272  -5.319
  769   1HB   MET   7           HB2      MET   7  -4.502  -0.956  -5.123
  770   2HB   MET   7           HB1      MET   7  -4.766  -2.403  -6.102
  771   1HG   MET   7           HG2      MET   7  -4.968  -3.158  -3.862
  772   2HG   MET   7           HG1      MET   7  -3.342  -3.636  -4.346
  773   1HE   MET   7           HE1      MET   7  -1.249  -2.285  -3.937
  774   2HE   MET   7           HE3      MET   7  -0.963  -1.859  -2.244
  775   3HE   MET   7           HE2      MET   7  -1.558  -3.463  -2.663
  776    H    VAL   8           HN       VAL   8  -3.471  -3.299  -7.879
  777    HA   VAL   8           HA       VAL   8  -2.191  -5.714  -6.942
  778    HB   VAL   8           HB       VAL   8  -3.210  -5.131  -9.735
  779   1HG1  VAL   8          HG12      VAL   8  -2.474  -7.580  -8.162
  780   2HG1  VAL   8          HG11      VAL   8  -3.750  -7.690  -9.375
  781   3HG1  VAL   8          HG13      VAL   8  -2.124  -7.191  -9.846
  782   1HG2  VAL   8          HG22      VAL   8  -4.914  -4.598  -8.010
  783   2HG2  VAL   8          HG21      VAL   8  -5.357  -6.042  -8.920
  784   3HG2  VAL   8          HG23      VAL   8  -4.685  -6.195  -7.298
  785    H    ALA   9           HN       ALA   9  -1.322  -3.269  -9.381
  786    HA   ALA   9           HA       ALA   9   0.864  -4.590 -10.579
  787   1HB   ALA   9           HB1      ALA   9   0.520  -1.654  -9.891
  788   2HB   ALA   9           HB3      ALA   9   1.821  -2.278 -10.907
  789   3HB   ALA   9           HB2      ALA   9   0.143  -2.437 -11.426
  790    H    LEU  10           HN       LEU  10   0.766  -2.684  -7.566
  791    HA   LEU  10           HA       LEU  10   3.504  -2.804  -6.899
  792   1HB   LEU  10           HB2      LEU  10   1.149  -1.973  -5.636
  793   2HB   LEU  10           HB1      LEU  10   1.781  -3.240  -4.585
  794    HG   LEU  10           HG       LEU  10   3.637  -1.136  -5.656
  795   1HD1  LEU  10          HD11      LEU  10   1.342  -0.516  -4.148
  796   2HD1  LEU  10          HD13      LEU  10   2.675  -0.519  -2.994
  797   3HD1  LEU  10          HD12      LEU  10   2.745   0.519  -4.417
  798   1HD2  LEU  10          HD21      LEU  10   3.665  -3.301  -3.707
  799   2HD2  LEU  10          HD23      LEU  10   5.019  -2.404  -4.395
  800   3HD2  LEU  10          HD22      LEU  10   4.170  -1.776  -2.981
  801    H    ILE  11           HN       ILE  11   0.889  -5.075  -5.985
  802    HA   ILE  11           HA       ILE  11   2.424  -7.003  -4.653
  803    HB   ILE  11           HB       ILE  11   0.099  -7.415  -6.559
  804   1HG1  ILE  11          HG12      ILE  11  -0.443  -5.985  -4.645
  805   2HG1  ILE  11          HG11      ILE  11  -1.193  -7.568  -4.428
  806   1HG2  ILE  11          HG22      ILE  11   1.812  -9.364  -5.611
  807   2HG2  ILE  11          HG21      ILE  11   0.520  -9.367  -4.408
  808   3HG2  ILE  11          HG23      ILE  11   0.142  -9.633  -6.108
  809   1HD1  ILE  11          HD11      ILE  11   1.340  -7.867  -3.302
  810   2HD1  ILE  11          HD13      ILE  11   0.837  -6.251  -2.802
  811   3HD1  ILE  11          HD12      ILE  11  -0.172  -7.648  -2.418
  812    H    ASP  12           HN       ASP  12   2.104  -6.373  -8.101
  813    HA   ASP  12           HA       ASP  12   3.407  -8.717  -9.082
  814   1HB   ASP  12           HB2      ASP  12   2.165  -6.691 -10.294
  815   2HB   ASP  12           HB1      ASP  12   3.812  -6.085 -10.446
  816    H    VAL  13           HN       VAL  13   4.700  -5.506  -8.177
  817    HA   VAL  13           HA       VAL  13   7.377  -5.829  -8.874
  818    HB   VAL  13           HB       VAL  13   6.208  -4.571  -6.376
  819   1HG1  VAL  13          HG11      VAL  13   8.610  -5.252  -6.091
  820   2HG1  VAL  13          HG13      VAL  13   9.011  -4.269  -7.500
  821   3HG1  VAL  13          HG12      VAL  13   8.369  -3.504  -6.045
  822   1HG2  VAL  13          HG21      VAL  13   6.264  -3.811  -9.105
  823   2HG2  VAL  13          HG23      VAL  13   5.778  -2.819  -7.730
  824   3HG2  VAL  13          HG22      VAL  13   7.452  -2.797  -8.286
  825    H    PHE  14           HN       PHE  14   5.666  -7.232  -6.099
  826    HA   PHE  14           HA       PHE  14   7.968  -8.320  -4.796
  827   1HB   PHE  14           HB2      PHE  14   5.338  -8.240  -4.157
  828   2HB   PHE  14           HB1      PHE  14   5.455  -9.909  -4.719
  829    HD1  PHE  14           HD2      PHE  14   7.027 -11.499  -3.641
  830    HD2  PHE  14           HD1      PHE  14   6.443  -7.515  -2.138
  831    HE1  PHE  14           HE2      PHE  14   8.111 -12.145  -1.508
  832    HE2  PHE  14           HE1      PHE  14   7.527  -8.161  -0.005
  833    HZ   PHE  14           HZ       PHE  14   8.360 -10.476   0.310
  834    H    HIS  15           HN       HIS  15   5.777  -9.712  -7.249
  835    HA   HIS  15           HA       HIS  15   7.168 -12.233  -7.406
  836   1HB   HIS  15           HB2      HIS  15   4.870 -11.988  -8.227
  837   2HB   HIS  15           HB1      HIS  15   5.412 -10.830  -9.443
  838    HD1  HIS  15           HD1      HIS  15   6.995 -14.159  -8.471
  839    HD2  HIS  15           HD2      HIS  15   5.271 -12.309 -11.783
  840    HE1  HIS  15           HE1      HIS  15   7.292 -15.756 -10.416
  841    H    GLN  16           HN       GLN  16   8.114  -9.142  -8.319
  842    HA   GLN  16           HA       GLN  16   9.726 -10.034 -10.636
  843   1HB   GLN  16           HB2      GLN  16   8.465  -7.768 -10.430
  844   2HB   GLN  16           HB1      GLN  16   9.807  -7.288  -9.392
  845   1HG   GLN  16           HG2      GLN  16  11.048  -6.852 -11.214
  846   2HG   GLN  16           HG1      GLN  16  10.920  -8.546 -11.694
  847   1HE2  GLN  16          HE22      GLN  16   8.901  -7.725 -14.445
  848   2HE2  GLN  16          HE21      GLN  16  10.066  -8.753 -13.761
  849    H    TYR  17           HN       TYR  17  10.378  -8.278  -7.575
  850    HA   TYR  17           HA       TYR  17  13.219  -8.862  -7.712
  851   1HB   TYR  17           HB2      TYR  17  11.451  -7.784  -5.499
  852   2HB   TYR  17           HB1      TYR  17  13.199  -7.963  -5.345
  853    HD1  TYR  17           HD2      TYR  17  10.581  -6.416  -7.528
  854    HD2  TYR  17           HD1      TYR  17  14.634  -6.267  -6.111
  855    HE1  TYR  17           HE2      TYR  17  10.906  -4.243  -8.680
  856    HE2  TYR  17           HE1      TYR  17  14.958  -4.093  -7.265
  857    HH   TYR  17           HH       TYR  17  14.074  -2.621  -8.684
  858    H    SER  18           HN       SER  18  10.726  -9.870  -5.332
  859    HA   SER  18           HA       SER  18  12.380 -11.970  -4.255
  860   1HB   SER  18           HB2      SER  18  10.300 -10.779  -3.212
  861   2HB   SER  18           HB1      SER  18   9.372 -11.985  -4.099
  862    HG   SER  18           HG       SER  18  11.030 -13.481  -3.057
  863    H    GLY  19           HN       GLY  19  10.759 -11.731  -7.188
  864   1HA   GLY  19           HA2      GLY  19   9.980 -14.545  -7.399
  865   2HA   GLY  19           HA1      GLY  19   9.922 -13.356  -8.700
  866    H    ARG  20           HN       ARG  20  12.921 -13.204  -7.204
  867    HA   ARG  20           HA       ARG  20  14.234 -14.372  -9.524
  868   1HB   ARG  20           HB2      ARG  20  15.374 -13.366  -6.899
  869   2HB   ARG  20           HB1      ARG  20  16.326 -13.791  -8.323
  870   1HG   ARG  20           HG2      ARG  20  14.203 -11.993  -9.082
  871   2HG   ARG  20           HG1      ARG  20  15.117 -11.295  -7.746
  872   1HD   ARG  20           HD2      ARG  20  17.195 -11.520  -8.951
  873   2HD   ARG  20           HD1      ARG  20  16.416 -12.461 -10.222
  874    HE   ARG  20           HE       ARG  20  15.057 -10.282 -10.624
  875   1HH1  ARG  20          HH11      ARG  20  17.298  -9.444  -8.399
  876   2HH1  ARG  20          HH12      ARG  20  18.172  -8.315  -9.381
  877   1HH2  ARG  20          HH21      ARG  20  16.594  -9.246 -12.322
  878   2HH2  ARG  20          HH22      ARG  20  17.773  -8.202 -11.602
  879    H    GLU  21           HN       GLU  21  15.726 -15.139  -6.483
  880    HA   GLU  21           HA       GLU  21  14.652 -17.844  -6.320
  881   1HB   GLU  21           HB2      GLU  21  16.872 -18.930  -6.788
  882   2HB   GLU  21           HB1      GLU  21  16.129 -18.192  -8.208
  883   1HG   GLU  21           HG2      GLU  21  17.777 -16.650  -8.417
  884   2HG   GLU  21           HG1      GLU  21  17.830 -16.345  -6.680
  885    H    GLY  22           HN       GLY  22  16.636 -19.083  -4.886
  886   1HA   GLY  22           HA2      GLY  22  17.695 -19.119  -2.790
  887   2HA   GLY  22           HA1      GLY  22  17.914 -17.374  -2.946
  888    H    ASP  23           HN       ASP  23  16.273 -15.975  -2.135
  889    HA   ASP  23           HA       ASP  23  14.411 -17.322  -0.230
  890   1HB   ASP  23           HB2      ASP  23  14.305 -14.720   0.511
  891   2HB   ASP  23           HB1      ASP  23  15.492 -15.851   1.153
  892    H    LYS  24           HN       LYS  24  12.605 -17.692  -1.517
  893    HA   LYS  24           HA       LYS  24  11.504 -15.376  -3.032
  894   1HB   LYS  24           HB2      LYS  24  11.749 -17.438  -4.323
  895   2HB   LYS  24           HB1      LYS  24  10.823 -18.333  -3.118
  896   1HG   LYS  24           HG2      LYS  24   8.814 -17.452  -3.799
  897   2HG   LYS  24           HG1      LYS  24   9.532 -15.908  -4.265
  898   1HD   LYS  24           HD2      LYS  24  10.615 -17.092  -6.215
  899   2HD   LYS  24           HD1      LYS  24   9.667 -18.521  -5.796
  900   1HE   LYS  24           HE2      LYS  24   8.374 -15.829  -6.261
  901   2HE   LYS  24           HE1      LYS  24   8.669 -16.964  -7.577
  902   1HZ   LYS  24           HZ2      LYS  24   7.484 -18.645  -6.108
  903   2HZ   LYS  24           HZ1      LYS  24   6.941 -17.311  -5.205
  904   3HZ   LYS  24           HZ3      LYS  24   6.524 -17.451  -6.842
  905    H    HIS  25           HN       HIS  25   9.261 -14.810  -2.748
  906    HA   HIS  25           HA       HIS  25   7.252 -14.560  -1.543
  907   1HB   HIS  25           HB2      HIS  25   7.456 -17.131  -1.360
  908   2HB   HIS  25           HB1      HIS  25   8.115 -16.832   0.248
  909    HD1  HIS  25           HD1      HIS  25   5.902 -17.993   1.207
  910    HD2  HIS  25           HD2      HIS  25   5.290 -14.390  -0.804
  911    HE1  HIS  25           HE1      HIS  25   3.568 -17.216   1.820
  912    H    LYS  26           HN       LYS  26  10.288 -14.007  -0.515
  913    HA   LYS  26           HA       LYS  26   9.300 -12.609   1.921
  914   1HB   LYS  26           HB2      LYS  26  11.178 -13.331   3.238
  915   2HB   LYS  26           HB1      LYS  26  10.464 -14.781   2.532
  916   1HG   LYS  26           HG2      LYS  26  12.171 -14.931   0.868
  917   2HG   LYS  26           HG1      LYS  26  12.762 -13.307   1.228
  918   1HD   LYS  26           HD2      LYS  26  12.720 -15.213   3.505
  919   2HD   LYS  26           HD1      LYS  26  13.906 -15.541   2.241
  920   1HE   LYS  26           HE2      LYS  26  14.425 -12.974   2.443
  921   2HE   LYS  26           HE1      LYS  26  13.661 -13.134   4.024
  922   1HZ   LYS  26           HZ2      LYS  26  15.714 -15.074   3.212
  923   2HZ   LYS  26           HZ1      LYS  26  16.196 -13.537   3.757
  924   3HZ   LYS  26           HZ3      LYS  26  15.283 -14.548   4.769
  925    H    LEU  27           HN       LEU  27  10.263 -10.592   2.237
  926    HA   LEU  27           HA       LEU  27  12.078  -9.698   0.043
  927   1HB   LEU  27           HB2      LEU  27   9.786  -8.521   1.336
  928   2HB   LEU  27           HB1      LEU  27  11.192  -7.486   1.584
  929    HG   LEU  27           HG       LEU  27   9.875  -7.042  -0.548
  930   1HD1  LEU  27          HD11      LEU  27  12.262  -6.366  -0.170
  931   2HD1  LEU  27          HD13      LEU  27  12.764  -7.880  -0.924
  932   3HD1  LEU  27          HD12      LEU  27  11.883  -6.677  -1.865
  933   1HD2  LEU  27          HD21      LEU  27  10.231  -9.847  -0.811
  934   2HD2  LEU  27          HD23      LEU  27   9.471  -8.751  -1.963
  935   3HD2  LEU  27          HD22      LEU  27  11.197  -9.094  -2.081
  936    H    LYS  28           HN       LYS  28  13.168  -7.442   1.268
  937    HA   LYS  28           HA       LYS  28  14.407  -8.324   3.795
  938   1HB   LYS  28           HB2      LYS  28  15.674  -8.711   1.273
  939   2HB   LYS  28           HB1      LYS  28  16.517  -7.391   2.086
  940   1HG   LYS  28           HG2      LYS  28  17.213  -8.725   3.829
  941   2HG   LYS  28           HG1      LYS  28  15.818  -9.798   3.706
  942   1HD   LYS  28           HD2      LYS  28  16.772 -11.073   2.025
  943   2HD   LYS  28           HD1      LYS  28  17.754  -9.735   1.425
  944   1HE   LYS  28           HE2      LYS  28  19.111  -9.889   3.547
  945   2HE   LYS  28           HE1      LYS  28  18.221 -11.363   3.937
  946   1HZ   LYS  28           HZ1      LYS  28  19.471 -11.135   1.294
  947   2HZ   LYS  28           HZ3      LYS  28  20.469 -11.451   2.627
  948   3HZ   LYS  28           HZ2      LYS  28  19.199 -12.515   2.248
  949    H    LYS  29           HN       LYS  29  15.772  -6.515   4.706
  950    HA   LYS  29           HA       LYS  29  14.400  -3.969   4.328
  951   1HB   LYS  29           HB2      LYS  29  16.908  -4.541   5.925
  952   2HB   LYS  29           HB1      LYS  29  15.819  -3.167   6.120
  953   1HG   LYS  29           HG2      LYS  29  14.065  -4.541   6.954
  954   2HG   LYS  29           HG1      LYS  29  14.866  -6.019   6.414
  955   1HD   LYS  29           HD2      LYS  29  16.026  -6.166   8.334
  956   2HD   LYS  29           HD1      LYS  29  16.607  -4.508   8.153
  957   1HE   LYS  29           HE2      LYS  29  15.332  -4.060   9.976
  958   2HE   LYS  29           HE1      LYS  29  13.974  -4.118   8.853
  959   1HZ   LYS  29           HZ3      LYS  29  14.138  -6.661   9.326
  960   2HZ   LYS  29           HZ2      LYS  29  14.906  -6.150  10.752
  961   3HZ   LYS  29           HZ1      LYS  29  13.322  -5.640  10.408
  962    H    SER  30           HN       SER  30  17.365  -5.448   3.236
  963    HA   SER  30           HA       SER  30  18.600  -2.970   2.321
  964   1HB   SER  30           HB2      SER  30  20.346  -4.310   1.553
  965   2HB   SER  30           HB1      SER  30  19.678  -5.334   2.821
  966    HG   SER  30           HG       SER  30  18.563  -6.483   1.260
  967    H    GLU  31           HN       GLU  31  16.594  -5.501   0.835
  968    HA   GLU  31           HA       GLU  31  16.719  -4.160  -1.787
  969   1HB   GLU  31           HB2      GLU  31  16.467  -6.746  -1.271
  970   2HB   GLU  31           HB1      GLU  31  14.758  -6.340  -1.111
  971   1HG   GLU  31           HG2      GLU  31  14.561  -5.702  -3.344
  972   2HG   GLU  31           HG1      GLU  31  16.287  -5.367  -3.505
  973    H    LEU  32           HN       LEU  32  14.848  -4.122   1.093
  974    HA   LEU  32           HA       LEU  32  12.433  -3.020  -0.142
  975   1HB   LEU  32           HB2      LEU  32  12.044  -4.186   1.904
  976   2HB   LEU  32           HB1      LEU  32  13.383  -3.371   2.710
  977    HG   LEU  32           HG       LEU  32  12.191  -1.253   2.666
  978   1HD1  LEU  32          HD11      LEU  32  11.044  -1.902   0.429
  979   2HD1  LEU  32          HD13      LEU  32   9.813  -2.651   1.447
  980   3HD1  LEU  32          HD12      LEU  32  10.128  -0.919   1.572
  981   1HD2  LEU  32          HD21      LEU  32  11.668  -3.028   4.439
  982   2HD2  LEU  32          HD23      LEU  32  10.458  -1.762   4.234
  983   3HD2  LEU  32          HD22      LEU  32  10.194  -3.359   3.531
  984    H    LYS  33           HN       LYS  33  15.390  -1.916   1.358
  985    HA   LYS  33           HA       LYS  33  14.691   0.853   1.685
  986   1HB   LYS  33           HB2      LYS  33  16.742  -0.504   2.585
  987   2HB   LYS  33           HB1      LYS  33  17.482  -0.092   1.039
  988   1HG   LYS  33           HG2      LYS  33  16.162   2.147   2.477
  989   2HG   LYS  33           HG1      LYS  33  17.631   1.514   3.219
  990   1HD   LYS  33           HD2      LYS  33  17.523   2.173   0.277
  991   2HD   LYS  33           HD1      LYS  33  17.907   3.405   1.481
  992   1HE   LYS  33           HE2      LYS  33  19.374   0.809   1.649
  993   2HE   LYS  33           HE1      LYS  33  19.816   1.913   0.345
  994   1HZ   LYS  33           HZ2      LYS  33  19.690   3.601   2.390
  995   2HZ   LYS  33           HZ1      LYS  33  20.171   2.195   3.213
  996   3HZ   LYS  33           HZ3      LYS  33  21.116   2.793   1.937
  997    H    GLU  34           HN       GLU  34  16.245  -0.987  -0.923
  998    HA   GLU  34           HA       GLU  34  16.586   1.301  -2.658
  999   1HB   GLU  34           HB2      GLU  34  17.402  -0.248  -4.232
 1000   2HB   GLU  34           HB1      GLU  34  17.736  -1.063  -2.706
 1001   1HG   GLU  34           HG2      GLU  34  15.812  -2.471  -2.927
 1002   2HG   GLU  34           HG1      GLU  34  15.215  -1.545  -4.299
 1003    H    LEU  35           HN       LEU  35  14.189  -1.248  -2.296
 1004    HA   LEU  35           HA       LEU  35  12.492  -0.828  -4.445
 1005   1HB   LEU  35           HB2      LEU  35  12.343  -2.192  -2.036
 1006   2HB   LEU  35           HB1      LEU  35  11.028  -1.018  -1.906
 1007    HG   LEU  35           HG       LEU  35  10.232  -3.099  -2.962
 1008   1HD1  LEU  35          HD11      LEU  35   9.882  -0.497  -3.904
 1009   2HD1  LEU  35          HD13      LEU  35  10.214  -1.435  -5.360
 1010   3HD1  LEU  35          HD12      LEU  35   8.877  -1.890  -4.305
 1011   1HD2  LEU  35          HD22      LEU  35  12.715  -2.720  -4.490
 1012   2HD2  LEU  35          HD21      LEU  35  11.790  -4.194  -4.198
 1013   3HD2  LEU  35          HD23      LEU  35  11.322  -3.103  -5.503
 1014    H    ILE  36           HN       ILE  36  12.634   1.088  -1.430
 1015    HA   ILE  36           HA       ILE  36  10.526   2.898  -2.341
 1016    HB   ILE  36           HB       ILE  36  12.395   3.751  -0.193
 1017   1HG1  ILE  36          HG12      ILE  36  10.720   1.240  -0.088
 1018   2HG1  ILE  36          HG11      ILE  36  12.385   1.479   0.437
 1019   1HG2  ILE  36          HG23      ILE  36   9.972   4.594  -1.080
 1020   2HG2  ILE  36          HG22      ILE  36   9.466   3.490   0.200
 1021   3HG2  ILE  36          HG21      ILE  36  10.537   4.843   0.572
 1022   1HD1  ILE  36          HD12      ILE  36   9.973   2.774   1.742
 1023   2HD1  ILE  36          HD11      ILE  36  10.793   1.337   2.353
 1024   3HD1  ILE  36          HD13      ILE  36  11.646   2.880   2.292
 1025    H    ASN  37           HN       ASN  37  14.010   3.378  -1.647
 1026    HA   ASN  37           HA       ASN  37  14.036   5.931  -3.021
 1027   1HB   ASN  37           HB2      ASN  37  15.577   5.284  -1.133
 1028   2HB   ASN  37           HB1      ASN  37  16.418   4.223  -2.266
 1029   1HD2  ASN  37          HD22      ASN  37  16.732   8.298  -2.776
 1030   2HD2  ASN  37          HD21      ASN  37  15.404   7.672  -1.924
 1031    H    ASN  38           HN       ASN  38  15.787   2.885  -3.767
 1032    HA   ASN  38           HA       ASN  38  16.706   3.605  -6.307
 1033   1HB   ASN  38           HB2      ASN  38  17.388   1.521  -5.224
 1034   2HB   ASN  38           HB1      ASN  38  15.758   0.872  -5.397
 1035   1HD2  ASN  38          HD22      ASN  38  16.092   0.265  -8.910
 1036   2HD2  ASN  38          HD21      ASN  38  14.961   0.564  -7.681
 1037    H    GLU  39           HN       GLU  39  13.438   2.670  -5.373
 1038    HA   GLU  39           HA       GLU  39  12.661   2.656  -8.247
 1039   1HB   GLU  39           HB2      GLU  39  11.890   1.026  -6.136
 1040   2HB   GLU  39           HB1      GLU  39  10.526   2.131  -6.319
 1041   1HG   GLU  39           HG2      GLU  39   9.855   0.833  -8.037
 1042   2HG   GLU  39           HG1      GLU  39  11.228   1.478  -8.940
 1043    H    LEU  40           HN       LEU  40  10.979   3.795  -5.293
 1044    HA   LEU  40           HA       LEU  40   9.648   5.893  -6.754
 1045   1HB   LEU  40           HB2      LEU  40   9.975   5.471  -3.769
 1046   2HB   LEU  40           HB1      LEU  40   8.840   6.585  -4.524
 1047    HG   LEU  40           HG       LEU  40   8.892   3.580  -4.911
 1048   1HD1  LEU  40          HD11      LEU  40   8.042   4.338  -2.694
 1049   2HD1  LEU  40          HD13      LEU  40   6.867   5.364  -3.517
 1050   3HD1  LEU  40          HD12      LEU  40   6.774   3.610  -3.679
 1051   1HD2  LEU  40          HD22      LEU  40   7.442   5.827  -6.242
 1052   2HD2  LEU  40          HD21      LEU  40   7.983   4.285  -6.910
 1053   3HD2  LEU  40          HD23      LEU  40   6.527   4.353  -5.915
 1054    H    SER  41           HN       SER  41  11.069   6.952  -3.765
 1055    HA   SER  41           HA       SER  41  12.528   8.732  -3.318
 1056   1HB   SER  41           HB2      SER  41  14.070   7.043  -4.506
 1057   2HB   SER  41           HB1      SER  41  13.878   8.054  -5.935
 1058    HG   SER  41           HG       SER  41  14.423   9.790  -4.216
 1059    H    HIS  42           HN       HIS  42  10.177   8.942  -5.382
 1060    HA   HIS  42           HA       HIS  42  11.069  11.242  -6.992
 1061   1HB   HIS  42           HB2      HIS  42   8.769   9.426  -6.952
 1062   2HB   HIS  42           HB1      HIS  42   8.305  11.109  -7.207
 1063    HD1  HIS  42           HD1      HIS  42  10.678   8.495  -8.631
 1064    HD2  HIS  42           HD2      HIS  42   8.853  12.069  -9.763
 1065    HE1  HIS  42           HE1      HIS  42  11.225   8.833 -11.080
 1066    H    PHE  43           HN       PHE  43   8.419  10.747  -4.613
 1067    HA   PHE  43           HA       PHE  43   7.988  13.545  -4.193
 1068   1HB   PHE  43           HB2      PHE  43   7.454  11.238  -2.290
 1069   2HB   PHE  43           HB1      PHE  43   6.740  12.848  -2.185
 1070    HD1  PHE  43           HD2      PHE  43   6.062  13.522  -4.917
 1071    HD2  PHE  43           HD1      PHE  43   5.779   9.733  -2.913
 1072    HE1  PHE  43           HE2      PHE  43   4.273  12.824  -6.485
 1073    HE2  PHE  43           HE1      PHE  43   3.990   9.035  -4.481
 1074    HZ   PHE  43           HZ       PHE  43   3.237  10.580  -6.268
 1075    H    LEU  44           HN       LEU  44   8.608  12.133  -1.142
 1076    HA   LEU  44           HA       LEU  44  10.079  12.915   0.528
 1077   1HB   LEU  44           HB2      LEU  44  11.320  11.219  -1.306
 1078   2HB   LEU  44           HB1      LEU  44  12.457  12.555  -1.122
 1079    HG   LEU  44           HG       LEU  44  11.640  12.105   1.477
 1080   1HD1  LEU  44          HD13      LEU  44  10.473  10.032   0.685
 1081   2HD1  LEU  44          HD12      LEU  44  12.030   9.412   0.134
 1082   3HD1  LEU  44          HD11      LEU  44  11.752   9.702   1.852
 1083   1HD2  LEU  44          HD22      LEU  44  14.002  11.176  -0.158
 1084   2HD2  LEU  44          HD21      LEU  44  13.925  12.490   1.016
 1085   3HD2  LEU  44          HD23      LEU  44  13.896  10.814   1.566
 1086    H    GLU  45           HN       GLU  45   9.670  15.162   0.627
 1087    HA   GLU  45           HA       GLU  45  11.521  16.864  -0.997
 1088   1HB   GLU  45           HB2      GLU  45   8.876  17.602   0.298
 1089   2HB   GLU  45           HB1      GLU  45   9.904  18.697  -0.631
 1090   1HG   GLU  45           HG2      GLU  45   9.484  16.325  -2.180
 1091   2HG   GLU  45           HG1      GLU  45   7.916  16.900  -1.609
 1092    H    GLU  46           HN       GLU  46   9.698  17.605   1.953
 1093    HA   GLU  46           HA       GLU  46  12.294  18.233   3.269
 1094   1HB   GLU  46           HB2      GLU  46  11.172  20.258   3.318
 1095   2HB   GLU  46           HB1      GLU  46   9.583  19.496   3.288
 1096   1HG   GLU  46           HG2      GLU  46   9.502  19.253   5.562
 1097   2HG   GLU  46           HG1      GLU  46  11.246  19.039   5.706
 1098    H    ILE  47           HN       ILE  47   9.512  16.226   3.281
 1099    HA   ILE  47           HA       ILE  47   9.030  14.348   4.605
 1100    HB   ILE  47           HB       ILE  47  11.377  15.107   6.352
 1101   1HG1  ILE  47          HG12      ILE  47  11.504  13.295   3.932
 1102   2HG1  ILE  47          HG11      ILE  47  11.909  15.008   3.832
 1103   1HG2  ILE  47          HG22      ILE  47   9.549  12.823   6.049
 1104   2HG2  ILE  47          HG21      ILE  47  11.253  12.364   6.065
 1105   3HG2  ILE  47          HG23      ILE  47  10.569  13.272   7.415
 1106   1HD1  ILE  47          HD12      ILE  47  13.168  13.406   6.015
 1107   2HD1  ILE  47          HD11      ILE  47  13.768  13.173   4.373
 1108   3HD1  ILE  47          HD13      ILE  47  13.817  14.775   5.110
 1109    H    LYS  48           HN       LYS  48   7.106  15.063   5.488
 1110    HA   LYS  48           HA       LYS  48   7.157  16.949   7.764
 1111   1HB   LYS  48           HB2      LYS  48   5.390  17.283   6.141
 1112   2HB   LYS  48           HB1      LYS  48   4.888  15.596   6.274
 1113   1HG   LYS  48           HG2      LYS  48   4.016  15.898   8.441
 1114   2HG   LYS  48           HG1      LYS  48   4.927  17.388   8.696
 1115   1HD   LYS  48           HD2      LYS  48   3.368  17.872   6.414
 1116   2HD   LYS  48           HD1      LYS  48   2.291  17.036   7.535
 1117   1HE   LYS  48           HE2      LYS  48   2.125  19.390   8.021
 1118   2HE   LYS  48           HE1      LYS  48   3.055  18.655   9.325
 1119   1HZ   LYS  48           HZ2      LYS  48   4.897  19.310   7.392
 1120   2HZ   LYS  48           HZ1      LYS  48   3.848  20.646   7.458
 1121   3HZ   LYS  48           HZ3      LYS  48   4.636  20.120   8.863
 1122    H    GLU  49           HN       GLU  49   6.198  13.585   7.070
 1123    HA   GLU  49           HA       GLU  49   5.677  13.062   9.915
 1124   1HB   GLU  49           HB2      GLU  49   5.376  11.571   7.355
 1125   2HB   GLU  49           HB1      GLU  49   5.698  10.599   8.789
 1126   1HG   GLU  49           HG2      GLU  49   3.548  12.726   8.736
 1127   2HG   GLU  49           HG1      GLU  49   3.232  11.048   8.286
 1128    H    GLN  50           HN       GLN  50   8.020  13.838  10.327
 1129    HA   GLN  50           HA       GLN  50  10.316  12.447   9.533
 1130   1HB   GLN  50           HB2      GLN  50  10.017  14.507  11.130
 1131   2HB   GLN  50           HB1      GLN  50   9.982  13.285  12.402
 1132   1HG   GLN  50           HG2      GLN  50  12.209  12.940  12.253
 1133   2HG   GLN  50           HG1      GLN  50  12.140  12.806  10.497
 1134   1HE2  GLN  50          HE22      GLN  50  12.580  16.599  12.054
 1135   2HE2  GLN  50          HE21      GLN  50  11.629  15.470  12.895
 1136    H    GLU  51           HN       GLU  51   7.749  11.397  11.639
 1137    HA   GLU  51           HA       GLU  51   9.303   9.235  12.843
 1138   1HB   GLU  51           HB2      GLU  51   6.833  10.488  13.369
 1139   2HB   GLU  51           HB1      GLU  51   6.443   8.817  12.958
 1140   1HG   GLU  51           HG2      GLU  51   8.208   8.073  14.585
 1141   2HG   GLU  51           HG1      GLU  51   8.391   9.757  15.079
 1142    H    VAL  52           HN       VAL  52   7.008   9.554  10.158
 1143    HA   VAL  52           HA       VAL  52   6.823   6.705   9.690
 1144    HB   VAL  52           HB       VAL  52   6.329   8.971   7.734
 1145   1HG1  VAL  52          HG11      VAL  52   6.315   6.180   7.407
 1146   2HG1  VAL  52          HG13      VAL  52   4.617   6.634   7.561
 1147   3HG1  VAL  52          HG12      VAL  52   5.620   7.376   6.312
 1148   1HG2  VAL  52          HG23      VAL  52   5.108   8.906  10.074
 1149   2HG2  VAL  52          HG22      VAL  52   4.182   9.208   8.606
 1150   3HG2  VAL  52          HG21      VAL  52   4.186   7.599   9.329
 1151    H    VAL  53           HN       VAL  53   8.807   9.309   8.278
 1152    HA   VAL  53           HA       VAL  53  10.140   7.446   6.469
 1153    HB   VAL  53           HB       VAL  53  10.794  10.304   7.254
 1154   1HG1  VAL  53          HG12      VAL  53  12.068   8.366   5.330
 1155   2HG1  VAL  53          HG11      VAL  53  12.128  10.103   5.022
 1156   3HG1  VAL  53          HG13      VAL  53  12.845   9.443   6.491
 1157   1HG2  VAL  53          HG21      VAL  53   8.814   9.171   5.549
 1158   2HG2  VAL  53          HG23      VAL  53   9.224  10.877   5.746
 1159   3HG2  VAL  53          HG22      VAL  53  10.036   9.911   4.512
 1160    H    ASP  54           HN       ASP  54  10.799   8.850   9.643
 1161    HA   ASP  54           HA       ASP  54  13.519   7.773   9.701
 1162   1HB   ASP  54           HB2      ASP  54  11.760   8.877  11.916
 1163   2HB   ASP  54           HB1      ASP  54  13.452   8.426  12.109
 1164    H    LYS  55           HN       LYS  55  10.328   6.624  10.370
 1165    HA   LYS  55           HA       LYS  55  11.201   4.477  12.146
 1166   1HB   LYS  55           HB2      LYS  55   8.923   5.403  12.331
 1167   2HB   LYS  55           HB1      LYS  55   8.578   4.887  10.679
 1168   1HG   LYS  55           HG2      LYS  55   7.755   3.310  12.492
 1169   2HG   LYS  55           HG1      LYS  55   8.790   2.569  11.269
 1170   1HD   LYS  55           HD2      LYS  55  10.680   2.576  12.715
 1171   2HD   LYS  55           HD1      LYS  55   9.894   3.669  13.855
 1172   1HE   LYS  55           HE2      LYS  55   9.717   1.512  14.848
 1173   2HE   LYS  55           HE1      LYS  55   8.127   1.832  14.159
 1174   1HZ   LYS  55           HZ1      LYS  55   9.547   0.694  12.121
 1175   2HZ   LYS  55           HZ3      LYS  55  10.018  -0.197  13.484
 1176   3HZ   LYS  55           HZ2      LYS  55   8.373  -0.075  13.078
 1177    H    VAL  56           HN       VAL  56  10.071   4.672   8.750
 1178    HA   VAL  56           HA       VAL  56  10.614   1.856   8.313
 1179    HB   VAL  56           HB       VAL  56  10.341   2.546   5.871
 1180   1HG1  VAL  56          HG11      VAL  56   8.513   1.675   7.363
 1181   2HG1  VAL  56          HG13      VAL  56   8.108   3.346   7.758
 1182   3HG1  VAL  56          HG12      VAL  56   7.932   2.763   6.103
 1183   1HG2  VAL  56          HG21      VAL  56  10.621   5.130   7.065
 1184   2HG2  VAL  56          HG23      VAL  56  10.401   4.735   5.363
 1185   3HG2  VAL  56          HG22      VAL  56   8.997   5.006   6.394
 1186    H    MET  57           HN       MET  57  12.330   4.876   7.699
 1187    HA   MET  57           HA       MET  57  14.517   3.620   6.260
 1188   1HB   MET  57           HB2      MET  57  13.878   6.071   6.133
 1189   2HB   MET  57           HB1      MET  57  14.532   6.253   7.761
 1190   1HG   MET  57           HG2      MET  57  16.177   6.860   5.970
 1191   2HG   MET  57           HG1      MET  57  16.735   5.549   7.007
 1192   1HE   MET  57           HE3      MET  57  14.742   6.570   4.194
 1193   2HE   MET  57           HE2      MET  57  15.747   6.058   2.841
 1194   3HE   MET  57           HE1      MET  57  14.350   5.090   3.308
 1195    H    GLU  58           HN       GLU  58  13.702   4.064   9.625
 1196    HA   GLU  58           HA       GLU  58  16.447   3.664  10.567
 1197   1HB   GLU  58           HB2      GLU  58  13.749   3.840  11.867
 1198   2HB   GLU  58           HB1      GLU  58  15.065   3.086  12.762
 1199   1HG   GLU  58           HG2      GLU  58  16.454   5.077  12.478
 1200   2HG   GLU  58           HG1      GLU  58  15.205   5.836  11.492
 1201    H    THR  59           HN       THR  59  13.499   1.627  10.367
 1202    HA   THR  59           HA       THR  59  14.822  -0.752  11.329
 1203    HB   THR  59           HB       THR  59  12.502  -0.772   9.395
 1204    HG1  THR  59           HG1      THR  59  11.171  -0.414  11.200
 1205   1HG2  THR  59          HG23      THR  59  13.823  -2.789  10.649
 1206   2HG2  THR  59          HG22      THR  59  12.575  -2.432  11.843
 1207   3HG2  THR  59          HG21      THR  59  12.120  -2.872  10.198
 1208    H    LEU  60           HN       LEU  60  14.784   0.961   8.355
 1209    HA   LEU  60           HA       LEU  60  15.602  -1.223   6.623
 1210   1HB   LEU  60           HB2      LEU  60  15.351   1.754   6.440
 1211   2HB   LEU  60           HB1      LEU  60  16.384   0.953   5.262
 1212    HG   LEU  60           HG       LEU  60  13.499   0.225   5.838
 1213   1HD1  LEU  60          HD13      LEU  60  14.839   1.967   3.799
 1214   2HD1  LEU  60          HD12      LEU  60  13.424   1.031   3.315
 1215   3HD1  LEU  60          HD11      LEU  60  13.299   2.198   4.630
 1216   1HD2  LEU  60          HD21      LEU  60  15.633  -1.228   4.616
 1217   2HD2  LEU  60          HD23      LEU  60  13.932  -1.684   4.724
 1218   3HD2  LEU  60          HD22      LEU  60  14.510  -0.753   3.343
 1219    H    ASP  61           HN       ASP  61  17.336   1.649   7.844
 1220    HA   ASP  61           HA       ASP  61  19.941   0.523   7.199
 1221   1HB   ASP  61           HB2      ASP  61  18.880   3.075   7.891
 1222   2HB   ASP  61           HB1      ASP  61  20.105   2.677   9.095
 1223    H    GLU  62           HN       GLU  62  17.756  -0.070   9.664
 1224    HA   GLU  62           HA       GLU  62  19.677  -0.330  11.847
 1225   1HB   GLU  62           HB2      GLU  62  17.398   0.171  12.454
 1226   2HB   GLU  62           HB1      GLU  62  16.797  -1.211  11.534
 1227   1HG   GLU  62           HG2      GLU  62  17.920  -2.762  13.043
 1228   2HG   GLU  62           HG1      GLU  62  18.658  -1.419  13.917
 1229    H    ASP  63           HN       ASP  63  17.740  -2.654   9.953
 1230    HA   ASP  63           HA       ASP  63  19.917  -4.647  10.433
 1231   1HB   ASP  63           HB2      ASP  63  17.347  -4.799  11.469
 1232   2HB   ASP  63           HB1      ASP  63  17.257  -5.803  10.022
 1233    H    GLY  64           HN       GLY  64  19.943  -3.082   8.140
 1234   1HA   GLY  64           HA2      GLY  64  18.565  -3.737   5.869
 1235   2HA   GLY  64           HA1      GLY  64  20.314  -3.520   5.843
 1236    H    ASP  65           HN       ASP  65  20.730  -5.845   7.650
 1237    HA   ASP  65           HA       ASP  65  20.556  -7.939   5.561
 1238   1HB   ASP  65           HB2      ASP  65  22.708  -7.505   6.780
 1239   2HB   ASP  65           HB1      ASP  65  21.920  -8.037   8.267
 1240    H    GLY  66           HN       GLY  66  18.070  -7.252   6.722
 1241   1HA   GLY  66           HA2      GLY  66  17.514  -9.665   8.385
 1242   2HA   GLY  66           HA1      GLY  66  16.652  -8.144   8.608
 1243    H    GLU  67           HN       GLU  67  15.008 -10.207   8.164
 1244    HA   GLU  67           HA       GLU  67  14.378 -10.085   5.242
 1245   1HB   GLU  67           HB2      GLU  67  13.065 -12.217   5.724
 1246   2HB   GLU  67           HB1      GLU  67  14.820 -12.361   5.831
 1247   1HG   GLU  67           HG2      GLU  67  14.797 -12.622   8.112
 1248   2HG   GLU  67           HG1      GLU  67  13.388 -11.581   8.322
 1249    H    CYS  68           HN       CYS  68  12.149  -9.850   4.656
 1250    HA   CYS  68           HA       CYS  68  10.344  -8.937   6.857
 1251   1HB   CYS  68           HB2      CYS  68  11.490  -7.288   4.882
 1252   2HB   CYS  68           HB1      CYS  68   9.826  -7.557   4.362
 1253    HG   CYS  68           HG       CYS  68   9.052  -6.705   6.764
 1254    H    ASP  69           HN       ASP  69   8.051  -8.514   5.470
 1255    HA   ASP  69           HA       ASP  69   7.607 -11.102   4.027
 1256   1HB   ASP  69           HB2      ASP  69   5.758  -9.640   5.937
 1257   2HB   ASP  69           HB1      ASP  69   5.291 -11.045   4.978
 1258    H    PHE  70           HN       PHE  70   5.426 -10.903   2.725
 1259    HA   PHE  70           HA       PHE  70   5.785  -8.701   0.874
 1260   1HB   PHE  70           HB2      PHE  70   3.537  -9.639  -0.046
 1261   2HB   PHE  70           HB1      PHE  70   4.967 -10.666  -0.140
 1262    HD1  PHE  70           HD2      PHE  70   1.854 -10.000   1.778
 1263    HD2  PHE  70           HD1      PHE  70   5.132 -12.700   1.119
 1264    HE1  PHE  70           HE2      PHE  70   0.703 -11.728   3.135
 1265    HE2  PHE  70           HE1      PHE  70   3.981 -14.427   2.477
 1266    HZ   PHE  70           HZ       PHE  70   1.766 -13.941   3.485
 1267    H    GLN  71           HN       GLN  71   3.618  -9.363   3.575
 1268    HA   GLN  71           HA       GLN  71   1.905  -7.064   2.981
 1269   1HB   GLN  71           HB2      GLN  71   0.619  -7.740   4.810
 1270   2HB   GLN  71           HB1      GLN  71   1.333  -9.271   4.306
 1271   1HG   GLN  71           HG2      GLN  71   1.892  -9.393   6.525
 1272   2HG   GLN  71           HG1      GLN  71   3.263  -8.416   5.995
 1273   1HE2  GLN  71          HE22      GLN  71   0.162  -6.238   7.603
 1274   2HE2  GLN  71          HE21      GLN  71  -0.178  -7.452   6.466
 1275    H    GLU  72           HN       GLU  72   4.758  -7.726   4.920
 1276    HA   GLU  72           HA       GLU  72   4.609  -5.282   6.480
 1277   1HB   GLU  72           HB2      GLU  72   6.599  -7.450   6.011
 1278   2HB   GLU  72           HB1      GLU  72   7.247  -5.893   6.526
 1279   1HG   GLU  72           HG2      GLU  72   4.937  -6.430   8.111
 1280   2HG   GLU  72           HG1      GLU  72   5.940  -7.881   8.119
 1281    H    PHE  73           HN       PHE  73   6.751  -6.256   3.778
 1282    HA   PHE  73           HA       PHE  73   7.816  -3.670   3.286
 1283   1HB   PHE  73           HB2      PHE  73   9.027  -4.980   1.886
 1284   2HB   PHE  73           HB1      PHE  73   7.847  -6.277   2.020
 1285    HD1  PHE  73           HD1      PHE  73   5.798  -6.231   0.511
 1286    HD2  PHE  73           HD2      PHE  73   9.185  -3.649  -0.080
 1287    HE1  PHE  73           HE1      PHE  73   5.068  -5.801  -1.820
 1288    HE2  PHE  73           HE2      PHE  73   8.452  -3.222  -2.410
 1289    HZ   PHE  73           HZ       PHE  73   6.396  -4.298  -3.278
 1290    H    MET  74           HN       MET  74   4.743  -5.097   2.545
 1291    HA   MET  74           HA       MET  74   3.949  -3.281   0.452
 1292   1HB   MET  74           HB2      MET  74   2.656  -5.312   2.188
 1293   2HB   MET  74           HB1      MET  74   1.591  -4.044   1.587
 1294   1HG   MET  74           HG2      MET  74   3.383  -5.029  -0.492
 1295   2HG   MET  74           HG1      MET  74   2.386  -6.319   0.185
 1296   1HE   MET  74           HE1      MET  74   2.908  -3.251  -1.492
 1297   2HE   MET  74           HE3      MET  74   2.123  -3.961  -2.908
 1298   3HE   MET  74           HE2      MET  74   1.385  -2.591  -2.081
 1299    H    ALA  75           HN       ALA  75   3.094  -3.387   3.930
 1300    HA   ALA  75           HA       ALA  75   1.808  -0.805   3.872
 1301   1HB   ALA  75           HB1      ALA  75   1.411  -2.594   5.607
 1302   2HB   ALA  75           HB3      ALA  75   3.005  -2.230   6.267
 1303   3HB   ALA  75           HB2      ALA  75   1.740  -1.000   6.289
 1304    H    PHE  76           HN       PHE  76   5.075  -1.805   3.912
 1305    HA   PHE  76           HA       PHE  76   6.140   0.578   5.238
 1306   1HB   PHE  76           HB2      PHE  76   7.191  -1.913   4.078
 1307   2HB   PHE  76           HB1      PHE  76   8.219  -0.511   3.777
 1308    HD1  PHE  76           HD1      PHE  76   6.321  -2.205   6.536
 1309    HD2  PHE  76           HD2      PHE  76   9.694   0.220   5.435
 1310    HE1  PHE  76           HE1      PHE  76   7.166  -2.326   8.863
 1311    HE2  PHE  76           HE2      PHE  76  10.540   0.098   7.761
 1312    HZ   PHE  76           HZ       PHE  76   9.277  -1.173   9.476
 1313    H    VAL  77           HN       VAL  77   5.655  -0.556   1.917
 1314    HA   VAL  77           HA       VAL  77   7.008   1.692   0.679
 1315    HB   VAL  77           HB       VAL  77   4.936  -0.224  -0.439
 1316   1HG1  VAL  77          HG11      VAL  77   5.693   2.139  -1.545
 1317   2HG1  VAL  77          HG13      VAL  77   6.968   1.087  -2.165
 1318   3HG1  VAL  77          HG12      VAL  77   5.276   0.715  -2.499
 1319   1HG2  VAL  77          HG23      VAL  77   7.311  -0.982   0.513
 1320   2HG2  VAL  77          HG22      VAL  77   6.670  -1.661  -0.983
 1321   3HG2  VAL  77          HG21      VAL  77   7.866  -0.365  -1.043
 1322    H    SER  78           HN       SER  78   3.768   1.124   1.877
 1323    HA   SER  78           HA       SER  78   2.578   3.337   0.403
 1324   1HB   SER  78           HB2      SER  78   1.542   1.907   2.866
 1325   2HB   SER  78           HB1      SER  78   0.604   2.918   1.771
 1326    HG   SER  78           HG       SER  78   0.354   1.201   0.602
 1327    H    MET  79           HN       MET  79   3.495   2.878   3.842
 1328    HA   MET  79           HA       MET  79   2.769   5.418   4.779
 1329   1HB   MET  79           HB2      MET  79   5.179   3.782   5.601
 1330   2HB   MET  79           HB1      MET  79   4.413   5.051   6.551
 1331   1HG   MET  79           HG2      MET  79   2.346   3.276   5.785
 1332   2HG   MET  79           HG1      MET  79   3.680   2.274   6.354
 1333   1HE   MET  79           HE3      MET  79   5.157   3.101   8.005
 1334   2HE   MET  79           HE2      MET  79   4.845   4.308   9.250
 1335   3HE   MET  79           HE1      MET  79   4.417   2.623   9.539
 1336    H    VAL  80           HN       VAL  80   5.900   4.432   3.346
 1337    HA   VAL  80           HA       VAL  80   7.145   6.980   3.625
 1338    HB   VAL  80           HB       VAL  80   8.569   6.112   1.658
 1339   1HG1  VAL  80          HG11      VAL  80   9.039   5.887   4.145
 1340   2HG1  VAL  80          HG13      VAL  80   8.309   4.283   4.057
 1341   3HG1  VAL  80          HG12      VAL  80   9.769   4.640   3.131
 1342   1HG2  VAL  80          HG22      VAL  80   6.373   4.294   1.554
 1343   2HG2  VAL  80          HG21      VAL  80   7.821   4.301   0.547
 1344   3HG2  VAL  80          HG23      VAL  80   7.797   3.379   2.049
 1345    H    THR  81           HN       THR  81   5.180   5.626   0.967
 1346    HA   THR  81           HA       THR  81   5.585   7.901  -0.769
 1347    HB   THR  81           HB       THR  81   3.050   6.337  -0.942
 1348    HG1  THR  81           HG1      THR  81   4.018   4.491  -1.278
 1349   1HG2  THR  81          HG21      THR  81   5.142   7.453  -2.796
 1350   2HG2  THR  81          HG23      THR  81   3.996   6.238  -3.364
 1351   3HG2  THR  81          HG22      THR  81   3.410   7.786  -2.753
 1352    H    THR  82           HN       THR  82   3.865   7.539   2.121
 1353    HA   THR  82           HA       THR  82   2.084   9.834   1.412
 1354    HB   THR  82           HB       THR  82   1.019   8.960   3.725
 1355    HG1  THR  82           HG1      THR  82   1.102   6.528   3.221
 1356   1HG2  THR  82          HG22      THR  82   0.148   9.129   1.238
 1357   2HG2  THR  82          HG21      THR  82   0.371   7.378   1.265
 1358   3HG2  THR  82          HG23      THR  82  -0.720   8.147   2.420
 1359    H    ALA  83           HN       ALA  83   4.952   9.174   2.907
 1360    HA   ALA  83           HA       ALA  83   4.564  10.948   5.229
 1361   1HB   ALA  83           HB3      ALA  83   6.377   8.887   4.554
 1362   2HB   ALA  83           HB2      ALA  83   7.333  10.368   4.639
 1363   3HB   ALA  83           HB1      ALA  83   6.367   9.859   6.026
 1364    H    CYS  84           HN       CYS  84   4.211  12.013   2.468
 1365    HA   CYS  84           HA       CYS  84   6.314  14.133   2.601
 1366   1HB   CYS  84           HB2      CYS  84   5.021  13.244   0.023
 1367   2HB   CYS  84           HB1      CYS  84   6.504  14.176   0.242
 1368    HG   CYS  84           HG       CYS  84   6.755  11.418  -0.216
 1369    H    HIS  85           HN       HIS  85   5.389  16.024   0.986
 1370    HA   HIS  85           HA       HIS  85   2.682  16.632   2.088
 1371   1HB   HIS  85           HB2      HIS  85   4.362  18.710   0.739
 1372   2HB   HIS  85           HB1      HIS  85   3.257  18.878   2.103
 1373    HD1  HIS  85           HD1      HIS  85   6.775  17.902   1.237
 1374    HD2  HIS  85           HD2      HIS  85   4.399  18.271   4.644
 1375    HE1  HIS  85           HE1      HIS  85   8.338  17.727   3.219
 1376    H    GLU  86           HN       GLU  86   4.599  16.808  -0.916
 1377    HA   GLU  86           HA       GLU  86   2.057  17.190  -2.426
 1378   1HB   GLU  86           HB2      GLU  86   4.957  17.731  -3.027
 1379   2HB   GLU  86           HB1      GLU  86   3.811  17.531  -4.352
 1380   1HG   GLU  86           HG2      GLU  86   3.301  19.715  -4.072
 1381   2HG   GLU  86           HG1      GLU  86   2.487  19.230  -2.584
 1382    H    PHE  87           HN       PHE  87   1.476  14.889  -2.104
 1383    HA   PHE  87           HA       PHE  87   3.160  13.020  -3.713
 1384   1HB   PHE  87           HB2      PHE  87   1.619  11.278  -2.543
 1385   2HB   PHE  87           HB1      PHE  87   2.884  12.053  -1.587
 1386    HD1  PHE  87           HD2      PHE  87  -0.735  12.236  -2.460
 1387    HD2  PHE  87           HD1      PHE  87   2.350  13.388   0.297
 1388    HE1  PHE  87           HE2      PHE  87  -2.453  13.115  -0.902
 1389    HE2  PHE  87           HE1      PHE  87   0.627  14.267   1.853
 1390    HZ   PHE  87           HZ       PHE  87  -1.775  14.131   1.251
 1391    H    PHE  88           HN       PHE  88   0.364  14.879  -3.930
 1392    HA   PHE  88           HA       PHE  88  -1.010  12.946  -5.716
 1393   1HB   PHE  88           HB2      PHE  88  -1.811  15.596  -4.503
 1394   2HB   PHE  88           HB1      PHE  88  -2.731  14.867  -5.814
 1395    HD1  PHE  88           HD1      PHE  88  -1.967  11.925  -4.673
 1396    HD2  PHE  88           HD2      PHE  88  -3.822  15.454  -3.058
 1397    HE1  PHE  88           HE1      PHE  88  -3.195  10.532  -3.036
 1398    HE2  PHE  88           HE2      PHE  88  -5.047  14.052  -1.420
 1399    HZ   PHE  88           HZ       PHE  88  -4.735  11.594  -1.410
 1400    H    GLU  89           HN       GLU  89  -0.282  16.425  -5.812
 1401    HA   GLU  89           HA       GLU  89   1.295  16.355  -8.162
 1402   1HB   GLU  89           HB2      GLU  89  -1.509  15.963  -8.561
 1403   2HB   GLU  89           HB1      GLU  89  -1.042  17.515  -9.256
 1404   1HG   GLU  89           HG2      GLU  89   0.938  15.463  -9.840
 1405   2HG   GLU  89           HG1      GLU  89  -0.658  14.996 -10.427
 1406    H    HIS  90           HN       HIS  90  -1.505  18.411  -7.349
 1407    HA   HIS  90           HA       HIS  90   0.001  20.841  -7.665
 1408   1HB   HIS  90           HB2      HIS  90  -1.972  21.971  -7.021
 1409   2HB   HIS  90           HB1      HIS  90  -2.561  20.497  -7.787
 1410    HD1  HIS  90           HD1      HIS  90  -2.572  18.411  -5.734
 1411    HD2  HIS  90           HD2      HIS  90  -3.415  22.363  -4.713
 1412    HE1  HIS  90           HE1      HIS  90  -3.858  18.328  -3.553
 1413    H    GLU  91           HN       GLU  91  -0.643  22.371  -5.412
 1414    HA   GLU  91           HA       GLU  91   1.123  21.105  -3.362
 1415   1HB   GLU  91           HB2      GLU  91   0.727  23.935  -4.289
 1416   2HB   GLU  91           HB1      GLU  91   1.271  23.641  -2.637
 1417   1HG   GLU  91           HG2      GLU  91   3.181  22.367  -3.439
 1418   2HG   GLU  91           HG1      GLU  91   2.606  22.479  -5.100
   
  No H/Q in entry =        1418
  Start of MODEL    6
    1   1H    MET   0           HT1      MET   0  10.913   5.428 -14.335
    2   2H    MET   0           HT3      MET   0   9.867   6.257 -15.383
    3   3H    MET   0           HT2      MET   0   9.235   5.372 -14.079
    4    HA   MET   0           HA       MET   0   8.914   4.153 -16.126
    5   1HB   MET   0           HB2      MET   0  11.880   4.646 -16.332
    6   2HB   MET   0           HB1      MET   0  11.136   3.271 -17.149
    7   1HG   MET   0           HG2      MET   0   9.488   5.517 -17.679
    8   2HG   MET   0           HG1      MET   0  11.152   6.033 -17.948
    9   1HE   MET   0           HE3      MET   0  12.772   4.929 -18.958
   10   2HE   MET   0           HE2      MET   0  12.692   3.265 -19.526
   11   3HE   MET   0           HE1      MET   0  12.552   4.588 -20.680
   12    H    SER   1           HN       SER   1   8.638   3.435 -13.574
   13    HA   SER   1           HA       SER   1  10.092   0.837 -13.436
   14   1HB   SER   1           HB2      SER   1  10.365   1.096 -11.013
   15   2HB   SER   1           HB1      SER   1  11.152   2.430 -11.849
   16    HG   SER   1           HG       SER   1   9.944   3.390 -10.312
   17    H    GLU   2           HN       GLU   2   8.946  -0.606 -11.729
   18    HA   GLU   2           HA       GLU   2   6.107  -0.676 -12.425
   19   1HB   GLU   2           HB2      GLU   2   7.676  -2.412 -10.504
   20   2HB   GLU   2           HB1      GLU   2   6.081  -2.770 -11.163
   21   1HG   GLU   2           HG2      GLU   2   8.711  -2.625 -12.638
   22   2HG   GLU   2           HG1      GLU   2   7.637  -4.013 -12.477
   23    H    LEU   3           HN       LEU   3   8.059   0.049  -9.566
   24    HA   LEU   3           HA       LEU   3   5.771   0.255  -7.786
   25   1HB   LEU   3           HB2      LEU   3   8.319  -0.163  -7.260
   26   2HB   LEU   3           HB1      LEU   3   8.394   1.598  -7.230
   27    HG   LEU   3           HG       LEU   3   6.341   1.461  -5.663
   28   1HD1  LEU   3          HD12      LEU   3   7.323  -1.393  -5.712
   29   2HD1  LEU   3          HD11      LEU   3   6.477  -0.737  -4.311
   30   3HD1  LEU   3          HD13      LEU   3   5.671  -0.799  -5.878
   31   1HD2  LEU   3          HD21      LEU   3   9.205   1.019  -5.151
   32   2HD2  LEU   3          HD23      LEU   3   8.094   2.159  -4.394
   33   3HD2  LEU   3          HD22      LEU   3   8.164   0.489  -3.832
   34    H    GLU   4           HN       GLU   4   7.930   2.668  -9.303
   35    HA   GLU   4           HA       GLU   4   6.644   4.956  -8.254
   36   1HB   GLU   4           HB2      GLU   4   8.755   5.197  -9.383
   37   2HB   GLU   4           HB1      GLU   4   8.092   4.535 -10.878
   38   1HG   GLU   4           HG2      GLU   4   6.522   6.792  -9.932
   39   2HG   GLU   4           HG1      GLU   4   8.210   7.238 -10.179
   40    H    LYS   5           HN       LYS   5   5.826   3.022 -11.125
   41    HA   LYS   5           HA       LYS   5   3.717   4.887 -11.916
   42   1HB   LYS   5           HB2      LYS   5   4.714   2.236 -12.902
   43   2HB   LYS   5           HB1      LYS   5   3.124   2.798 -13.417
   44   1HG   LYS   5           HG2      LYS   5   3.981   4.545 -14.638
   45   2HG   LYS   5           HG1      LYS   5   5.358   4.761 -13.556
   46   1HD   LYS   5           HD2      LYS   5   6.588   3.692 -15.120
   47   2HD   LYS   5           HD1      LYS   5   5.751   2.221 -14.627
   48   1HE   LYS   5           HE2      LYS   5   3.925   3.458 -16.313
   49   2HE   LYS   5           HE1      LYS   5   5.476   3.772 -17.091
   50   1HZ   LYS   5           HZ1      LYS   5   4.647   1.092 -16.137
   51   2HZ   LYS   5           HZ3      LYS   5   4.383   1.633 -17.723
   52   3HZ   LYS   5           HZ2      LYS   5   5.968   1.475 -17.133
   53    H    ALA   6           HN       ALA   6   3.704   1.522 -10.681
   54    HA   ALA   6           HA       ALA   6   0.855   1.434 -10.349
   55   1HB   ALA   6           HB1      ALA   6   3.018  -0.175  -8.962
   56   2HB   ALA   6           HB3      ALA   6   1.302  -0.579  -8.985
   57   3HB   ALA   6           HB2      ALA   6   2.231  -0.599 -10.482
   58    H    MET   7           HN       MET   7   3.402   1.696  -7.847
   59    HA   MET   7           HA       MET   7   1.762   2.135  -5.632
   60   1HB   MET   7           HB2      MET   7   4.224   1.865  -5.505
   61   2HB   MET   7           HB1      MET   7   4.424   3.477  -6.196
   62   1HG   MET   7           HG2      MET   7   4.591   3.447  -3.695
   63   2HG   MET   7           HG1      MET   7   3.306   4.490  -4.298
   64   1HE   MET   7           HE1      MET   7   3.674   3.744  -1.597
   65   2HE   MET   7           HE3      MET   7   1.980   4.246  -1.632
   66   3HE   MET   7           HE2      MET   7   2.437   2.734  -0.854
   67    H    VAL   8           HN       VAL   8   3.248   4.680  -7.651
   68    HA   VAL   8           HA       VAL   8   1.872   6.828  -6.388
   69    HB   VAL   8           HB       VAL   8   2.802   6.731  -9.272
   70   1HG1  VAL   8          HG12      VAL   8   2.468   8.996  -7.277
   71   2HG1  VAL   8          HG11      VAL   8   3.086   9.162  -8.920
   72   3HG1  VAL   8          HG13      VAL   8   1.412   8.678  -8.654
   73   1HG2  VAL   8          HG23      VAL   8   4.577   5.997  -7.701
   74   2HG2  VAL   8          HG22      VAL   8   4.943   7.578  -8.389
   75   3HG2  VAL   8          HG21      VAL   8   4.323   7.455  -6.743
   76    H    ALA   9           HN       ALA   9   0.869   4.622  -8.950
   77    HA   ALA   9           HA       ALA   9  -1.369   6.122  -9.910
   78   1HB   ALA   9           HB2      ALA   9  -0.799   3.157  -9.766
   79   2HB   ALA   9           HB1      ALA   9  -2.308   3.779 -10.433
   80   3HB   ALA   9           HB3      ALA   9  -0.772   4.205 -11.184
   81    H    LEU  10           HN       LEU  10  -1.104   3.727  -7.276
   82    HA   LEU  10           HA       LEU  10  -3.795   3.657  -6.477
   83   1HB   LEU  10           HB2      LEU  10  -1.334   2.803  -5.404
   84   2HB   LEU  10           HB1      LEU  10  -2.060   3.818  -4.158
   85    HG   LEU  10           HG       LEU  10  -3.802   1.826  -5.556
   86   1HD1  LEU  10          HD13      LEU  10  -1.382   1.082  -4.271
   87   2HD1  LEU  10          HD12      LEU  10  -2.692   0.681  -3.161
   88   3HD1  LEU  10          HD11      LEU  10  -2.690   0.025  -4.798
   89   1HD2  LEU  10          HD22      LEU  10  -3.666   3.292  -2.952
   90   2HD2  LEU  10          HD21      LEU  10  -5.047   3.024  -4.016
   91   3HD2  LEU  10          HD23      LEU  10  -4.471   1.725  -2.972
   92    H    ILE  11           HN       ILE  11  -1.279   6.048  -5.702
   93    HA   ILE  11           HA       ILE  11  -2.790   7.624  -3.881
   94    HB   ILE  11           HB       ILE  11  -0.571   8.286  -5.824
   95   1HG1  ILE  11          HG12      ILE  11   0.742   8.490  -3.787
   96   2HG1  ILE  11          HG11      ILE  11  -0.701   8.311  -2.794
   97   1HG2  ILE  11          HG22      ILE  11  -2.107  10.270  -5.507
   98   2HG2  ILE  11          HG21      ILE  11  -1.762  10.183  -3.781
   99   3HG2  ILE  11          HG23      ILE  11  -0.464  10.526  -4.923
  100   1HD1  ILE  11          HD12      ILE  11   0.306   6.200  -4.720
  101   2HD1  ILE  11          HD11      ILE  11   0.634   6.199  -2.988
  102   3HD1  ILE  11          HD13      ILE  11  -1.022   6.034  -3.573
  103    H    ASP  12           HN       ASP  12  -2.608   7.664  -7.427
  104    HA   ASP  12           HA       ASP  12  -4.177   9.939  -7.956
  105   1HB   ASP  12           HB2      ASP  12  -2.983   8.354  -9.606
  106   2HB   ASP  12           HB1      ASP  12  -4.441   7.372  -9.529
  107    H    VAL  13           HN       VAL  13  -5.288   6.560  -7.594
  108    HA   VAL  13           HA       VAL  13  -8.031   6.910  -7.842
  109    HB   VAL  13           HB       VAL  13  -6.521   5.188  -5.860
  110   1HG1  VAL  13          HG11      VAL  13  -9.409   5.677  -6.260
  111   2HG1  VAL  13          HG13      VAL  13  -8.936   3.979  -6.228
  112   3HG1  VAL  13          HG12      VAL  13  -8.562   5.024  -4.857
  113   1HG2  VAL  13          HG22      VAL  13  -7.032   5.057  -8.676
  114   2HG2  VAL  13          HG21      VAL  13  -6.185   3.887  -7.664
  115   3HG2  VAL  13          HG23      VAL  13  -7.928   3.762  -7.886
  116    H    PHE  14           HN       PHE  14  -5.988   7.775  -5.086
  117    HA   PHE  14           HA       PHE  14  -8.063   8.360  -3.231
  118   1HB   PHE  14           HB2      PHE  14  -5.506   8.306  -2.842
  119   2HB   PHE  14           HB1      PHE  14  -5.518   9.972  -3.421
  120    HD1  PHE  14           HD1      PHE  14  -6.911  11.694  -2.237
  121    HD2  PHE  14           HD2      PHE  14  -6.325   7.744  -0.670
  122    HE1  PHE  14           HE1      PHE  14  -7.682  12.463  -0.009
  123    HE2  PHE  14           HE2      PHE  14  -7.094   8.510   1.557
  124    HZ   PHE  14           HZ       PHE  14  -7.774  10.871   1.888
  125    H    HIS  15           HN       HIS  15  -6.386  10.521  -5.540
  126    HA   HIS  15           HA       HIS  15  -8.211  12.717  -4.957
  127   1HB   HIS  15           HB2      HIS  15  -5.729  12.706  -5.947
  128   2HB   HIS  15           HB1      HIS  15  -6.611  12.674  -7.475
  129    HD1  HIS  15           HD1      HIS  15  -6.556  14.678  -4.232
  130    HD2  HIS  15           HD2      HIS  15  -7.565  15.157  -8.247
  131    HE1  HIS  15           HE1      HIS  15  -7.171  17.116  -4.529
  132    H    GLN  16           HN       GLN  16  -8.713   9.877  -6.518
  133    HA   GLN  16           HA       GLN  16 -10.130  10.829  -8.877
  134   1HB   GLN  16           HB2      GLN  16  -9.105   8.421  -8.238
  135   2HB   GLN  16           HB1      GLN  16 -10.763   8.167  -7.697
  136   1HG   GLN  16           HG2      GLN  16 -11.059   7.577  -9.894
  137   2HG   GLN  16           HG1      GLN  16 -11.266   9.318 -10.080
  138   1HE2  GLN  16          HE22      GLN  16  -8.750   8.848 -12.594
  139   2HE2  GLN  16          HE21      GLN  16 -10.426   8.953 -12.354
  140    H    TYR  17           HN       TYR  17 -11.114   9.447  -5.733
  141    HA   TYR  17           HA       TYR  17 -13.590  11.070  -5.931
  142   1HB   TYR  17           HB2      TYR  17 -14.613   8.904  -4.719
  143   2HB   TYR  17           HB1      TYR  17 -14.659   9.123  -6.463
  144    HD1  TYR  17           HD1      TYR  17 -11.905   8.087  -4.104
  145    HD2  TYR  17           HD2      TYR  17 -14.326   7.081  -7.512
  146    HE1  TYR  17           HE1      TYR  17 -10.635   5.975  -4.392
  147    HE2  TYR  17           HE2      TYR  17 -13.053   4.978  -7.797
  148    HH   TYR  17           HH       TYR  17 -10.875   4.060  -7.215
  149    H    SER  18           HN       SER  18 -11.948  12.232  -4.433
  150    HA   SER  18           HA       SER  18 -12.435  11.280  -1.639
  151   1HB   SER  18           HB2      SER  18 -10.103  10.951  -1.943
  152   2HB   SER  18           HB1      SER  18  -9.932  12.435  -2.875
  153    HG   SER  18           HG       SER  18  -9.679  12.082  -0.252
  154    H    GLY  19           HN       GLY  19 -12.009  14.010  -3.840
  155   1HA   GLY  19           HA2      GLY  19 -12.932  15.875  -1.733
  156   2HA   GLY  19           HA1      GLY  19 -12.269  16.346  -3.295
  157    H    ARG  20           HN       ARG  20 -14.097  14.127  -4.462
  158    HA   ARG  20           HA       ARG  20 -16.316  15.920  -5.064
  159   1HB   ARG  20           HB2      ARG  20 -15.765  13.039  -5.822
  160   2HB   ARG  20           HB1      ARG  20 -17.149  13.960  -6.408
  161   1HG   ARG  20           HG2      ARG  20 -15.671  15.603  -7.441
  162   2HG   ARG  20           HG1      ARG  20 -14.257  14.782  -6.781
  163   1HD   ARG  20           HD2      ARG  20 -14.376  13.959  -8.985
  164   2HD   ARG  20           HD1      ARG  20 -15.153  12.693  -8.038
  165    HE   ARG  20           HE       ARG  20 -17.330  13.556  -8.817
  166   1HH1  ARG  20          HH21      ARG  20 -17.226  16.199  -9.631
  167   2HH1  ARG  20          HH22      ARG  20 -16.840  16.181 -11.319
  168   1HH2  ARG  20          HH11      ARG  20 -15.646  12.927 -11.285
  169   2HH2  ARG  20          HH12      ARG  20 -15.945  14.329 -12.255
  170    H    GLU  21           HN       GLU  21 -15.949  12.833  -3.340
  171    HA   GLU  21           HA       GLU  21 -18.750  12.861  -2.485
  172   1HB   GLU  21           HB2      GLU  21 -16.952  10.852  -2.813
  173   2HB   GLU  21           HB1      GLU  21 -16.812  11.115  -1.075
  174   1HG   GLU  21           HG2      GLU  21 -18.998  10.489  -0.663
  175   2HG   GLU  21           HG1      GLU  21 -19.554  10.989  -2.261
  176    H    GLY  22           HN       GLY  22 -15.813  12.577  -0.468
  177   1HA   GLY  22           HA2      GLY  22 -17.118  13.867   1.775
  178   2HA   GLY  22           HA1      GLY  22 -15.409  13.437   1.686
  179    H    ASP  23           HN       ASP  23 -14.214  15.257   1.994
  180    HA   ASP  23           HA       ASP  23 -15.152  17.765   0.665
  181   1HB   ASP  23           HB2      ASP  23 -14.883  17.607   3.264
  182   2HB   ASP  23           HB1      ASP  23 -13.157  17.718   2.917
  183    H    LYS  24           HN       LYS  24 -12.081  16.289   1.788
  184    HA   LYS  24           HA       LYS  24 -10.790  16.027  -0.660
  185   1HB   LYS  24           HB2      LYS  24 -11.074  18.310  -1.239
  186   2HB   LYS  24           HB1      LYS  24 -10.700  18.857   0.394
  187   1HG   LYS  24           HG2      LYS  24  -8.395  18.445   0.135
  188   2HG   LYS  24           HG1      LYS  24  -8.652  17.369  -1.240
  189   1HD   LYS  24           HD2      LYS  24  -7.850  19.408  -2.178
  190   2HD   LYS  24           HD1      LYS  24  -9.589  19.408  -2.474
  191   1HE   LYS  24           HE2      LYS  24  -9.889  20.758  -0.385
  192   2HE   LYS  24           HE1      LYS  24  -8.134  20.858  -0.243
  193   1HZ   LYS  24           HZ3      LYS  24  -8.386  21.660  -2.721
  194   2HZ   LYS  24           HZ2      LYS  24  -9.924  22.127  -2.173
  195   3HZ   LYS  24           HZ1      LYS  24  -8.530  22.738  -1.421
  196    H    HIS  25           HN       HIS  25  -8.635  15.350  -0.343
  197    HA   HIS  25           HA       HIS  25  -6.759  14.641   0.859
  198   1HB   HIS  25           HB2      HIS  25  -6.203  16.862   1.381
  199   2HB   HIS  25           HB1      HIS  25  -7.610  17.082   2.412
  200    HD1  HIS  25           HD1      HIS  25  -7.445  16.283   4.850
  201    HD2  HIS  25           HD2      HIS  25  -4.026  15.450   2.618
  202    HE1  HIS  25           HE1      HIS  25  -5.668  15.566   6.505
  203    H    LYS  26           HN       LYS  26  -9.759  13.951   1.638
  204    HA   LYS  26           HA       LYS  26  -8.908  12.309   3.969
  205   1HB   LYS  26           HB2      LYS  26 -11.656  13.492   4.029
  206   2HB   LYS  26           HB1      LYS  26 -10.626  12.985   5.367
  207   1HG   LYS  26           HG2      LYS  26  -9.072  14.936   4.562
  208   2HG   LYS  26           HG1      LYS  26 -10.535  15.527   3.777
  209   1HD   LYS  26           HD2      LYS  26 -11.666  15.171   6.082
  210   2HD   LYS  26           HD1      LYS  26 -10.022  15.113   6.717
  211   1HE   LYS  26           HE2      LYS  26  -9.648  17.338   6.332
  212   2HE   LYS  26           HE1      LYS  26 -10.625  17.352   4.862
  213   1HZ   LYS  26           HZ3      LYS  26 -12.498  16.885   6.669
  214   2HZ   LYS  26           HZ2      LYS  26 -11.416  17.781   7.627
  215   3HZ   LYS  26           HZ1      LYS  26 -12.046  18.450   6.198
  216    H    LEU  27           HN       LEU  27 -10.605  10.573   4.416
  217    HA   LEU  27           HA       LEU  27 -12.014   9.764   1.908
  218   1HB   LEU  27           HB2      LEU  27  -9.783   8.448   3.219
  219   2HB   LEU  27           HB1      LEU  27 -11.201   7.400   3.202
  220    HG   LEU  27           HG       LEU  27  -9.729   7.205   1.155
  221   1HD1  LEU  27          HD13      LEU  27 -12.171   6.612   1.206
  222   2HD1  LEU  27          HD12      LEU  27 -12.528   8.235   0.618
  223   3HD1  LEU  27          HD11      LEU  27 -11.603   7.118  -0.384
  224   1HD2  LEU  27          HD23      LEU  27  -9.676   9.937   1.269
  225   2HD2  LEU  27          HD22      LEU  27  -9.288   9.002  -0.175
  226   3HD2  LEU  27          HD21      LEU  27 -10.905   9.672   0.033
  227    H    LYS  28           HN       LYS  28 -13.129   7.401   2.893
  228    HA   LYS  28           HA       LYS  28 -14.439   8.059   5.454
  229   1HB   LYS  28           HB2      LYS  28 -15.628   8.793   3.031
  230   2HB   LYS  28           HB1      LYS  28 -16.449   7.303   3.497
  231   1HG   LYS  28           HG2      LYS  28 -17.011   8.210   5.661
  232   2HG   LYS  28           HG1      LYS  28 -16.021   9.640   5.371
  233   1HD   LYS  28           HD2      LYS  28 -17.544  10.568   3.893
  234   2HD   LYS  28           HD1      LYS  28 -18.198   8.999   3.421
  235   1HE   LYS  28           HE2      LYS  28 -18.595   9.552   6.261
  236   2HE   LYS  28           HE1      LYS  28 -19.355  10.764   5.231
  237   1HZ   LYS  28           HZ1      LYS  28 -20.217   8.766   3.923
  238   2HZ   LYS  28           HZ3      LYS  28 -19.815   7.851   5.291
  239   3HZ   LYS  28           HZ2      LYS  28 -20.948   9.108   5.418
  240    H    LYS  29           HN       LYS  29 -16.001   6.208   6.043
  241    HA   LYS  29           HA       LYS  29 -14.590   3.687   5.595
  242   1HB   LYS  29           HB2      LYS  29 -17.230   4.080   7.021
  243   2HB   LYS  29           HB1      LYS  29 -16.074   2.767   7.238
  244   1HG   LYS  29           HG2      LYS  29 -15.665   5.678   7.965
  245   2HG   LYS  29           HG1      LYS  29 -15.807   4.320   9.081
  246   1HD   LYS  29           HD2      LYS  29 -13.782   3.362   7.684
  247   2HD   LYS  29           HD1      LYS  29 -13.528   5.059   7.282
  248   1HE   LYS  29           HE2      LYS  29 -12.697   5.501   9.330
  249   2HE   LYS  29           HE1      LYS  29 -14.069   4.723  10.118
  250   1HZ   LYS  29           HZ1      LYS  29 -12.972   2.560   9.531
  251   2HZ   LYS  29           HZ3      LYS  29 -11.592   3.452   9.112
  252   3HZ   LYS  29           HZ2      LYS  29 -12.171   3.489  10.708
  253    H    SER  30           HN       SER  30 -17.417   5.289   4.344
  254    HA   SER  30           HA       SER  30 -18.562   2.865   3.168
  255   1HB   SER  30           HB2      SER  30 -19.827   4.809   1.831
  256   2HB   SER  30           HB1      SER  30 -20.255   4.402   3.489
  257    HG   SER  30           HG       SER  30 -19.914   6.626   3.293
  258    H    GLU  31           HN       GLU  31 -16.561   5.578   2.059
  259    HA   GLU  31           HA       GLU  31 -16.519   4.541  -0.690
  260   1HB   GLU  31           HB2      GLU  31 -16.363   7.026  -0.015
  261   2HB   GLU  31           HB1      GLU  31 -14.705   6.672   0.466
  262   1HG   GLU  31           HG2      GLU  31 -14.581   5.577  -1.941
  263   2HG   GLU  31           HG1      GLU  31 -15.928   6.669  -2.270
  264    H    LEU  32           HN       LEU  32 -14.790   4.168   2.257
  265    HA   LEU  32           HA       LEU  32 -12.327   3.178   1.010
  266   1HB   LEU  32           HB2      LEU  32 -12.080   4.182   3.188
  267   2HB   LEU  32           HB1      LEU  32 -13.368   3.182   3.858
  268    HG   LEU  32           HG       LEU  32 -12.014   1.165   3.511
  269   1HD1  LEU  32          HD12      LEU  32 -10.233   3.143   2.135
  270   2HD1  LEU  32          HD11      LEU  32  -9.502   1.751   2.931
  271   3HD1  LEU  32          HD13      LEU  32 -10.679   1.510   1.641
  272   1HD2  LEU  32          HD21      LEU  32 -10.767   3.477   5.000
  273   2HD2  LEU  32          HD23      LEU  32 -11.660   2.105   5.654
  274   3HD2  LEU  32          HD22      LEU  32 -10.030   1.876   5.024
  275    H    LYS  33           HN       LYS  33 -15.262   1.899   2.485
  276    HA   LYS  33           HA       LYS  33 -14.539  -0.871   2.458
  277   1HB   LYS  33           HB2      LYS  33 -16.609   0.472   3.479
  278   2HB   LYS  33           HB1      LYS  33 -17.369  -0.039   1.979
  279   1HG   LYS  33           HG2      LYS  33 -16.436  -2.393   2.566
  280   2HG   LYS  33           HG1      LYS  33 -16.250  -1.746   4.196
  281   1HD   LYS  33           HD2      LYS  33 -18.576  -1.348   4.424
  282   2HD   LYS  33           HD1      LYS  33 -18.857  -1.520   2.691
  283   1HE   LYS  33           HE2      LYS  33 -19.221  -3.721   2.948
  284   2HE   LYS  33           HE1      LYS  33 -17.615  -3.916   3.649
  285   1HZ   LYS  33           HZ3      LYS  33 -19.818  -2.836   5.277
  286   2HZ   LYS  33           HZ2      LYS  33 -19.673  -4.512   5.048
  287   3HZ   LYS  33           HZ1      LYS  33 -18.412  -3.640   5.779
  288    H    GLU  34           HN       GLU  34 -15.907   1.296   0.052
  289    HA   GLU  34           HA       GLU  34 -16.410  -0.854  -1.870
  290   1HB   GLU  34           HB2      GLU  34 -17.310   0.824  -3.246
  291   2HB   GLU  34           HB1      GLU  34 -17.592   1.483  -1.637
  292   1HG   GLU  34           HG2      GLU  34 -15.677   2.924  -1.796
  293   2HG   GLU  34           HG1      GLU  34 -15.152   2.156  -3.292
  294    H    LEU  35           HN       LEU  35 -14.055   1.691  -1.347
  295    HA   LEU  35           HA       LEU  35 -12.440   1.537  -3.584
  296   1HB   LEU  35           HB2      LEU  35 -12.227   2.620  -1.029
  297   2HB   LEU  35           HB1      LEU  35 -10.864   1.499  -1.116
  298    HG   LEU  35           HG       LEU  35 -10.127   3.643  -1.965
  299   1HD1  LEU  35          HD13      LEU  35  -9.937   1.261  -3.345
  300   2HD1  LEU  35          HD12      LEU  35 -10.525   2.368  -4.585
  301   3HD1  LEU  35          HD11      LEU  35  -9.026   2.722  -3.724
  302   1HD2  LEU  35          HD21      LEU  35 -12.799   3.785  -2.906
  303   2HD2  LEU  35          HD23      LEU  35 -11.551   5.024  -3.033
  304   3HD2  LEU  35          HD22      LEU  35 -11.762   3.846  -4.328
  305    H    ILE  36           HN       ILE  36 -12.216  -0.552  -0.698
  306    HA   ILE  36           HA       ILE  36 -10.251  -2.287  -1.986
  307    HB   ILE  36           HB       ILE  36 -11.788  -3.248   0.374
  308   1HG1  ILE  36          HG12      ILE  36 -10.206  -0.692   0.295
  309   2HG1  ILE  36          HG11      ILE  36 -11.691  -1.056   1.164
  310   1HG2  ILE  36          HG21      ILE  36  -9.565  -4.096  -0.876
  311   2HG2  ILE  36          HG23      ILE  36  -8.823  -2.986   0.277
  312   3HG2  ILE  36          HG22      ILE  36  -9.816  -4.323   0.855
  313   1HD1  ILE  36          HD12      ILE  36  -8.959  -2.180   1.839
  314   2HD1  ILE  36          HD11      ILE  36  -9.774  -0.886   2.716
  315   3HD1  ILE  36          HD13      ILE  36 -10.453  -2.514   2.711
  316    H    ASN  37           HN       ASN  37 -13.664  -2.661  -1.004
  317    HA   ASN  37           HA       ASN  37 -13.902  -5.260  -2.237
  318   1HB   ASN  37           HB2      ASN  37 -15.353  -4.312  -0.360
  319   2HB   ASN  37           HB1      ASN  37 -16.183  -3.383  -1.609
  320   1HD2  ASN  37          HD22      ASN  37 -17.138  -7.249  -1.103
  321   2HD2  ASN  37          HD21      ASN  37 -16.165  -6.389  -0.009
  322    H    ASN  38           HN       ASN  38 -15.657  -2.267  -3.118
  323    HA   ASN  38           HA       ASN  38 -16.558  -3.027  -5.615
  324   1HB   ASN  38           HB2      ASN  38 -17.107  -0.842  -4.705
  325   2HB   ASN  38           HB1      ASN  38 -15.428  -0.324  -4.843
  326   1HD2  ASN  38          HD22      ASN  38 -15.581  -0.030  -8.441
  327   2HD2  ASN  38          HD21      ASN  38 -14.519  -0.452  -7.188
  328    H    GLU  39           HN       GLU  39 -13.214  -2.450  -4.734
  329    HA   GLU  39           HA       GLU  39 -12.491  -2.599  -7.623
  330   1HB   GLU  39           HB2      GLU  39 -10.711  -1.778  -5.321
  331   2HB   GLU  39           HB1      GLU  39 -10.396  -1.572  -7.044
  332   1HG   GLU  39           HG2      GLU  39 -12.878  -0.384  -5.841
  333   2HG   GLU  39           HG1      GLU  39 -11.336   0.451  -5.656
  334    H    LEU  40           HN       LEU  40 -10.611  -3.549  -4.729
  335    HA   LEU  40           HA       LEU  40  -9.413  -5.752  -6.092
  336   1HB   LEU  40           HB2      LEU  40  -9.616  -5.409  -3.098
  337   2HB   LEU  40           HB1      LEU  40  -8.367  -6.253  -4.003
  338    HG   LEU  40           HG       LEU  40  -8.819  -3.300  -3.717
  339   1HD1  LEU  40          HD12      LEU  40  -7.156  -4.539  -2.326
  340   2HD1  LEU  40          HD11      LEU  40  -6.319  -5.009  -3.804
  341   3HD1  LEU  40          HD13      LEU  40  -6.414  -3.310  -3.348
  342   1HD2  LEU  40          HD23      LEU  40  -7.730  -4.746  -6.119
  343   2HD2  LEU  40          HD22      LEU  40  -8.735  -3.299  -6.056
  344   3HD2  LEU  40          HD21      LEU  40  -7.022  -3.203  -5.645
  345    H    SER  41           HN       SER  41 -12.515  -5.554  -4.659
  346    HA   SER  41           HA       SER  41 -12.850  -8.152  -3.594
  347   1HB   SER  41           HB2      SER  41 -14.609  -6.440  -3.439
  348   2HB   SER  41           HB1      SER  41 -14.861  -6.529  -5.178
  349    HG   SER  41           HG       SER  41 -16.169  -7.883  -3.533
  350    H    HIS  42           HN       HIS  42 -13.047  -7.060  -6.978
  351    HA   HIS  42           HA       HIS  42 -13.952  -9.521  -8.089
  352   1HB   HIS  42           HB2      HIS  42 -12.652  -7.066  -9.093
  353   2HB   HIS  42           HB1      HIS  42 -12.369  -8.506 -10.070
  354    HD1  HIS  42           HD1      HIS  42 -13.956  -7.923 -11.987
  355    HD2  HIS  42           HD2      HIS  42 -15.823  -7.859  -8.261
  356    HE1  HIS  42           HE1      HIS  42 -16.440  -7.730 -12.436
  357    H    PHE  43           HN       PHE  43 -10.786  -8.490  -7.006
  358    HA   PHE  43           HA       PHE  43  -9.580 -10.970  -8.129
  359   1HB   PHE  43           HB2      PHE  43  -8.285  -9.048  -8.681
  360   2HB   PHE  43           HB1      PHE  43  -8.407  -8.403  -7.046
  361    HD1  PHE  43           HD1      PHE  43  -7.413 -11.693  -8.569
  362    HD2  PHE  43           HD2      PHE  43  -6.415  -8.513  -5.859
  363    HE1  PHE  43           HE1      PHE  43  -5.321 -12.873  -7.951
  364    HE2  PHE  43           HE2      PHE  43  -4.326  -9.693  -5.240
  365    HZ   PHE  43           HZ       PHE  43  -3.778 -11.872  -6.287
  366    H    LEU  44           HN       LEU  44 -11.118 -10.075  -5.369
  367    HA   LEU  44           HA       LEU  44  -9.323 -11.732  -3.643
  368   1HB   LEU  44           HB2      LEU  44  -9.650  -9.420  -2.834
  369   2HB   LEU  44           HB1      LEU  44 -11.394  -9.672  -2.828
  370    HG   LEU  44           HG       LEU  44 -10.070 -11.807  -1.398
  371   1HD1  LEU  44          HD13      LEU  44  -8.375  -9.940  -1.080
  372   2HD1  LEU  44          HD12      LEU  44  -9.642  -9.039  -0.248
  373   3HD1  LEU  44          HD11      LEU  44  -9.075 -10.573   0.409
  374   1HD2  LEU  44          HD22      LEU  44 -12.015  -9.612  -0.623
  375   2HD2  LEU  44          HD21      LEU  44 -12.427 -11.246  -1.138
  376   3HD2  LEU  44          HD23      LEU  44 -11.610 -10.986   0.404
  377    H    GLU  45           HN       GLU  45 -10.123 -13.674  -2.988
  378    HA   GLU  45           HA       GLU  45 -12.947 -14.097  -2.463
  379   1HB   GLU  45           HB2      GLU  45 -13.308 -15.809  -4.216
  380   2HB   GLU  45           HB1      GLU  45 -12.999 -14.223  -4.919
  381   1HG   GLU  45           HG2      GLU  45 -10.644 -14.824  -5.282
  382   2HG   GLU  45           HG1      GLU  45 -10.925 -16.402  -4.549
  383    H    GLU  46           HN       GLU  46 -10.159 -14.511  -1.340
  384    HA   GLU  46           HA       GLU  46 -10.564 -17.361  -0.552
  385   1HB   GLU  46           HB2      GLU  46  -8.020 -16.009  -1.454
  386   2HB   GLU  46           HB1      GLU  46  -7.980 -17.432  -0.414
  387   1HG   GLU  46           HG2      GLU  46  -9.563 -17.397  -2.986
  388   2HG   GLU  46           HG1      GLU  46  -7.856 -17.837  -2.956
  389    H    ILE  47           HN       ILE  47  -8.681 -14.417   0.215
  390    HA   ILE  47           HA       ILE  47  -8.150 -13.464   2.288
  391    HB   ILE  47           HB       ILE  47 -10.849 -14.690   2.893
  392   1HG1  ILE  47          HG12      ILE  47 -10.505 -11.771   2.747
  393   2HG1  ILE  47          HG11      ILE  47 -10.167 -12.604   1.228
  394   1HG2  ILE  47          HG23      ILE  47  -8.889 -13.398   4.633
  395   2HG2  ILE  47          HG22      ILE  47 -10.428 -12.539   4.612
  396   3HG2  ILE  47          HG21      ILE  47 -10.376 -14.243   5.057
  397   1HD1  ILE  47          HD12      ILE  47 -12.582 -13.525   2.670
  398   2HD1  ILE  47          HD11      ILE  47 -12.668 -11.890   2.017
  399   3HD1  ILE  47          HD13      ILE  47 -12.336 -13.252   0.946
  400    H    LYS  48           HN       LYS  48  -6.342 -14.678   2.925
  401    HA   LYS  48           HA       LYS  48  -6.815 -17.230   4.361
  402   1HB   LYS  48           HB2      LYS  48  -4.970 -16.960   2.618
  403   2HB   LYS  48           HB1      LYS  48  -4.156 -15.909   3.777
  404   1HG   LYS  48           HG2      LYS  48  -4.998 -18.275   5.149
  405   2HG   LYS  48           HG1      LYS  48  -4.134 -18.756   3.689
  406   1HD   LYS  48           HD2      LYS  48  -2.200 -18.289   4.739
  407   2HD   LYS  48           HD1      LYS  48  -2.681 -16.593   4.787
  408   1HE   LYS  48           HE2      LYS  48  -2.827 -16.735   7.026
  409   2HE   LYS  48           HE1      LYS  48  -4.144 -17.891   6.832
  410   1HZ   LYS  48           HZ1      LYS  48  -2.349 -19.612   6.531
  411   2HZ   LYS  48           HZ3      LYS  48  -1.249 -18.450   7.092
  412   3HZ   LYS  48           HZ2      LYS  48  -2.514 -18.975   8.096
  413    H    GLU  49           HN       GLU  49  -5.722 -13.924   4.880
  414    HA   GLU  49           HA       GLU  49  -5.080 -14.477   7.708
  415   1HB   GLU  49           HB2      GLU  49  -4.484 -12.381   5.780
  416   2HB   GLU  49           HB1      GLU  49  -5.069 -11.706   7.300
  417   1HG   GLU  49           HG2      GLU  49  -2.860 -13.770   7.088
  418   2HG   GLU  49           HG1      GLU  49  -2.588 -12.037   7.270
  419    H    GLN  50           HN       GLN  50  -7.479 -15.194   7.870
  420    HA   GLN  50           HA       GLN  50  -9.705 -13.569   7.685
  421   1HB   GLN  50           HB2      GLN  50  -9.819 -15.876   8.514
  422   2HB   GLN  50           HB1      GLN  50  -9.005 -15.395  10.004
  423   1HG   GLN  50           HG2      GLN  50 -11.105 -15.101  10.813
  424   2HG   GLN  50           HG1      GLN  50 -11.068 -13.592   9.902
  425   1HE2  GLN  50          HE22      GLN  50 -13.993 -15.913   8.931
  426   2HE2  GLN  50          HE21      GLN  50 -13.351 -15.583  10.467
  427    H    GLU  51           HN       GLU  51  -7.030 -13.231   9.912
  428    HA   GLU  51           HA       GLU  51  -8.401 -11.390  11.701
  429   1HB   GLU  51           HB2      GLU  51  -6.139 -12.852  11.947
  430   2HB   GLU  51           HB1      GLU  51  -5.441 -11.297  11.500
  431   1HG   GLU  51           HG2      GLU  51  -6.958 -10.278  13.304
  432   2HG   GLU  51           HG1      GLU  51  -7.214 -11.931  13.861
  433    H    VAL  52           HN       VAL  52  -6.067 -11.011   9.023
  434    HA   VAL  52           HA       VAL  52  -5.848  -8.178   9.182
  435    HB   VAL  52           HB       VAL  52  -5.650 -10.003   6.767
  436   1HG1  VAL  52          HG12      VAL  52  -5.323  -7.083   7.144
  437   2HG1  VAL  52          HG11      VAL  52  -4.032  -7.883   6.249
  438   3HG1  VAL  52          HG13      VAL  52  -5.697  -7.995   5.682
  439   1HG2  VAL  52          HG22      VAL  52  -4.099 -10.242   8.875
  440   2HG2  VAL  52          HG21      VAL  52  -3.376 -10.223   7.266
  441   3HG2  VAL  52          HG23      VAL  52  -3.352  -8.767   8.262
  442    H    VAL  53           HN       VAL  53  -7.908 -10.143   7.005
  443    HA   VAL  53           HA       VAL  53  -9.360  -7.875   6.008
  444    HB   VAL  53           HB       VAL  53 -10.060 -10.823   6.094
  445   1HG1  VAL  53          HG13      VAL  53 -11.385  -8.535   4.610
  446   2HG1  VAL  53          HG12      VAL  53 -11.740 -10.242   4.353
  447   3HG1  VAL  53          HG11      VAL  53 -12.104  -9.489   5.906
  448   1HG2  VAL  53          HG22      VAL  53  -8.604  -9.012   4.219
  449   2HG2  VAL  53          HG21      VAL  53  -8.288 -10.699   4.619
  450   3HG2  VAL  53          HG23      VAL  53  -9.600 -10.286   3.517
  451    H    ASP  54           HN       ASP  54  -9.756  -9.924   8.825
  452    HA   ASP  54           HA       ASP  54 -12.464  -9.015   9.384
  453   1HB   ASP  54           HB2      ASP  54 -11.698 -11.161  10.271
  454   2HB   ASP  54           HB1      ASP  54 -10.403 -10.358  11.159
  455    H    LYS  55           HN       LYS  55  -9.268  -7.798   9.942
  456    HA   LYS  55           HA       LYS  55 -10.065  -6.030  12.133
  457   1HB   LYS  55           HB2      LYS  55  -7.760  -6.808  12.050
  458   2HB   LYS  55           HB1      LYS  55  -7.559  -6.135  10.432
  459   1HG   LYS  55           HG2      LYS  55  -8.546  -4.178  12.384
  460   2HG   LYS  55           HG1      LYS  55  -6.954  -4.821  12.786
  461   1HD   LYS  55           HD2      LYS  55  -6.417  -4.394  10.267
  462   2HD   LYS  55           HD1      LYS  55  -7.810  -3.314  10.327
  463   1HE   LYS  55           HE2      LYS  55  -6.018  -1.893  10.876
  464   2HE   LYS  55           HE1      LYS  55  -6.670  -2.336  12.454
  465   1HZ   LYS  55           HZ1      LYS  55  -5.002  -4.174  12.470
  466   2HZ   LYS  55           HZ3      LYS  55  -4.298  -3.480  11.095
  467   3HZ   LYS  55           HZ2      LYS  55  -4.338  -2.614  12.556
  468    H    VAL  56           HN       VAL  56  -9.122  -5.536   8.699
  469    HA   VAL  56           HA       VAL  56  -9.826  -2.741   8.749
  470    HB   VAL  56           HB       VAL  56  -9.679  -2.924   6.279
  471   1HG1  VAL  56          HG13      VAL  56  -7.621  -3.749   8.178
  472   2HG1  VAL  56          HG12      VAL  56  -7.330  -4.382   6.558
  473   3HG1  VAL  56          HG11      VAL  56  -7.500  -2.645   6.810
  474   1HG2  VAL  56          HG21      VAL  56  -9.484  -5.877   6.908
  475   2HG2  VAL  56          HG23      VAL  56 -10.692  -5.078   5.904
  476   3HG2  VAL  56          HG22      VAL  56  -9.021  -5.186   5.355
  477    H    MET  57           HN       MET  57 -11.475  -5.658   7.566
  478    HA   MET  57           HA       MET  57 -13.876  -4.345   6.711
  479   1HB   MET  57           HB2      MET  57 -13.140  -6.751   6.231
  480   2HB   MET  57           HB1      MET  57 -13.685  -7.133   7.866
  481   1HG   MET  57           HG2      MET  57 -15.486  -7.604   6.279
  482   2HG   MET  57           HG1      MET  57 -15.935  -6.229   7.289
  483   1HE   MET  57           HE1      MET  57 -13.930  -7.230   4.269
  484   2HE   MET  57           HE3      MET  57 -14.106  -5.918   3.095
  485   3HE   MET  57           HE2      MET  57 -13.120  -5.690   4.538
  486    H    GLU  58           HN       GLU  58 -12.583  -5.111   9.817
  487    HA   GLU  58           HA       GLU  58 -15.092  -5.157  11.265
  488   1HB   GLU  58           HB2      GLU  58 -12.232  -5.249  11.908
  489   2HB   GLU  58           HB1      GLU  58 -13.172  -4.340  13.091
  490   1HG   GLU  58           HG2      GLU  58 -14.657  -6.205  13.453
  491   2HG   GLU  58           HG1      GLU  58 -13.939  -7.102  12.114
  492    H    THR  59           HN       THR  59 -12.516  -2.640  11.092
  493    HA   THR  59           HA       THR  59 -14.057  -0.627  12.401
  494    HB   THR  59           HB       THR  59 -12.236   0.204  10.190
  495    HG1  THR  59           HG1      THR  59 -10.493  -0.350  11.769
  496   1HG2  THR  59          HG21      THR  59 -12.777   0.958  13.056
  497   2HG2  THR  59          HG23      THR  59 -11.328   1.528  12.230
  498   3HG2  THR  59          HG22      THR  59 -12.922   1.953  11.607
  499    H    LEU  60           HN       LEU  60 -13.810  -1.630   9.044
  500    HA   LEU  60           HA       LEU  60 -15.327   0.383   7.784
  501   1HB   LEU  60           HB2      LEU  60 -14.714  -2.491   7.256
  502   2HB   LEU  60           HB1      LEU  60 -16.019  -1.763   6.325
  503    HG   LEU  60           HG       LEU  60 -13.243  -0.580   6.582
  504   1HD1  LEU  60          HD13      LEU  60 -14.506  -2.330   4.464
  505   2HD1  LEU  60          HD12      LEU  60 -13.123  -1.294   4.123
  506   3HD1  LEU  60          HD11      LEU  60 -12.984  -2.582   5.317
  507   1HD2  LEU  60          HD23      LEU  60 -15.792   0.357   5.527
  508   2HD2  LEU  60          HD22      LEU  60 -14.295   1.253   5.785
  509   3HD2  LEU  60          HD21      LEU  60 -14.539   0.354   4.286
  510    H    ASP  61           HN       ASP  61 -16.476  -2.760   9.038
  511    HA   ASP  61           HA       ASP  61 -19.269  -1.922   8.822
  512   1HB   ASP  61           HB2      ASP  61 -18.091  -4.354   8.748
  513   2HB   ASP  61           HB1      ASP  61 -18.539  -4.297  10.452
  514    H    GLU  62           HN       GLU  62 -16.849  -1.198  10.974
  515    HA   GLU  62           HA       GLU  62 -18.206  -1.505  13.495
  516   1HB   GLU  62           HB2      GLU  62 -15.791  -1.178  13.432
  517   2HB   GLU  62           HB1      GLU  62 -15.993   0.386  12.646
  518   1HG   GLU  62           HG2      GLU  62 -17.057   1.317  14.595
  519   2HG   GLU  62           HG1      GLU  62 -17.150  -0.267  15.366
  520    H    ASP  63           HN       ASP  63 -18.190   0.979  11.007
  521    HA   ASP  63           HA       ASP  63 -20.545   2.200  12.291
  522   1HB   ASP  63           HB2      ASP  63 -18.535   3.385  13.230
  523   2HB   ASP  63           HB1      ASP  63 -18.130   3.882  11.587
  524    H    GLY  64           HN       GLY  64 -18.200   2.511   9.624
  525   1HA   GLY  64           HA2      GLY  64 -18.729   2.413   7.295
  526   2HA   GLY  64           HA1      GLY  64 -20.442   2.505   7.707
  527    H    ASP  65           HN       ASP  65 -19.640   4.834   9.577
  528    HA   ASP  65           HA       ASP  65 -19.425   6.899   7.424
  529   1HB   ASP  65           HB2      ASP  65 -21.692   6.661   8.598
  530   2HB   ASP  65           HB1      ASP  65 -20.888   7.270  10.043
  531    H    GLY  66           HN       GLY  66 -17.095   6.903   7.827
  532   1HA   GLY  66           HA2      GLY  66 -16.415   8.587  10.167
  533   2HA   GLY  66           HA1      GLY  66 -15.514   7.089   9.946
  534    H    GLU  67           HN       GLU  67 -13.826   9.033   9.868
  535    HA   GLU  67           HA       GLU  67 -13.469   9.729   6.979
  536   1HB   GLU  67           HB2      GLU  67 -12.772  11.323   9.460
  537   2HB   GLU  67           HB1      GLU  67 -12.160  11.719   7.854
  538   1HG   GLU  67           HG2      GLU  67 -14.174  12.510   7.138
  539   2HG   GLU  67           HG1      GLU  67 -15.079  11.268   8.001
  540    H    CYS  68           HN       CYS  68 -11.642   8.894   6.089
  541    HA   CYS  68           HA       CYS  68  -9.565   7.826   7.955
  542   1HB   CYS  68           HB2      CYS  68 -10.456   6.991   5.194
  543   2HB   CYS  68           HB1      CYS  68  -8.910   6.468   5.863
  544    HG   CYS  68           HG       CYS  68 -11.636   5.825   7.264
  545    H    ASP  69           HN       ASP  69  -7.300   7.847   6.961
  546    HA   ASP  69           HA       ASP  69  -6.851  10.537   5.772
  547   1HB   ASP  69           HB2      ASP  69  -4.879   8.608   7.038
  548   2HB   ASP  69           HB1      ASP  69  -4.521  10.251   6.507
  549    H    PHE  70           HN       PHE  70  -4.458  10.204   4.487
  550    HA   PHE  70           HA       PHE  70  -5.301   8.638   2.150
  551   1HB   PHE  70           HB2      PHE  70  -3.002   9.520   1.271
  552   2HB   PHE  70           HB1      PHE  70  -4.343  10.646   1.451
  553    HD1  PHE  70           HD1      PHE  70  -4.387  12.283   3.268
  554    HD2  PHE  70           HD2      PHE  70  -1.110   9.552   2.810
  555    HE1  PHE  70           HE1      PHE  70  -3.035  13.645   4.838
  556    HE2  PHE  70           HE2      PHE  70   0.243  10.911   4.381
  557    HZ   PHE  70           HZ       PHE  70  -0.719  12.959   5.396
  558    H    GLN  71           HN       GLN  71  -2.776   8.476   4.642
  559    HA   GLN  71           HA       GLN  71  -1.583   6.114   3.363
  560   1HB   GLN  71           HB2      GLN  71  -0.722   6.143   6.030
  561   2HB   GLN  71           HB1      GLN  71   0.168   6.707   4.626
  562   1HG   GLN  71           HG2      GLN  71  -1.023   8.940   4.939
  563   2HG   GLN  71           HG1      GLN  71  -1.552   8.327   6.507
  564   1HE2  GLN  71          HE22      GLN  71   2.305   7.897   6.991
  565   2HE2  GLN  71          HE21      GLN  71   1.203   6.738   6.433
  566    H    GLU  72           HN       GLU  72  -4.229   6.741   5.384
  567    HA   GLU  72           HA       GLU  72  -4.202   4.181   6.781
  568   1HB   GLU  72           HB2      GLU  72  -6.073   6.505   6.541
  569   2HB   GLU  72           HB1      GLU  72  -6.741   4.964   7.071
  570   1HG   GLU  72           HG2      GLU  72  -4.229   5.544   8.419
  571   2HG   GLU  72           HG1      GLU  72  -5.407   6.832   8.673
  572    H    PHE  73           HN       PHE  73  -6.050   5.583   4.075
  573    HA   PHE  73           HA       PHE  73  -7.453   3.135   3.466
  574   1HB   PHE  73           HB2      PHE  73  -8.577   4.867   2.460
  575   2HB   PHE  73           HB1      PHE  73  -7.114   5.821   2.250
  576    HD1  PHE  73           HD1      PHE  73  -8.725   2.685   0.952
  577    HD2  PHE  73           HD2      PHE  73  -6.231   6.074   0.114
  578    HE1  PHE  73           HE1      PHE  73  -8.612   2.011  -1.431
  579    HE2  PHE  73           HE2      PHE  73  -6.119   5.403  -2.270
  580    HZ   PHE  73           HZ       PHE  73  -7.308   3.372  -3.043
  581    H    MET  74           HN       MET  74  -4.343   4.487   2.574
  582    HA   MET  74           HA       MET  74  -3.847   2.647   0.383
  583   1HB   MET  74           HB2      MET  74  -2.454   4.820   1.737
  584   2HB   MET  74           HB1      MET  74  -1.371   3.478   1.371
  585   1HG   MET  74           HG2      MET  74  -3.029   3.826  -0.906
  586   2HG   MET  74           HG1      MET  74  -2.473   5.431  -0.431
  587   1HE   MET  74           HE3      MET  74  -1.881   2.644  -2.583
  588   2HE   MET  74           HE2      MET  74  -0.224   2.077  -2.400
  589   3HE   MET  74           HE1      MET  74  -1.405   1.744  -1.137
  590    H    ALA  75           HN       ALA  75  -2.834   2.787   3.797
  591    HA   ALA  75           HA       ALA  75  -1.375   0.289   3.670
  592   1HB   ALA  75           HB2      ALA  75  -1.312   2.290   5.436
  593   2HB   ALA  75           HB1      ALA  75  -2.516   1.290   6.249
  594   3HB   ALA  75           HB3      ALA  75  -0.911   0.641   5.914
  595    H    PHE  76           HN       PHE  76  -4.690   1.142   3.936
  596    HA   PHE  76           HA       PHE  76  -5.536  -1.321   5.262
  597   1HB   PHE  76           HB2      PHE  76  -6.732   1.180   4.492
  598   2HB   PHE  76           HB1      PHE  76  -7.709  -0.147   3.865
  599    HD1  PHE  76           HD1      PHE  76  -5.751   0.604   6.986
  600    HD2  PHE  76           HD2      PHE  76  -9.396  -0.894   5.273
  601    HE1  PHE  76           HE1      PHE  76  -6.647   0.189   9.259
  602    HE2  PHE  76           HE2      PHE  76 -10.291  -1.308   7.546
  603    HZ   PHE  76           HZ       PHE  76  -8.917  -0.767   9.539
  604    H    VAL  77           HN       VAL  77  -5.376  -0.096   1.939
  605    HA   VAL  77           HA       VAL  77  -6.737  -2.354   0.755
  606    HB   VAL  77           HB       VAL  77  -4.781  -0.366  -0.434
  607   1HG1  VAL  77          HG13      VAL  77  -5.681  -2.797  -1.503
  608   2HG1  VAL  77          HG12      VAL  77  -6.705  -1.572  -2.250
  609   3HG1  VAL  77          HG11      VAL  77  -4.952  -1.464  -2.398
  610   1HG2  VAL  77          HG22      VAL  77  -7.518  -0.169   0.411
  611   2HG2  VAL  77          HG21      VAL  77  -6.520   1.065  -0.353
  612   3HG2  VAL  77          HG23      VAL  77  -7.460  -0.048  -1.347
  613    H    SER  78           HN       SER  78  -3.444  -1.740   1.759
  614    HA   SER  78           HA       SER  78  -2.293  -3.931   0.228
  615   1HB   SER  78           HB2      SER  78  -1.312  -2.208   2.503
  616   2HB   SER  78           HB1      SER  78  -0.368  -3.573   1.915
  617    HG   SER  78           HG       SER  78  -1.363  -1.443   0.320
  618    H    MET  79           HN       MET  79  -3.849  -3.604   3.334
  619    HA   MET  79           HA       MET  79  -2.845  -6.041   4.499
  620   1HB   MET  79           HB2      MET  79  -5.578  -5.056   5.196
  621   2HB   MET  79           HB1      MET  79  -4.279  -5.601   6.252
  622   1HG   MET  79           HG2      MET  79  -3.026  -3.475   5.564
  623   2HG   MET  79           HG1      MET  79  -4.559  -2.924   4.888
  624   1HE   MET  79           HE1      MET  79  -3.218  -4.861   7.922
  625   2HE   MET  79           HE3      MET  79  -2.381  -3.306   8.007
  626   3HE   MET  79           HE2      MET  79  -3.521  -3.766   9.267
  627    H    VAL  80           HN       VAL  80  -5.913  -5.237   2.852
  628    HA   VAL  80           HA       VAL  80  -6.849  -7.958   2.852
  629    HB   VAL  80           HB       VAL  80  -8.466  -7.050   1.119
  630   1HG1  VAL  80          HG12      VAL  80  -8.824  -7.058   3.617
  631   2HG1  VAL  80          HG11      VAL  80  -8.204  -5.409   3.651
  632   3HG1  VAL  80          HG13      VAL  80  -9.690  -5.774   2.772
  633   1HG2  VAL  80          HG21      VAL  80  -6.504  -4.930   1.132
  634   2HG2  VAL  80          HG23      VAL  80  -7.888  -5.148   0.063
  635   3HG2  VAL  80          HG22      VAL  80  -8.080  -4.298   1.596
  636    H    THR  81           HN       THR  81  -5.166  -5.953   0.440
  637    HA   THR  81           HA       THR  81  -5.240  -7.940  -1.645
  638    HB   THR  81           HB       THR  81  -3.139  -5.789  -1.264
  639    HG1  THR  81           HG1      THR  81  -5.605  -5.321  -1.289
  640   1HG2  THR  81          HG22      THR  81  -3.560  -7.778  -3.236
  641   2HG2  THR  81          HG21      THR  81  -4.045  -6.244  -3.958
  642   3HG2  THR  81          HG23      THR  81  -2.422  -6.432  -3.294
  643    H    THR  82           HN       THR  82  -3.609  -7.823   1.309
  644    HA   THR  82           HA       THR  82  -1.531  -9.735   0.325
  645    HB   THR  82           HB       THR  82  -0.237  -9.086   2.336
  646    HG1  THR  82           HG1      THR  82  -1.927  -8.498   3.678
  647   1HG2  THR  82          HG22      THR  82  -1.075  -7.156   0.242
  648   2HG2  THR  82          HG21      THR  82  -0.213  -6.479   1.625
  649   3HG2  THR  82          HG23      THR  82   0.536  -7.745   0.652
  650    H    ALA  83           HN       ALA  83  -4.367  -9.401   2.161
  651    HA   ALA  83           HA       ALA  83  -3.757 -11.609   4.010
  652   1HB   ALA  83           HB2      ALA  83  -6.268  -9.987   3.504
  653   2HB   ALA  83           HB1      ALA  83  -6.158 -11.272   4.706
  654   3HB   ALA  83           HB3      ALA  83  -5.159  -9.828   4.866
  655    H    CYS  84           HN       CYS  84  -3.374 -12.652   1.583
  656    HA   CYS  84           HA       CYS  84  -5.877 -14.200   1.050
  657   1HB   CYS  84           HB2      CYS  84  -3.732 -13.369  -0.926
  658   2HB   CYS  84           HB1      CYS  84  -5.113 -14.398  -1.304
  659    HG   CYS  84           HG       CYS  84  -5.497 -11.713  -1.766
  660    H    HIS  85           HN       HIS  85  -5.242 -16.356  -0.120
  661    HA   HIS  85           HA       HIS  85  -3.067 -17.574   1.499
  662   1HB   HIS  85           HB2      HIS  85  -5.493 -18.501   1.370
  663   2HB   HIS  85           HB1      HIS  85  -5.028 -19.087  -0.227
  664    HD1  HIS  85           HD1      HIS  85  -2.456 -18.997   2.491
  665    HD2  HIS  85           HD2      HIS  85  -4.996 -21.795   0.728
  666    HE1  HIS  85           HE1      HIS  85  -1.679 -21.269   3.285
  667    H    GLU  86           HN       GLU  86  -1.404 -18.801   0.470
  668    HA   GLU  86           HA       GLU  86   0.196 -19.126  -1.221
  669   1HB   GLU  86           HB2      GLU  86  -2.441 -19.539  -2.620
  670   2HB   GLU  86           HB1      GLU  86  -0.924 -19.650  -3.513
  671   1HG   GLU  86           HG2      GLU  86  -0.592 -21.725  -2.723
  672   2HG   GLU  86           HG1      GLU  86  -0.634 -21.110  -1.070
  673    H    PHE  87           HN       PHE  87   0.479 -16.654  -0.766
  674    HA   PHE  87           HA       PHE  87   0.772 -14.472  -1.591
  675   1HB   PHE  87           HB2      PHE  87   2.113 -16.219  -3.176
  676   2HB   PHE  87           HB1      PHE  87   1.052 -15.469  -4.369
  677    HD1  PHE  87           HD1      PHE  87   2.927 -14.292  -1.334
  678    HD2  PHE  87           HD2      PHE  87   2.047 -13.693  -5.496
  679    HE1  PHE  87           HE1      PHE  87   4.367 -12.276  -1.346
  680    HE2  PHE  87           HE2      PHE  87   3.486 -11.674  -5.507
  681    HZ   PHE  87           HZ       PHE  87   4.646 -10.967  -3.431
  682    H    PHE  88           HN       PHE  88   0.182 -13.464  -4.199
  683    HA   PHE  88           HA       PHE  88  -2.725 -13.910  -4.552
  684   1HB   PHE  88           HB2      PHE  88  -2.460 -11.134  -4.714
  685   2HB   PHE  88           HB1      PHE  88  -3.248 -12.024  -3.416
  686    HD1  PHE  88           HD1      PHE  88  -1.988 -12.600  -1.345
  687    HD2  PHE  88           HD2      PHE  88  -0.286 -10.146  -4.429
  688    HE1  PHE  88           HE1      PHE  88  -0.221 -11.851   0.227
  689    HE2  PHE  88           HE2      PHE  88   1.480  -9.397  -2.856
  690    HZ   PHE  88           HZ       PHE  88   1.510 -10.248  -0.529
  691    H    GLU  89           HN       GLU  89  -2.558 -14.567  -6.685
  692    HA   GLU  89           HA       GLU  89  -1.626 -12.532  -8.612
  693   1HB   GLU  89           HB2      GLU  89  -0.025 -14.779  -7.903
  694   2HB   GLU  89           HB1      GLU  89  -0.637 -15.052  -9.535
  695   1HG   GLU  89           HG2      GLU  89   0.439 -12.347  -8.825
  696   2HG   GLU  89           HG1      GLU  89   1.572 -13.652  -9.172
  697    H    HIS  90           HN       HIS  90  -2.191 -15.991  -9.115
  698    HA   HIS  90           HA       HIS  90  -4.877 -15.429 -10.220
  699   1HB   HIS  90           HB2      HIS  90  -2.863 -15.255 -11.971
  700   2HB   HIS  90           HB1      HIS  90  -3.051 -17.008 -11.978
  701    HD1  HIS  90           HD1      HIS  90  -4.491 -17.636 -13.905
  702    HD2  HIS  90           HD2      HIS  90  -5.847 -14.153 -12.061
  703    HE1  HIS  90           HE1      HIS  90  -6.614 -16.967 -15.112
  704    H    GLU  91           HN       GLU  91  -4.787 -16.806  -8.020
  705    HA   GLU  91           HA       GLU  91  -5.420 -18.869  -7.090
  706   1HB   GLU  91           HB2      GLU  91  -6.527 -18.951  -9.534
  707   2HB   GLU  91           HB1      GLU  91  -5.341 -20.239  -9.739
  708   1HG   GLU  91           HG2      GLU  91  -6.224 -21.472  -7.888
  709   2HG   GLU  91           HG1      GLU  91  -7.219 -20.110  -7.372
  710   1H    MET   0           HT1      MET   0 -11.481  -3.614 -14.363
  711   2H    MET   0           HT3      MET   0 -10.490  -4.306 -15.552
  712   3H    MET   0           HT2      MET   0  -9.791  -3.585 -14.182
  713    HA   MET   0           HA       MET   0  -9.565  -2.125 -16.075
  714   1HB   MET   0           HB2      MET   0 -12.540  -2.597 -16.202
  715   2HB   MET   0           HB1      MET   0 -11.831  -1.133 -16.880
  716   1HG   MET   0           HG2      MET   0 -10.218  -3.292 -17.756
  717   2HG   MET   0           HG1      MET   0 -11.894  -3.776 -18.009
  718   1HE   MET   0           HE3      MET   0 -13.559  -2.564 -18.798
  719   2HE   MET   0           HE2      MET   0 -13.501  -0.842 -19.163
  720   3HE   MET   0           HE1      MET   0 -13.418  -2.016 -20.475
  721    H    SER   1           HN       SER   1  -9.167  -1.721 -13.472
  722    HA   SER   1           HA       SER   1 -10.607   0.836 -12.949
  723   1HB   SER   1           HB2      SER   1 -10.763   0.284 -10.565
  724   2HB   SER   1           HB1      SER   1 -11.593  -0.941 -11.522
  725    HG   SER   1           HG       SER   1 -10.315  -2.076 -10.171
  726    H    GLU   2           HN       GLU   2  -9.377   2.065 -11.134
  727    HA   GLU   2           HA       GLU   2  -6.574   2.227 -11.949
  728   1HB   GLU   2           HB2      GLU   2  -8.046   3.712  -9.758
  729   2HB   GLU   2           HB1      GLU   2  -6.483   4.154 -10.441
  730   1HG   GLU   2           HG2      GLU   2  -9.181   4.180 -11.799
  731   2HG   GLU   2           HG1      GLU   2  -8.095   5.541 -11.519
  732    H    LEU   3           HN       LEU   3  -8.389   1.156  -9.111
  733    HA   LEU   3           HA       LEU   3  -6.018   0.743  -7.478
  734   1HB   LEU   3           HB2      LEU   3  -8.538   1.085  -6.786
  735   2HB   LEU   3           HB1      LEU   3  -8.615  -0.666  -6.968
  736    HG   LEU   3           HG       LEU   3  -6.489  -0.713  -5.493
  737   1HD1  LEU   3          HD12      LEU   3  -7.465   2.121  -5.148
  738   2HD1  LEU   3          HD11      LEU   3  -6.554   1.304  -3.878
  739   3HD1  LEU   3          HD13      LEU   3  -5.824   1.558  -5.463
  740   1HD2  LEU   3          HD21      LEU   3  -9.325  -0.346  -4.799
  741   2HD2  LEU   3          HD23      LEU   3  -8.182  -1.566  -4.239
  742   3HD2  LEU   3          HD22      LEU   3  -8.221   0.022  -3.475
  743    H    GLU   4           HN       GLU   4  -8.254  -1.475  -9.177
  744    HA   GLU   4           HA       GLU   4  -6.926  -3.869  -8.476
  745   1HB   GLU   4           HB2      GLU   4  -9.088  -3.980  -9.527
  746   2HB   GLU   4           HB1      GLU   4  -8.497  -3.139 -10.960
  747   1HG   GLU   4           HG2      GLU   4  -6.888  -5.488 -10.370
  748   2HG   GLU   4           HG1      GLU   4  -8.587  -5.906 -10.592
  749    H    LYS   5           HN       LYS   5  -6.241  -1.600 -11.125
  750    HA   LYS   5           HA       LYS   5  -4.176  -3.347 -12.236
  751   1HB   LYS   5           HB2      LYS   5  -5.212  -0.599 -12.843
  752   2HB   LYS   5           HB1      LYS   5  -3.650  -1.090 -13.495
  753   1HG   LYS   5           HG2      LYS   5  -4.568  -2.678 -14.880
  754   2HG   LYS   5           HG1      LYS   5  -5.893  -3.028 -13.770
  755   1HD   LYS   5           HD2      LYS   5  -7.194  -1.782 -15.132
  756   2HD   LYS   5           HD1      LYS   5  -6.329  -0.379 -14.501
  757   1HE   LYS   5           HE2      LYS   5  -4.590  -1.397 -16.410
  758   2HE   LYS   5           HE1      LYS   5  -6.177  -1.619 -17.148
  759   1HZ   LYS   5           HZ1      LYS   5  -5.297   0.929 -15.914
  760   2HZ   LYS   5           HZ3      LYS   5  -5.111   0.584 -17.564
  761   3HZ   LYS   5           HZ2      LYS   5  -6.665   0.665 -16.885
  762    H    ALA   6           HN       ALA   6  -4.096  -0.157 -10.601
  763    HA   ALA   6           HA       ALA   6  -1.234  -0.100 -10.394
  764   1HB   ALA   6           HB1      ALA   6  -3.323   1.323  -8.720
  765   2HB   ALA   6           HB3      ALA   6  -1.609   1.730  -8.772
  766   3HB   ALA   6           HB2      ALA   6  -2.608   1.930 -10.213
  767    H    MET   7           HN       MET   7  -3.659  -0.671  -7.826
  768    HA   MET   7           HA       MET   7  -1.916  -1.370  -5.760
  769   1HB   MET   7           HB2      MET   7  -4.369  -1.126  -5.486
  770   2HB   MET   7           HB1      MET   7  -4.606  -2.643  -6.360
  771   1HG   MET   7           HG2      MET   7  -4.653  -2.919  -3.868
  772   2HG   MET   7           HG1      MET   7  -3.400  -3.877  -4.655
  773   1HE   MET   7           HE1      MET   7  -3.637  -3.464  -1.867
  774   2HE   MET   7           HE3      MET   7  -1.947  -3.953  -2.043
  775   3HE   MET   7           HE2      MET   7  -2.363  -2.547  -1.066
  776    H    VAL   8           HN       VAL   8  -3.503  -3.656  -8.005
  777    HA   VAL   8           HA       VAL   8  -2.074  -5.937  -7.079
  778    HB   VAL   8           HB       VAL   8  -3.140  -5.495  -9.883
  779   1HG1  VAL   8          HG12      VAL   8  -2.717  -7.984  -8.198
  780   2HG1  VAL   8          HG11      VAL   8  -3.414  -7.951  -9.819
  781   3HG1  VAL   8          HG13      VAL   8  -1.727  -7.499  -9.574
  782   1HG2  VAL   8          HG23      VAL   8  -4.836  -4.963  -8.152
  783   2HG2  VAL   8          HG22      VAL   8  -5.239  -6.450  -9.010
  784   3HG2  VAL   8          HG21      VAL   8  -4.540  -6.526  -7.393
  785    H    ALA   9           HN       ALA   9  -1.188  -3.435  -9.396
  786    HA   ALA   9           HA       ALA   9   0.997  -4.799 -10.636
  787   1HB   ALA   9           HB2      ALA   9   0.443  -1.876 -10.104
  788   2HB   ALA   9           HB1      ALA   9   1.916  -2.407 -10.912
  789   3HB   ALA   9           HB3      ALA   9   0.344  -2.744 -11.636
  790    H    LEU  10           HN       LEU  10   0.865  -2.743  -7.719
  791    HA   LEU  10           HA       LEU  10   3.591  -2.761  -7.045
  792   1HB   LEU  10           HB2      LEU  10   1.186  -2.052  -5.760
  793   2HB   LEU  10           HB1      LEU  10   1.968  -3.209  -4.684
  794    HG   LEU  10           HG       LEU  10   3.646  -1.056  -5.907
  795   1HD1  LEU  10          HD13      LEU  10   1.293  -0.483  -4.430
  796   2HD1  LEU  10          HD12      LEU  10   2.655  -0.214  -3.342
  797   3HD1  LEU  10          HD11      LEU  10   2.576   0.636  -4.885
  798   1HD2  LEU  10          HD22      LEU  10   3.631  -2.828  -3.499
  799   2HD2  LEU  10          HD21      LEU  10   4.959  -2.427  -4.585
  800   3HD2  LEU  10          HD23      LEU  10   4.439  -1.267  -3.366
  801    H    ILE  11           HN       ILE  11   1.110  -5.236  -6.452
  802    HA   ILE  11           HA       ILE  11   2.701  -7.016  -4.909
  803    HB   ILE  11           HB       ILE  11   0.391  -7.445  -6.812
  804   1HG1  ILE  11          HG12      ILE  11  -0.826  -7.899  -4.757
  805   2HG1  ILE  11          HG11      ILE  11   0.665  -7.838  -3.817
  806   1HG2  ILE  11          HG22      ILE  11   1.934  -9.448  -6.814
  807   2HG2  ILE  11          HG21      ILE  11   1.672  -9.573  -5.075
  808   3HG2  ILE  11          HG23      ILE  11   0.321  -9.779  -6.188
  809   1HD1  ILE  11          HD12      ILE  11  -0.428  -5.512  -5.422
  810   2HD1  ILE  11          HD11      ILE  11  -0.673  -5.722  -3.688
  811   3HD1  ILE  11          HD13      ILE  11   0.953  -5.482  -4.325
  812    H    ASP  12           HN       ASP  12   2.349  -6.626  -8.421
  813    HA   ASP  12           HA       ASP  12   3.886  -8.815  -9.298
  814   1HB   ASP  12           HB2      ASP  12   2.618  -7.047 -10.683
  815   2HB   ASP  12           HB1      ASP  12   4.080  -6.076 -10.555
  816    H    VAL  13           HN       VAL  13   5.021  -5.502  -8.577
  817    HA   VAL  13           HA       VAL  13   7.749  -5.811  -8.995
  818    HB   VAL  13           HB       VAL  13   6.339  -4.347  -6.748
  819   1HG1  VAL  13          HG11      VAL  13   9.205  -4.774  -7.338
  820   2HG1  VAL  13          HG13      VAL  13   8.738  -3.094  -7.077
  821   3HG1  VAL  13          HG12      VAL  13   8.425  -4.299  -5.828
  822   1HG2  VAL  13          HG22      VAL  13   6.715  -3.874  -9.548
  823   2HG2  VAL  13          HG21      VAL  13   5.921  -2.837  -8.361
  824   3HG2  VAL  13          HG23      VAL  13   7.652  -2.682  -8.649
  825    H    PHE  14           HN       PHE  14   5.837  -7.009  -6.273
  826    HA   PHE  14           HA       PHE  14   7.996  -7.810  -4.602
  827   1HB   PHE  14           HB2      PHE  14   5.461  -7.811  -4.089
  828   2HB   PHE  14           HB1      PHE  14   5.441  -9.394  -4.868
  829    HD1  PHE  14           HD1      PHE  14   6.886 -11.243  -3.971
  830    HD2  PHE  14           HD2      PHE  14   6.384  -7.514  -1.907
  831    HE1  PHE  14           HE1      PHE  14   7.760 -12.275  -1.891
  832    HE2  PHE  14           HE2      PHE  14   7.257  -8.542   0.172
  833    HZ   PHE  14           HZ       PHE  14   7.946 -10.923   0.181
  834    H    HIS  15           HN       HIS  15   6.206  -9.679  -7.077
  835    HA   HIS  15           HA       HIS  15   8.051 -11.924  -6.852
  836   1HB   HIS  15           HB2      HIS  15   5.524 -11.801  -7.716
  837   2HB   HIS  15           HB1      HIS  15   6.332 -11.581  -9.269
  838    HD1  HIS  15           HD1      HIS  15   6.428 -13.964  -6.296
  839    HD2  HIS  15           HD2      HIS  15   7.243 -13.948 -10.383
  840    HE1  HIS  15           HE1      HIS  15   7.021 -16.346  -6.919
  841    H    GLN  16           HN       GLN  16   8.486  -8.914  -8.076
  842    HA   GLN  16           HA       GLN  16   9.786  -9.568 -10.599
  843   1HB   GLN  16           HB2      GLN  16   8.799  -7.259  -9.621
  844   2HB   GLN  16           HB1      GLN  16  10.482  -7.066  -9.131
  845   1HG   GLN  16           HG2      GLN  16  10.674  -6.214 -11.252
  846   2HG   GLN  16           HG1      GLN  16  10.866  -7.919 -11.659
  847   1HE2  GLN  16          HE22      GLN  16   8.234  -7.155 -13.976
  848   2HE2  GLN  16          HE21      GLN  16   9.920  -7.282 -13.829
  849    H    TYR  17           HN       TYR  17  10.922  -8.574  -7.357
  850    HA   TYR  17           HA       TYR  17  13.383 -10.152  -7.868
  851   1HB   TYR  17           HB2      TYR  17  14.467  -8.147  -6.449
  852   2HB   TYR  17           HB1      TYR  17  14.429  -8.152  -8.208
  853    HD1  TYR  17           HD1      TYR  17  11.794  -7.418  -5.613
  854    HD2  TYR  17           HD2      TYR  17  14.051  -5.999  -8.982
  855    HE1  TYR  17           HE1      TYR  17  10.518  -5.293  -5.581
  856    HE2  TYR  17           HE2      TYR  17  12.773  -3.882  -8.947
  857    HH   TYR  17           HH       TYR  17  10.626  -3.049  -8.156
  858    H    SER  18           HN       SER  18  11.811 -11.493  -6.448
  859    HA   SER  18           HA       SER  18  12.433 -10.886  -3.585
  860   1HB   SER  18           HB2      SER  18  10.090 -10.530  -3.738
  861   2HB   SER  18           HB1      SER  18   9.872 -11.891  -4.835
  862    HG   SER  18           HG       SER  18   9.745 -11.859  -2.179
  863    H    GLY  19           HN       GLY  19  11.896 -13.330  -6.081
  864   1HA   GLY  19           HA2      GLY  19  12.914 -15.433  -4.262
  865   2HA   GLY  19           HA1      GLY  19  12.175 -15.715  -5.839
  866    H    ARG  20           HN       ARG  20  13.951 -13.364  -6.810
  867    HA   ARG  20           HA       ARG  20  16.134 -15.064  -7.730
  868   1HB   ARG  20           HB2      ARG  20  15.555 -12.114  -8.105
  869   2HB   ARG  20           HB1      ARG  20  16.907 -12.952  -8.862
  870   1HG   ARG  20           HG2      ARG  20  15.376 -14.463 -10.019
  871   2HG   ARG  20           HG1      ARG  20  13.997 -13.733  -9.197
  872   1HD   ARG  20           HD2      ARG  20  14.013 -12.648 -11.287
  873   2HD   ARG  20           HD1      ARG  20  14.840 -11.504 -10.229
  874    HE   ARG  20           HE       ARG  20  16.974 -12.258 -11.208
  875   1HH1  ARG  20          HH21      ARG  20  16.823 -14.784 -12.335
  876   2HH1  ARG  20          HH22      ARG  20  16.356 -14.563 -13.988
  877   1HH2  ARG  20          HH11      ARG  20  15.176 -11.340 -13.500
  878   2HH2  ARG  20          HH12      ARG  20  15.423 -12.614 -14.648
  879    H    GLU  21           HN       GLU  21  15.858 -12.210  -5.625
  880    HA   GLU  21           HA       GLU  21  18.697 -12.332  -4.912
  881   1HB   GLU  21           HB2      GLU  21  16.890 -10.304  -4.908
  882   2HB   GLU  21           HB1      GLU  21  16.833 -10.777  -3.211
  883   1HG   GLU  21           HG2      GLU  21  19.038 -10.198  -2.827
  884   2HG   GLU  21           HG1      GLU  21  19.515 -10.497  -4.498
  885    H    GLY  22           HN       GLY  22  15.860 -12.304  -2.740
  886   1HA   GLY  22           HA2      GLY  22  17.267 -13.852  -0.735
  887   2HA   GLY  22           HA1      GLY  22  15.557 -13.421  -0.691
  888    H    ASP  23           HN       ASP  23  14.374 -15.268  -0.553
  889    HA   ASP  23           HA       ASP  23  15.240 -17.594  -2.222
  890   1HB   ASP  23           HB2      ASP  23  15.097 -17.754   0.386
  891   2HB   ASP  23           HB1      ASP  23  13.356 -17.827   0.111
  892    H    LYS  24           HN       LYS  24  12.230 -16.274  -0.784
  893    HA   LYS  24           HA       LYS  24  10.825 -15.722  -3.119
  894   1HB   LYS  24           HB2      LYS  24  11.075 -17.917  -3.985
  895   2HB   LYS  24           HB1      LYS  24  10.778 -18.659  -2.415
  896   1HG   LYS  24           HG2      LYS  24   8.466 -18.228  -2.514
  897   2HG   LYS  24           HG1      LYS  24   8.657 -16.990  -3.757
  898   1HD   LYS  24           HD2      LYS  24   7.807 -18.904  -4.899
  899   2HD   LYS  24           HD1      LYS  24   9.530 -18.862  -5.273
  900   1HE   LYS  24           HE2      LYS  24   9.926 -20.454  -3.382
  901   2HE   LYS  24           HE1      LYS  24   8.180 -20.576  -3.172
  902   1HZ   LYS  24           HZ3      LYS  24   8.311 -21.071  -5.740
  903   2HZ   LYS  24           HZ2      LYS  24   9.873 -21.597  -5.324
  904   3HZ   LYS  24           HZ1      LYS  24   8.513 -22.299  -4.587
  905    H    HIS  25           HN       HIS  25   8.689 -15.094  -2.620
  906    HA   HIS  25           HA       HIS  25   6.875 -14.543  -1.254
  907   1HB   HIS  25           HB2      HIS  25   6.339 -16.813  -0.982
  908   2HB   HIS  25           HB1      HIS  25   7.794 -17.152  -0.054
  909    HD1  HIS  25           HD1      HIS  25   7.747 -16.655   2.470
  910    HD2  HIS  25           HD2      HIS  25   4.228 -15.570   0.518
  911    HE1  HIS  25           HE1      HIS  25   6.052 -16.152   4.283
  912    H    LYS  26           HN       LYS  26   9.909 -13.941  -0.537
  913    HA   LYS  26           HA       LYS  26   9.174 -12.599   2.014
  914   1HB   LYS  26           HB2      LYS  26  11.919 -13.774   1.799
  915   2HB   LYS  26           HB1      LYS  26  10.957 -13.435   3.237
  916   1HG   LYS  26           HG2      LYS  26   9.360 -15.278   2.273
  917   2HG   LYS  26           HG1      LYS  26  10.782 -15.765   1.354
  918   1HD   LYS  26           HD2      LYS  26  12.025 -15.687   3.627
  919   2HD   LYS  26           HD1      LYS  26  10.413 -15.712   4.343
  920   1HE   LYS  26           HE2      LYS  26  10.014 -17.876   3.706
  921   2HE   LYS  26           HE1      LYS  26  10.919 -17.708   2.203
  922   1HZ   LYS  26           HZ3      LYS  26  12.879 -17.458   3.963
  923   2HZ   LYS  26           HZ2      LYS  26  11.841 -18.465   4.854
  924   3HZ   LYS  26           HZ1      LYS  26  12.400 -18.955   3.326
  925    H    LEU  27           HN       LEU  27  10.897 -10.925   2.590
  926    HA   LEU  27           HA       LEU  27  12.185  -9.814   0.137
  927   1HB   LEU  27           HB2      LEU  27  10.024  -8.673   1.702
  928   2HB   LEU  27           HB1      LEU  27  11.443  -7.626   1.746
  929    HG   LEU  27           HG       LEU  27   9.874  -7.188  -0.191
  930   1HD1  LEU  27          HD13      LEU  27  12.318  -6.599  -0.180
  931   2HD1  LEU  27          HD12      LEU  27  12.641  -8.137  -0.980
  932   3HD1  LEU  27          HD11      LEU  27  11.673  -6.909  -1.793
  933   1HD2  LEU  27          HD23      LEU  27   9.820  -9.915  -0.409
  934   2HD2  LEU  27          HD22      LEU  27   9.367  -8.813  -1.708
  935   3HD2  LEU  27          HD21      LEU  27  10.990  -9.498  -1.659
  936    H    LYS  28           HN       LYS  28  13.353  -7.583   1.351
  937    HA   LYS  28           HA       LYS  28  14.782  -8.543   3.749
  938   1HB   LYS  28           HB2      LYS  28  15.852  -8.975   1.201
  939   2HB   LYS  28           HB1      LYS  28  16.698  -7.549   1.805
  940   1HG   LYS  28           HG2      LYS  28  17.359  -8.709   3.814
  941   2HG   LYS  28           HG1      LYS  28  16.353 -10.097   3.399
  942   1HD   LYS  28           HD2      LYS  28  17.803 -10.833   1.747
  943   2HD   LYS  28           HD1      LYS  28  18.436  -9.217   1.441
  944   1HE   LYS  28           HE2      LYS  28  18.969 -10.108   4.170
  945   2HE   LYS  28           HE1      LYS  28  19.675 -11.184   2.966
  946   1HZ   LYS  28           HZ1      LYS  28  20.477  -9.040   1.873
  947   2HZ   LYS  28           HZ3      LYS  28  20.144  -8.299   3.360
  948   3HZ   LYS  28           HZ2      LYS  28  21.278  -9.557   3.279
  949    H    LYS  29           HN       LYS  29  16.375  -6.771   4.486
  950    HA   LYS  29           HA       LYS  29  14.951  -4.220   4.416
  951   1HB   LYS  29           HB2      LYS  29  17.655  -4.774   5.658
  952   2HB   LYS  29           HB1      LYS  29  16.513  -3.500   6.088
  953   1HG   LYS  29           HG2      LYS  29  16.132  -6.481   6.470
  954   2HG   LYS  29           HG1      LYS  29  16.332  -5.267   7.736
  955   1HD   LYS  29           HD2      LYS  29  14.245  -4.154   6.566
  956   2HD   LYS  29           HD1      LYS  29  13.966  -5.789   5.968
  957   1HE   LYS  29           HE2      LYS  29  13.233  -6.480   7.984
  958   2HE   LYS  29           HE1      LYS  29  14.644  -5.800   8.797
  959   1HZ   LYS  29           HZ1      LYS  29  13.526  -3.585   8.531
  960   2HZ   LYS  29           HZ3      LYS  29  12.125  -4.421   8.071
  961   3HZ   LYS  29           HZ2      LYS  29  12.780  -4.652   9.622
  962    H    SER  30           HN       SER  30  17.711  -5.650   2.847
  963    HA   SER  30           HA       SER  30  18.804  -3.096   1.923
  964   1HB   SER  30           HB2      SER  30  19.998  -4.860   0.301
  965   2HB   SER  30           HB1      SER  30  20.506  -4.656   1.975
  966    HG   SER  30           HG       SER  30  20.151  -6.840   1.525
  967    H    GLU  31           HN       GLU  31  16.745  -5.662   0.586
  968    HA   GLU  31           HA       GLU  31  16.574  -4.300  -2.011
  969   1HB   GLU  31           HB2      GLU  31  16.445  -6.848  -1.638
  970   2HB   GLU  31           HB1      GLU  31  14.812  -6.560  -1.041
  971   1HG   GLU  31           HG2      GLU  31  14.578  -5.182  -3.288
  972   2HG   GLU  31           HG1      GLU  31  15.904  -6.221  -3.809
  973    H    LEU  32           HN       LEU  32  14.990  -4.292   1.038
  974    HA   LEU  32           HA       LEU  32  12.473  -3.166   0.038
  975   1HB   LEU  32           HB2      LEU  32  12.327  -4.427   2.085
  976   2HB   LEU  32           HB1      LEU  32  13.648  -3.512   2.812
  977    HG   LEU  32           HG       LEU  32  12.284  -1.472   2.778
  978   1HD1  LEU  32          HD12      LEU  32  10.434  -3.274   1.255
  979   2HD1  LEU  32          HD11      LEU  32   9.746  -1.991   2.250
  980   3HD1  LEU  32          HD13      LEU  32  10.861  -1.593   0.945
  981   1HD2  LEU  32          HD21      LEU  32  11.104  -3.952   4.030
  982   2HD2  LEU  32          HD23      LEU  32  12.031  -2.667   4.803
  983   3HD2  LEU  32          HD22      LEU  32  10.373  -2.368   4.284
  984    H    LYS  33           HN       LYS  33  15.478  -2.065   1.519
  985    HA   LYS  33           HA       LYS  33  14.762   0.684   1.866
  986   1HB   LYS  33           HB2      LYS  33  16.875  -0.766   2.617
  987   2HB   LYS  33           HB1      LYS  33  17.563  -0.074   1.156
  988   1HG   LYS  33           HG2      LYS  33  16.664   2.188   2.070
  989   2HG   LYS  33           HG1      LYS  33  16.555   1.346   3.615
  990   1HD   LYS  33           HD2      LYS  33  18.888   0.933   3.684
  991   2HD   LYS  33           HD1      LYS  33  19.087   1.314   1.974
  992   1HE   LYS  33           HE2      LYS  33  19.469   3.469   2.481
  993   2HE   LYS  33           HE1      LYS  33  17.898   3.573   3.275
  994   1HZ   LYS  33           HZ3      LYS  33  20.174   2.311   4.654
  995   2HZ   LYS  33           HZ2      LYS  33  20.022   4.002   4.639
  996   3HZ   LYS  33           HZ1      LYS  33  18.795   3.043   5.316
  997    H    GLU  34           HN       GLU  34  16.007  -1.171  -0.849
  998    HA   GLU  34           HA       GLU  34  16.424   1.198  -2.515
  999   1HB   GLU  34           HB2      GLU  34  17.251  -0.298  -4.127
 1000   2HB   GLU  34           HB1      GLU  34  17.608  -1.147  -2.626
 1001   1HG   GLU  34           HG2      GLU  34  15.684  -2.563  -2.870
 1002   2HG   GLU  34           HG1      GLU  34  15.090  -1.621  -4.235
 1003    H    LEU  35           HN       LEU  35  14.089  -1.399  -2.198
 1004    HA   LEU  35           HA       LEU  35  12.368  -0.980  -4.323
 1005   1HB   LEU  35           HB2      LEU  35  12.276  -2.366  -1.911
 1006   2HB   LEU  35           HB1      LEU  35  10.914  -1.247  -1.796
 1007    HG   LEU  35           HG       LEU  35  10.132  -3.275  -2.866
 1008   1HD1  LEU  35          HD13      LEU  35   9.882  -0.743  -3.933
 1009   2HD1  LEU  35          HD12      LEU  35  10.407  -1.689  -5.325
 1010   3HD1  LEU  35          HD11      LEU  35   8.951  -2.150  -4.445
 1011   1HD2  LEU  35          HD21      LEU  35  12.755  -3.294  -3.941
 1012   2HD2  LEU  35          HD23      LEU  35  11.499  -4.510  -4.160
 1013   3HD2  LEU  35          HD22      LEU  35  11.650  -3.184  -5.311
 1014    H    ILE  36           HN       ILE  36  12.288   0.743  -1.193
 1015    HA   ILE  36           HA       ILE  36  10.269   2.615  -2.166
 1016    HB   ILE  36           HB       ILE  36  11.918   3.288   0.218
 1017   1HG1  ILE  36          HG12      ILE  36  10.330   0.755  -0.098
 1018   2HG1  ILE  36          HG11      ILE  36  11.855   1.017   0.739
 1019   1HG2  ILE  36          HG21      ILE  36   9.641   4.275  -0.812
 1020   2HG2  ILE  36          HG23      ILE  36   8.952   3.029   0.229
 1021   3HG2  ILE  36          HG22      ILE  36   9.975   4.289   0.921
 1022   1HD1  ILE  36          HD12      ILE  36   9.160   2.041   1.672
 1023   2HD1  ILE  36          HD11      ILE  36  10.014   0.653   2.345
 1024   3HD1  ILE  36          HD13      ILE  36  10.695   2.271   2.509
 1025    H    ASN  37           HN       ASN  37  13.727   2.878  -1.307
 1026    HA   ASN  37           HA       ASN  37  13.911   5.609  -2.221
 1027   1HB   ASN  37           HB2      ASN  37  15.449   4.444  -0.545
 1028   2HB   ASN  37           HB1      ASN  37  16.216   3.676  -1.935
 1029   1HD2  ASN  37          HD22      ASN  37  17.202   7.455  -1.005
 1030   2HD2  ASN  37          HD21      ASN  37  16.282   6.465   0.019
 1031    H    ASN  38           HN       ASN  38  15.615   2.750  -3.545
 1032    HA   ASN  38           HA       ASN  38  16.396   3.812  -5.969
 1033   1HB   ASN  38           HB2      ASN  38  16.983   1.534  -5.360
 1034   2HB   ASN  38           HB1      ASN  38  15.299   1.031  -5.480
 1035   1HD2  ASN  38          HD22      ASN  38  15.278   1.174  -9.092
 1036   2HD2  ASN  38          HD21      ASN  38  14.278   1.438  -7.748
 1037    H    GLU  39           HN       GLU  39  13.098   3.120  -5.009
 1038    HA   GLU  39           HA       GLU  39  12.238   3.615  -7.823
 1039   1HB   GLU  39           HB2      GLU  39  10.568   2.517  -5.556
 1040   2HB   GLU  39           HB1      GLU  39  10.171   2.519  -7.274
 1041   1HG   GLU  39           HG2      GLU  39  12.704   1.202  -6.343
 1042   2HG   GLU  39           HG1      GLU  39  11.171   0.346  -6.192
 1043    H    LEU  40           HN       LEU  40  10.500   4.201  -4.749
 1044    HA   LEU  40           HA       LEU  40   9.245   6.548  -5.775
 1045   1HB   LEU  40           HB2      LEU  40   9.589   5.847  -2.858
 1046   2HB   LEU  40           HB1      LEU  40   8.301   6.789  -3.594
 1047    HG   LEU  40           HG       LEU  40   8.758   3.825  -3.690
 1048   1HD1  LEU  40          HD12      LEU  40   7.166   4.880  -2.083
 1049   2HD1  LEU  40          HD11      LEU  40   6.261   5.524  -3.453
 1050   3HD1  LEU  40          HD13      LEU  40   6.373   3.782  -3.213
 1051   1HD2  LEU  40          HD23      LEU  40   7.560   5.549  -5.843
 1052   2HD2  LEU  40          HD22      LEU  40   8.562   4.108  -6.005
 1053   3HD2  LEU  40          HD21      LEU  40   6.871   3.957  -5.531
 1054    H    SER  41           HN       SER  41  12.411   6.188  -4.522
 1055    HA   SER  41           HA       SER  41  12.803   8.640  -3.164
 1056   1HB   SER  41           HB2      SER  41  14.563   6.926  -3.301
 1057   2HB   SER  41           HB1      SER  41  14.732   7.226  -5.027
 1058    HG   SER  41           HG       SER  41  16.121   8.375  -3.291
 1059    H    HIS  42           HN       HIS  42  12.835   7.967  -6.662
 1060    HA   HIS  42           HA       HIS  42  13.692  10.548  -7.506
 1061   1HB   HIS  42           HB2      HIS  42  12.339   8.229  -8.740
 1062   2HB   HIS  42           HB1      HIS  42  12.013   9.775  -9.519
 1063    HD1  HIS  42           HD1      HIS  42  13.506   9.433 -11.565
 1064    HD2  HIS  42           HD2      HIS  42  15.549   8.925  -7.967
 1065    HE1  HIS  42           HE1      HIS  42  15.966   9.305 -12.150
 1066    H    PHE  43           HN       PHE  43  10.579   9.383  -6.408
 1067    HA   PHE  43           HA       PHE  43   9.327  11.975  -7.163
 1068   1HB   PHE  43           HB2      PHE  43   8.004  10.131  -7.886
 1069   2HB   PHE  43           HB1      PHE  43   8.201   9.291  -6.348
 1070    HD1  PHE  43           HD1      PHE  43   7.143  12.739  -7.409
 1071    HD2  PHE  43           HD2      PHE  43   6.269   9.251  -5.065
 1072    HE1  PHE  43           HE1      PHE  43   5.086  13.829  -6.555
 1073    HE2  PHE  43           HE2      PHE  43   4.214  10.341  -4.209
 1074    HZ   PHE  43           HZ       PHE  43   3.622  12.629  -4.954
 1075    H    LEU  44           HN       LEU  44  10.991  10.758  -4.608
 1076    HA   LEU  44           HA       LEU  44   9.286  12.188  -2.609
 1077   1HB   LEU  44           HB2      LEU  44   9.647   9.795  -2.107
 1078   2HB   LEU  44           HB1      LEU  44  11.390  10.052  -2.151
 1079    HG   LEU  44           HG       LEU  44  10.140  11.992  -0.409
 1080   1HD1  LEU  44          HD13      LEU  44   8.458  10.095  -0.243
 1081   2HD1  LEU  44          HD12      LEU  44   9.761   9.104   0.411
 1082   3HD1  LEU  44          HD11      LEU  44   9.231  10.545   1.278
 1083   1HD2  LEU  44          HD22      LEU  44  12.115   9.725  -0.002
 1084   2HD2  LEU  44          HD21      LEU  44  12.505  11.412  -0.332
 1085   3HD2  LEU  44          HD23      LEU  44  11.763  10.965   1.203
 1086    H    GLU  45           HN       GLU  45  10.122  14.038  -1.760
 1087    HA   GLU  45           HA       GLU  45  12.969  14.403  -1.320
 1088   1HB   GLU  45           HB2      GLU  45  13.250  16.316  -2.867
 1089   2HB   GLU  45           HB1      GLU  45  12.904  14.826  -3.742
 1090   1HG   GLU  45           HG2      GLU  45  10.535  15.459  -3.918
 1091   2HG   GLU  45           HG1      GLU  45  10.855  16.938  -3.010
 1092    H    GLU  46           HN       GLU  46  10.238  14.669  -0.025
 1093    HA   GLU  46           HA       GLU  46  10.689  17.404   1.085
 1094   1HB   GLU  46           HB2      GLU  46   8.101  16.162   0.145
 1095   2HB   GLU  46           HB1      GLU  46   8.114  17.447   1.352
 1096   1HG   GLU  46           HG2      GLU  46   9.573  17.732  -1.275
 1097   2HG   GLU  46           HG1      GLU  46   7.869  18.158  -1.112
 1098    H    ILE  47           HN       ILE  47   8.838  14.382   1.573
 1099    HA   ILE  47           HA       ILE  47   8.403  13.183   3.537
 1100    HB   ILE  47           HB       ILE  47  11.131  14.335   4.159
 1101   1HG1  ILE  47          HG12      ILE  47  10.772  11.455   3.674
 1102   2HG1  ILE  47          HG11      ILE  47  10.364  12.464   2.286
 1103   1HG2  ILE  47          HG23      ILE  47   9.255  12.837   5.819
 1104   2HG2  ILE  47          HG22      ILE  47  10.788  11.990   5.620
 1105   3HG2  ILE  47          HG21      ILE  47  10.762  13.628   6.273
 1106   1HD1  ILE  47          HD12      ILE  47  12.848  13.213   3.716
 1107   2HD1  ILE  47          HD11      ILE  47  12.899  11.670   2.864
 1108   3HD1  ILE  47          HD13      ILE  47  12.521  13.149   1.985
 1109    H    LYS  48           HN       LYS  48   6.631  14.305   4.402
 1110    HA   LYS  48           HA       LYS  48   7.177  16.665   6.115
 1111   1HB   LYS  48           HB2      LYS  48   5.252  16.604   4.441
 1112   2HB   LYS  48           HB1      LYS  48   4.490  15.416   5.499
 1113   1HG   LYS  48           HG2      LYS  48   5.403  17.601   7.109
 1114   2HG   LYS  48           HG1      LYS  48   4.471  18.253   5.761
 1115   1HD   LYS  48           HD2      LYS  48   2.588  17.656   6.837
 1116   2HD   LYS  48           HD1      LYS  48   3.067  15.968   6.653
 1117   1HE   LYS  48           HE2      LYS  48   3.321  15.838   8.883
 1118   2HE   LYS  48           HE1      LYS  48   4.629  17.013   8.770
 1119   1HZ   LYS  48           HZ1      LYS  48   2.827  18.753   8.766
 1120   2HZ   LYS  48           HZ3      LYS  48   1.752  17.528   9.234
 1121   3HZ   LYS  48           HZ2      LYS  48   3.066  17.932  10.233
 1122    H    GLU  49           HN       GLU  49   6.101  13.318   6.277
 1123    HA   GLU  49           HA       GLU  49   5.598  13.521   9.179
 1124   1HB   GLU  49           HB2      GLU  49   4.906  11.673   7.038
 1125   2HB   GLU  49           HB1      GLU  49   5.560  10.819   8.436
 1126   1HG   GLU  49           HG2      GLU  49   3.350  12.887   8.580
 1127   2HG   GLU  49           HG1      GLU  49   3.082  11.145   8.562
 1128    H    GLN  50           HN       GLN  50   8.004  14.220   9.314
 1129    HA   GLN  50           HA       GLN  50  10.214  12.637   8.828
 1130   1HB   GLN  50           HB2      GLN  50  10.374  14.827   9.927
 1131   2HB   GLN  50           HB1      GLN  50   9.630  14.167  11.382
 1132   1HG   GLN  50           HG2      GLN  50  11.766  13.784  12.051
 1133   2HG   GLN  50           HG1      GLN  50  11.682  12.397  10.966
 1134   1HE2  GLN  50          HE22      GLN  50  14.563  14.828  10.149
 1135   2HE2  GLN  50          HE21      GLN  50  13.993  14.310  11.662
 1136    H    GLU  51           HN       GLU  51   7.649  12.023  11.119
 1137    HA   GLU  51           HA       GLU  51   9.097   9.984  12.603
 1138   1HB   GLU  51           HB2      GLU  51   6.855  11.399  13.132
 1139   2HB   GLU  51           HB1      GLU  51   6.131   9.907  12.532
 1140   1HG   GLU  51           HG2      GLU  51   7.731   8.681  14.125
 1141   2HG   GLU  51           HG1      GLU  51   8.017  10.256  14.867
 1142    H    VAL  52           HN       VAL  52   6.638   9.926  10.012
 1143    HA   VAL  52           HA       VAL  52   6.420   7.093   9.833
 1144    HB   VAL  52           HB       VAL  52   6.111   9.197   7.672
 1145   1HG1  VAL  52          HG12      VAL  52   5.796   6.252   7.704
 1146   2HG1  VAL  52          HG11      VAL  52   4.465   7.150   6.975
 1147   3HG1  VAL  52          HG13      VAL  52   6.101   7.337   6.347
 1148   1HG2  VAL  52          HG22      VAL  52   4.664   9.172   9.862
 1149   2HG2  VAL  52          HG21      VAL  52   3.864   9.346   8.300
 1150   3HG2  VAL  52          HG23      VAL  52   3.884   7.781   9.109
 1151    H    VAL  53           HN       VAL  53   8.378   9.315   7.818
 1152    HA   VAL  53           HA       VAL  53   9.775   7.189   6.485
 1153    HB   VAL  53           HB       VAL  53  10.486  10.107   6.898
 1154   1HG1  VAL  53          HG13      VAL  53  11.732   8.019   5.085
 1155   2HG1  VAL  53          HG12      VAL  53  12.078   9.746   5.022
 1156   3HG1  VAL  53          HG11      VAL  53  12.514   8.812   6.452
 1157   1HG2  VAL  53          HG22      VAL  53   8.937   8.532   4.885
 1158   2HG2  VAL  53          HG21      VAL  53   8.645  10.156   5.503
 1159   3HG2  VAL  53          HG23      VAL  53   9.903   9.884   4.297
 1160    H    ASP  54           HN       ASP  54  10.311   8.883   9.510
 1161    HA   ASP  54           HA       ASP  54  13.040   7.922   9.825
 1162   1HB   ASP  54           HB2      ASP  54  12.322   9.941  11.004
 1163   2HB   ASP  54           HB1      ASP  54  11.069   9.031  11.848
 1164    H    LYS  55           HN       LYS  55   9.871   6.635  10.380
 1165    HA   LYS  55           HA       LYS  55  10.767   4.616  12.298
 1166   1HB   LYS  55           HB2      LYS  55   8.464   5.391  12.418
 1167   2HB   LYS  55           HB1      LYS  55   8.184   4.918  10.742
 1168   1HG   LYS  55           HG2      LYS  55   9.257   2.742  12.391
 1169   2HG   LYS  55           HG1      LYS  55   7.688   3.328  12.943
 1170   1HD   LYS  55           HD2      LYS  55   7.030   3.207  10.418
 1171   2HD   LYS  55           HD1      LYS  55   8.423   2.133  10.282
 1172   1HE   LYS  55           HE2      LYS  55   6.656   0.650  10.735
 1173   2HE   LYS  55           HE1      LYS  55   7.382   0.899  12.323
 1174   1HZ   LYS  55           HZ1      LYS  55   5.722   2.717  12.644
 1175   2HZ   LYS  55           HZ3      LYS  55   4.951   2.192  11.226
 1176   3HZ   LYS  55           HZ2      LYS  55   5.059   1.156  12.567
 1177    H    VAL  56           HN       VAL  56   9.660   4.540   8.878
 1178    HA   VAL  56           HA       VAL  56  10.358   1.763   8.552
 1179    HB   VAL  56           HB       VAL  56  10.094   2.243   6.133
 1180   1HG1  VAL  56          HG13      VAL  56   8.131   2.825   8.213
 1181   2HG1  VAL  56          HG12      VAL  56   7.765   3.648   6.696
 1182   3HG1  VAL  56          HG11      VAL  56   7.943   1.894   6.727
 1183   1HG2  VAL  56          HG21      VAL  56   9.936   5.097   7.127
 1184   2HG2  VAL  56          HG23      VAL  56  11.093   4.430   5.978
 1185   3HG2  VAL  56          HG22      VAL  56   9.399   4.598   5.523
 1186    H    MET  57           HN       MET  57  11.958   4.806   7.658
 1187    HA   MET  57           HA       MET  57  14.310   3.614   6.539
 1188   1HB   MET  57           HB2      MET  57  13.559   6.057   6.392
 1189   2HB   MET  57           HB1      MET  57  14.182   6.240   8.034
 1190   1HG   MET  57           HG2      MET  57  15.906   6.907   6.434
 1191   2HG   MET  57           HG1      MET  57  16.400   5.421   7.245
 1192   1HE   MET  57           HE1      MET  57  14.256   6.775   4.466
 1193   2HE   MET  57           HE3      MET  57  14.371   5.614   3.135
 1194   3HE   MET  57           HE2      MET  57  13.456   5.211   4.585
 1195    H    GLU  58           HN       GLU  58  13.170   3.994   9.773
 1196    HA   GLU  58           HA       GLU  58  15.745   3.873  11.096
 1197   1HB   GLU  58           HB2      GLU  58  12.920   3.876  11.878
 1198   2HB   GLU  58           HB1      GLU  58  13.913   2.833  12.895
 1199   1HG   GLU  58           HG2      GLU  58  15.418   4.646  13.413
 1200   2HG   GLU  58           HG1      GLU  58  14.638   5.696  12.230
 1201    H    THR  59           HN       THR  59  13.157   1.387  10.736
 1202    HA   THR  59           HA       THR  59  14.755  -0.766  11.716
 1203    HB   THR  59           HB       THR  59  12.828  -1.328   9.508
 1204    HG1  THR  59           HG1      THR  59  11.162  -0.976  11.223
 1205   1HG2  THR  59          HG21      THR  59  13.503  -2.423  12.231
 1206   2HG2  THR  59          HG23      THR  59  12.015  -2.893  11.411
 1207   3HG2  THR  59          HG22      THR  59  13.576  -3.234  10.667
 1208    H    LEU  60           HN       LEU  60  14.351   0.638   8.522
 1209    HA   LEU  60           HA       LEU  60  15.799  -1.204   6.956
 1210   1HB   LEU  60           HB2      LEU  60  15.169   1.710   6.812
 1211   2HB   LEU  60           HB1      LEU  60  16.427   1.106   5.739
 1212    HG   LEU  60           HG       LEU  60  13.663  -0.109   5.979
 1213   1HD1  LEU  60          HD13      LEU  60  14.827   1.889   4.034
 1214   2HD1  LEU  60          HD12      LEU  60  13.427   0.897   3.633
 1215   3HD1  LEU  60          HD11      LEU  60  13.349   2.031   4.982
 1216   1HD2  LEU  60          HD23      LEU  60  16.156  -0.902   4.698
 1217   2HD2  LEU  60          HD22      LEU  60  14.672  -1.827   4.916
 1218   3HD2  LEU  60          HD21      LEU  60  14.845  -0.755   3.527
 1219    H    ASP  61           HN       ASP  61  17.015   1.767   8.530
 1220    HA   ASP  61           HA       ASP  61  19.793   0.971   8.081
 1221   1HB   ASP  61           HB2      ASP  61  18.618   3.390   8.361
 1222   2HB   ASP  61           HB1      ASP  61  19.147   3.128  10.024
 1223    H    GLU  62           HN       GLU  62  17.476  -0.016  10.240
 1224    HA   GLU  62           HA       GLU  62  18.953  -0.014  12.713
 1225   1HB   GLU  62           HB2      GLU  62  16.537  -0.338  12.725
 1226   2HB   GLU  62           HB1      GLU  62  16.698  -1.795  11.743
 1227   1HG   GLU  62           HG2      GLU  62  17.852  -2.951  13.514
 1228   2HG   GLU  62           HG1      GLU  62  17.986  -1.472  14.466
 1229    H    ASP  63           HN       ASP  63  18.813  -2.178   9.944
 1230    HA   ASP  63           HA       ASP  63  21.223  -3.536  10.958
 1231   1HB   ASP  63           HB2      ASP  63  19.256  -4.833  11.837
 1232   2HB   ASP  63           HB1      ASP  63  18.772  -5.130  10.166
 1233    H    GLY  64           HN       GLY  64  18.752  -3.529   8.385
 1234   1HA   GLY  64           HA2      GLY  64  19.171  -3.148   6.063
 1235   2HA   GLY  64           HA1      GLY  64  20.901  -3.285   6.380
 1236    H    ASP  65           HN       ASP  65  20.182  -5.825   7.986
 1237    HA   ASP  65           HA       ASP  65  19.860  -7.615   5.610
 1238   1HB   ASP  65           HB2      ASP  65  22.181  -7.513   6.696
 1239   2HB   ASP  65           HB1      ASP  65  21.444  -8.296   8.093
 1240    H    GLY  66           HN       GLY  66  17.550  -7.676   6.118
 1241   1HA   GLY  66           HA2      GLY  66  16.979  -9.631   8.264
 1242   2HA   GLY  66           HA1      GLY  66  16.072  -8.121   8.269
 1243    H    GLU  67           HN       GLU  67  14.377 -10.047   8.032
 1244    HA   GLU  67           HA       GLU  67  13.882 -10.389   5.100
 1245   1HB   GLU  67           HB2      GLU  67  13.300 -12.274   7.398
 1246   2HB   GLU  67           HB1      GLU  67  12.611 -12.475   5.785
 1247   1HG   GLU  67           HG2      GLU  67  14.587 -13.166   4.883
 1248   2HG   GLU  67           HG1      GLU  67  15.535 -12.035   5.851
 1249    H    CYS  68           HN       CYS  68  12.017  -9.458   4.405
 1250    HA   CYS  68           HA       CYS  68  10.034  -8.631   6.485
 1251   1HB   CYS  68           HB2      CYS  68  10.794  -7.465   3.807
 1252   2HB   CYS  68           HB1      CYS  68   9.284  -7.032   4.606
 1253    HG   CYS  68           HG       CYS  68  12.073  -6.553   5.947
 1254    H    ASP  69           HN       ASP  69   7.724  -8.539   5.602
 1255    HA   ASP  69           HA       ASP  69   7.211 -11.066   4.114
 1256   1HB   ASP  69           HB2      ASP  69   5.307  -9.311   5.697
 1257   2HB   ASP  69           HB1      ASP  69   4.919 -10.878   4.987
 1258    H    PHE  70           HN       PHE  70   4.760 -10.586   2.993
 1259    HA   PHE  70           HA       PHE  70   5.495  -8.746   0.828
 1260   1HB   PHE  70           HB2      PHE  70   3.153  -9.522  -0.043
 1261   2HB   PHE  70           HB1      PHE  70   4.498 -10.657  -0.067
 1262    HD1  PHE  70           HD1      PHE  70   4.627 -12.503   1.534
 1263    HD2  PHE  70           HD2      PHE  70   1.337  -9.747   1.566
 1264    HE1  PHE  70           HE1      PHE  70   3.347 -14.049   2.987
 1265    HE2  PHE  70           HE2      PHE  70   0.057 -11.291   3.021
 1266    HZ   PHE  70           HZ       PHE  70   1.062 -13.443   3.732
 1267    H    GLN  71           HN       GLN  71   3.092  -8.896   3.437
 1268    HA   GLN  71           HA       GLN  71   1.846  -6.401   2.513
 1269   1HB   GLN  71           HB2      GLN  71   1.113  -6.754   5.195
 1270   2HB   GLN  71           HB1      GLN  71   0.155  -7.147   3.776
 1271   1HG   GLN  71           HG2      GLN  71   1.355  -9.397   3.757
 1272   2HG   GLN  71           HG1      GLN  71   1.959  -8.978   5.361
 1273   1HE2  GLN  71          HE22      GLN  71  -1.870  -8.623   6.074
 1274   2HE2  GLN  71          HE21      GLN  71  -0.792  -7.402   5.612
 1275    H    GLU  72           HN       GLU  72   4.583  -7.261   4.316
 1276    HA   GLU  72           HA       GLU  72   4.630  -4.890   6.017
 1277   1HB   GLU  72           HB2      GLU  72   6.482  -7.160   5.407
 1278   2HB   GLU  72           HB1      GLU  72   7.179  -5.693   6.089
 1279   1HG   GLU  72           HG2      GLU  72   4.732  -6.440   7.473
 1280   2HG   GLU  72           HG1      GLU  72   5.916  -7.745   7.512
 1281    H    PHE  73           HN       PHE  73   6.344  -5.946   3.074
 1282    HA   PHE  73           HA       PHE  73   7.721  -3.436   2.707
 1283   1HB   PHE  73           HB2      PHE  73   8.792  -5.030   1.445
 1284   2HB   PHE  73           HB1      PHE  73   7.319  -5.957   1.188
 1285    HD1  PHE  73           HD1      PHE  73   8.872  -2.681   0.210
 1286    HD2  PHE  73           HD2      PHE  73   6.335  -5.953  -0.920
 1287    HE1  PHE  73           HE1      PHE  73   8.647  -1.723  -2.065
 1288    HE2  PHE  73           HE2      PHE  73   6.110  -4.998  -3.197
 1289    HZ   PHE  73           HZ       PHE  73   7.265  -2.884  -3.770
 1290    H    MET  74           HN       MET  74   4.569  -4.680   1.803
 1291    HA   MET  74           HA       MET  74   3.973  -2.591  -0.122
 1292   1HB   MET  74           HB2      MET  74   2.641  -4.917   1.019
 1293   2HB   MET  74           HB1      MET  74   1.544  -3.545   0.872
 1294   1HG   MET  74           HG2      MET  74   3.091  -3.607  -1.505
 1295   2HG   MET  74           HG1      MET  74   2.556  -5.260  -1.206
 1296   1HE   MET  74           HE3      MET  74   1.868  -2.235  -2.971
 1297   2HE   MET  74           HE2      MET  74   0.224  -1.699  -2.641
 1298   3HE   MET  74           HE1      MET  74   1.464  -1.518  -1.404
 1299    H    ALA  75           HN       ALA  75   3.124  -3.148   3.293
 1300    HA   ALA  75           HA       ALA  75   1.668  -0.656   3.542
 1301   1HB   ALA  75           HB2      ALA  75   1.684  -2.858   5.050
 1302   2HB   ALA  75           HB1      ALA  75   2.926  -1.960   5.922
 1303   3HB   ALA  75           HB3      ALA  75   1.309  -1.280   5.744
 1304    H    PHE  76           HN       PHE  76   4.988  -1.525   3.545
 1305    HA   PHE  76           HA       PHE  76   5.904   0.762   5.122
 1306   1HB   PHE  76           HB2      PHE  76   7.056  -1.622   3.995
 1307   2HB   PHE  76           HB1      PHE  76   8.005  -0.226   3.490
 1308    HD1  PHE  76           HD1      PHE  76   6.195  -1.356   6.585
 1309    HD2  PHE  76           HD2      PHE  76   9.759   0.349   4.900
 1310    HE1  PHE  76           HE1      PHE  76   7.200  -1.217   8.848
 1311    HE2  PHE  76           HE2      PHE  76  10.762   0.486   7.163
 1312    HZ   PHE  76           HZ       PHE  76   9.483  -0.296   9.136
 1313    H    VAL  77           HN       VAL  77   5.582  -0.051   1.685
 1314    HA   VAL  77           HA       VAL  77   6.890   2.337   0.723
 1315    HB   VAL  77           HB       VAL  77   4.875   0.502  -0.608
 1316   1HG1  VAL  77          HG13      VAL  77   5.728   3.047  -1.411
 1317   2HG1  VAL  77          HG12      VAL  77   6.713   1.925  -2.349
 1318   3HG1  VAL  77          HG11      VAL  77   4.954   1.830  -2.427
 1319   1HG2  VAL  77          HG22      VAL  77   7.648   0.214   0.079
 1320   2HG2  VAL  77          HG21      VAL  77   6.611  -0.923  -0.783
 1321   3HG2  VAL  77          HG23      VAL  77   7.506   0.306  -1.676
 1322    H    SER  78           HN       SER  78   3.648   1.596   1.798
 1323    HA   SER  78           HA       SER  78   2.431   3.952   0.602
 1324   1HB   SER  78           HB2      SER  78   1.554   1.963   2.693
 1325   2HB   SER  78           HB1      SER  78   0.586   3.386   2.320
 1326    HG   SER  78           HG       SER  78   1.499   1.467   0.432
 1327    H    MET  79           HN       MET  79   4.132   3.255   3.568
 1328    HA   MET  79           HA       MET  79   3.190   5.530   5.068
 1329   1HB   MET  79           HB2      MET  79   5.951   4.477   5.512
 1330   2HB   MET  79           HB1      MET  79   4.705   4.886   6.686
 1331   1HG   MET  79           HG2      MET  79   3.416   2.855   5.803
 1332   2HG   MET  79           HG1      MET  79   4.913   2.395   4.993
 1333   1HE   MET  79           HE1      MET  79   3.724   3.945   8.300
 1334   2HE   MET  79           HE3      MET  79   2.888   2.388   8.233
 1335   3HE   MET  79           HE2      MET  79   4.088   2.695   9.485
 1336    H    VAL  80           HN       VAL  80   6.175   4.941   3.194
 1337    HA   VAL  80           HA       VAL  80   7.116   7.646   3.484
 1338    HB   VAL  80           HB       VAL  80   8.647   6.960   1.579
 1339   1HG1  VAL  80          HG12      VAL  80   9.125   6.667   4.038
 1340   2HG1  VAL  80          HG11      VAL  80   8.503   5.023   3.900
 1341   3HG1  VAL  80          HG13      VAL  80   9.944   5.497   3.003
 1342   1HG2  VAL  80          HG21      VAL  80   6.682   4.849   1.423
 1343   2HG2  VAL  80          HG23      VAL  80   8.015   5.198   0.325
 1344   3HG2  VAL  80          HG22      VAL  80   8.275   4.169   1.733
 1345    H    THR  81           HN       THR  81   5.315   5.942   0.924
 1346    HA   THR  81           HA       THR  81   5.295   8.167  -0.902
 1347    HB   THR  81           HB       THR  81   3.207   5.980  -0.690
 1348    HG1  THR  81           HG1      THR  81   5.669   5.528  -0.887
 1349   1HG2  THR  81          HG22      THR  81   3.541   8.194  -2.421
 1350   2HG2  THR  81          HG21      THR  81   3.986   6.762  -3.348
 1351   3HG2  THR  81          HG23      THR  81   2.397   6.863  -2.591
 1352    H    THR  82           HN       THR  82   3.806   7.688   2.088
 1353    HA   THR  82           HA       THR  82   1.688   9.700   1.444
 1354    HB   THR  82           HB       THR  82   0.489   8.806   3.419
 1355    HG1  THR  82           HG1      THR  82   2.240   8.066   4.598
 1356   1HG2  THR  82          HG22      THR  82   1.222   7.148   1.068
 1357   2HG2  THR  82          HG21      THR  82   0.426   6.305   2.396
 1358   3HG2  THR  82          HG23      THR  82  -0.367   7.676   1.622
 1359    H    ALA  83           HN       ALA  83   4.607   9.154   3.090
 1360    HA   ALA  83           HA       ALA  83   4.093  11.119   5.222
 1361   1HB   ALA  83           HB2      ALA  83   6.573   9.579   4.406
 1362   2HB   ALA  83           HB1      ALA  83   6.522  10.708   5.760
 1363   3HB   ALA  83           HB3      ALA  83   5.529   9.252   5.788
 1364    H    CYS  84           HN       CYS  84   3.596  12.447   2.961
 1365    HA   CYS  84           HA       CYS  84   6.076  14.055   2.506
 1366   1HB   CYS  84           HB2      CYS  84   3.835  13.463   0.545
 1367   2HB   CYS  84           HB1      CYS  84   5.200  14.535   0.233
 1368    HG   CYS  84           HG       CYS  84   5.555  11.926  -0.570
 1369    H    HIS  85           HN       HIS  85   5.391  16.337   1.639
 1370    HA   HIS  85           HA       HIS  85   3.301  17.340   3.497
 1371   1HB   HIS  85           HB2      HIS  85   5.718  18.287   3.369
 1372   2HB   HIS  85           HB1      HIS  85   5.178  19.059   1.879
 1373    HD1  HIS  85           HD1      HIS  85   2.741  18.634   4.682
 1374    HD2  HIS  85           HD2      HIS  85   5.199  21.631   3.156
 1375    HE1  HIS  85           HE1      HIS  85   2.006  20.789   5.782
 1376    H    GLU  86           HN       GLU  86   1.593  18.679   2.704
 1377    HA   GLU  86           HA       GLU  86  -0.087  19.201   1.141
 1378   1HB   GLU  86           HB2      GLU  86   2.483  19.789  -0.318
 1379   2HB   GLU  86           HB1      GLU  86   0.925  20.002  -1.120
 1380   1HG   GLU  86           HG2      GLU  86   0.635  21.965  -0.067
 1381   2HG   GLU  86           HG1      GLU  86   0.754  21.155   1.495
 1382    H    PHE  87           HN       PHE  87  -0.355  16.691   1.304
 1383    HA   PHE  87           HA       PHE  87  -0.692  14.625   0.232
 1384   1HB   PHE  87           HB2      PHE  87  -2.103  16.547  -1.063
 1385   2HB   PHE  87           HB1      PHE  87  -1.102  15.950  -2.387
 1386    HD1  PHE  87           HD1      PHE  87  -2.832  14.409   0.566
 1387    HD2  PHE  87           HD2      PHE  87  -2.153  14.321  -3.675
 1388    HE1  PHE  87           HE1      PHE  87  -4.277  12.405   0.375
 1389    HE2  PHE  87           HE2      PHE  87  -3.597  12.314  -3.866
 1390    HZ   PHE  87           HZ       PHE  87  -4.660  11.356  -1.841
 1391    H    PHE  88           HN       PHE  88  -0.230  13.943  -2.505
 1392    HA   PHE  88           HA       PHE  88   2.658  14.438  -2.936
 1393   1HB   PHE  88           HB2      PHE  88   2.380  11.701  -3.424
 1394   2HB   PHE  88           HB1      PHE  88   3.231  12.429  -2.065
 1395    HD1  PHE  88           HD1      PHE  88   2.072  12.746   0.116
 1396    HD2  PHE  88           HD2      PHE  88   0.217  10.678  -3.161
 1397    HE1  PHE  88           HE1      PHE  88   0.382  11.807   1.666
 1398    HE2  PHE  88           HE2      PHE  88  -1.473   9.738  -1.610
 1399    HZ   PHE  88           HZ       PHE  88  -1.388  10.302   0.803
 1400    H    GLU  89           HN       GLU  89   2.391  15.346  -4.961
 1401    HA   GLU  89           HA       GLU  89   1.363  13.558  -7.078
 1402   1HB   GLU  89           HB2      GLU  89  -0.196  15.698  -6.025
 1403   2HB   GLU  89           HB1      GLU  89   0.337  16.169  -7.638
 1404   1HG   GLU  89           HG2      GLU  89  -0.709  13.394  -7.214
 1405   2HG   GLU  89           HG1      GLU  89  -1.854  14.728  -7.346
 1406    H    HIS  90           HN       HIS  90   1.911  17.055  -7.180
 1407    HA   HIS  90           HA       HIS  90   4.541  16.640  -8.470
 1408   1HB   HIS  90           HB2      HIS  90   2.444  16.673 -10.132
 1409   2HB   HIS  90           HB1      HIS  90   2.637  18.414  -9.933
 1410    HD1  HIS  90           HD1      HIS  90   3.986  19.276 -11.836
 1411    HD2  HIS  90           HD2      HIS  90   5.419  15.599 -10.496
 1412    HE1  HIS  90           HE1      HIS  90   6.046  18.766 -13.214
 1413    H    GLU  91           HN       GLU  91   4.560  17.740  -6.116
 1414    HA   GLU  91           HA       GLU  91   5.243  19.676  -4.972
 1415   1HB   GLU  91           HB2      GLU  91   6.230  20.057  -7.437
 1416   2HB   GLU  91           HB1      GLU  91   5.039  21.357  -7.428
 1417   1HG   GLU  91           HG2      GLU  91   6.011  22.360  -5.481
 1418   2HG   GLU  91           HG1      GLU  91   7.027  20.948  -5.183
   
  No H/Q in entry =        1418
  Start of MODEL    7
    1   1H    MET   0           HT3      MET   0   6.231   5.309 -14.084
    2   2H    MET   0           HT2      MET   0   7.300   6.621 -13.923
    3   3H    MET   0           HT1      MET   0   5.949   6.741 -14.944
    4    HA   MET   0           HA       MET   0   6.848   5.359 -16.550
    5   1HB   MET   0           HB2      MET   0   8.467   7.476 -15.457
    6   2HB   MET   0           HB1      MET   0   9.514   6.205 -16.090
    7   1HG   MET   0           HG2      MET   0   7.899   6.258 -18.149
    8   2HG   MET   0           HG1      MET   0   7.457   7.852 -17.538
    9   1HE   MET   0           HE2      MET   0   9.135   9.514 -16.727
   10   2HE   MET   0           HE1      MET   0  10.476   8.540 -16.134
   11   3HE   MET   0           HE3      MET   0  10.751   9.765 -17.379
   12    H    SER   1           HN       SER   1   7.876   4.668 -13.360
   13    HA   SER   1           HA       SER   1   9.596   2.428 -14.311
   14   1HB   SER   1           HB2      SER   1  10.761   2.610 -12.358
   15   2HB   SER   1           HB1      SER   1  10.049   4.220 -12.305
   16    HG   SER   1           HG       SER   1   9.420   1.914 -10.872
   17    H    GLU   2           HN       GLU   2   9.292   0.618 -12.270
   18    HA   GLU   2           HA       GLU   2   6.658  -0.490 -12.878
   19   1HB   GLU   2           HB2      GLU   2   9.124  -1.574 -12.199
   20   2HB   GLU   2           HB1      GLU   2   8.154  -1.828 -10.751
   21   1HG   GLU   2           HG2      GLU   2   7.695  -2.866 -13.536
   22   2HG   GLU   2           HG1      GLU   2   7.677  -3.744 -12.011
   23    H    LEU   3           HN       LEU   3   8.315   0.097  -9.766
   24    HA   LEU   3           HA       LEU   3   5.849   0.014  -8.265
   25   1HB   LEU   3           HB2      LEU   3   8.189  -0.424  -7.376
   26   2HB   LEU   3           HB1      LEU   3   8.445   1.317  -7.422
   27    HG   LEU   3           HG       LEU   3   6.136   1.347  -6.107
   28   1HD1  LEU   3          HD11      LEU   3   7.204  -1.440  -5.815
   29   2HD1  LEU   3          HD13      LEU   3   6.413  -0.680  -4.435
   30   3HD1  LEU   3          HD12      LEU   3   5.533  -0.894  -5.948
   31   1HD2  LEU   3          HD23      LEU   3   8.887   1.517  -5.433
   32   2HD2  LEU   3          HD22      LEU   3   7.522   2.177  -4.534
   33   3HD2  LEU   3          HD21      LEU   3   8.120   0.559  -4.169
   34    H    GLU   4           HN       GLU   4   8.017   2.680  -9.179
   35    HA   GLU   4           HA       GLU   4   6.586   4.800  -8.045
   36   1HB   GLU   4           HB2      GLU   4   8.764   5.113  -9.129
   37   2HB   GLU   4           HB1      GLU   4   8.050   4.768 -10.705
   38   1HG   GLU   4           HG2      GLU   4   6.902   6.960  -8.998
   39   2HG   GLU   4           HG1      GLU   4   8.355   7.263  -9.950
   40    H    LYS   5           HN       LYS   5   5.915   3.117 -11.109
   41    HA   LYS   5           HA       LYS   5   3.759   4.979 -11.770
   42   1HB   LYS   5           HB2      LYS   5   4.854   3.997 -13.643
   43   2HB   LYS   5           HB1      LYS   5   4.721   2.374 -12.968
   44   1HG   LYS   5           HG2      LYS   5   2.130   3.722 -13.257
   45   2HG   LYS   5           HG1      LYS   5   2.967   3.477 -14.790
   46   1HD   LYS   5           HD2      LYS   5   3.402   1.070 -13.614
   47   2HD   LYS   5           HD1      LYS   5   1.833   1.482 -12.921
   48   1HE   LYS   5           HE2      LYS   5   1.148   0.467 -14.890
   49   2HE   LYS   5           HE1      LYS   5   1.276   2.140 -15.432
   50   1HZ   LYS   5           HZ1      LYS   5   3.767   0.740 -15.573
   51   2HZ   LYS   5           HZ3      LYS   5   2.568   0.002 -16.516
   52   3HZ   LYS   5           HZ2      LYS   5   2.959   1.636 -16.768
   53    H    ALA   6           HN       ALA   6   4.035   1.728 -10.387
   54    HA   ALA   6           HA       ALA   6   1.138   1.360 -10.270
   55   1HB   ALA   6           HB2      ALA   6   2.844  -0.514 -10.473
   56   2HB   ALA   6           HB1      ALA   6   3.256  -0.211  -8.786
   57   3HB   ALA   6           HB3      ALA   6   1.628  -0.739  -9.215
   58    H    MET   7           HN       MET   7   3.538   1.308  -7.620
   59    HA   MET   7           HA       MET   7   1.881   1.701  -5.461
   60   1HB   MET   7           HB2      MET   7   4.268   1.452  -5.139
   61   2HB   MET   7           HB1      MET   7   4.588   2.972  -5.983
   62   1HG   MET   7           HG2      MET   7   4.635   3.081  -3.426
   63   2HG   MET   7           HG1      MET   7   3.601   4.262  -4.228
   64   1HE   MET   7           HE1      MET   7   3.870   3.453  -1.508
   65   2HE   MET   7           HE3      MET   7   2.224   3.423  -0.863
   66   3HE   MET   7           HE2      MET   7   3.165   1.936  -0.961
   67    H    VAL   8           HN       VAL   8   3.311   4.312  -7.417
   68    HA   VAL   8           HA       VAL   8   1.862   6.408  -6.086
   69    HB   VAL   8           HB       VAL   8   2.915   6.453  -8.921
   70   1HG1  VAL   8          HG11      VAL   8   1.778   8.407  -7.065
   71   2HG1  VAL   8          HG13      VAL   8   3.363   8.889  -7.669
   72   3HG1  VAL   8          HG12      VAL   8   2.056   8.542  -8.801
   73   1HG2  VAL   8          HG22      VAL   8   4.356   7.022  -6.313
   74   2HG2  VAL   8          HG21      VAL   8   4.651   5.638  -7.365
   75   3HG2  VAL   8          HG23      VAL   8   5.024   7.267  -7.926
   76    H    ALA   9           HN       ALA   9   1.146   4.387  -8.912
   77    HA   ALA   9           HA       ALA   9  -1.096   5.771  -9.926
   78   1HB   ALA   9           HB3      ALA   9  -0.405   2.840  -9.764
   79   2HB   ALA   9           HB2      ALA   9  -1.953   3.355 -10.428
   80   3HB   ALA   9           HB1      ALA   9  -0.450   3.883 -11.182
   81    H    LEU  10           HN       LEU  10  -0.847   3.542  -7.173
   82    HA   LEU  10           HA       LEU  10  -3.601   3.376  -6.521
   83   1HB   LEU  10           HB2      LEU  10  -1.278   2.440  -5.388
   84   2HB   LEU  10           HB1      LEU  10  -1.775   3.663  -4.218
   85    HG   LEU  10           HG       LEU  10  -3.720   1.615  -5.286
   86   1HD1  LEU  10          HD13      LEU  10  -1.748   0.476  -4.241
   87   2HD1  LEU  10          HD12      LEU  10  -2.049   1.393  -2.765
   88   3HD1  LEU  10          HD11      LEU  10  -3.246   0.233  -3.343
   89   1HD2  LEU  10          HD23      LEU  10  -3.764   3.836  -3.405
   90   2HD2  LEU  10          HD22      LEU  10  -5.111   2.900  -4.053
   91   3HD2  LEU  10          HD21      LEU  10  -4.251   2.333  -2.623
   92    H    ILE  11           HN       ILE  11  -1.127   5.757  -5.576
   93    HA   ILE  11           HA       ILE  11  -2.701   7.412  -3.925
   94    HB   ILE  11           HB       ILE  11  -0.289   7.758  -5.633
   95   1HG1  ILE  11          HG12      ILE  11  -0.795   8.895  -2.894
   96   2HG1  ILE  11          HG11      ILE  11  -0.519   7.166  -3.105
   97   1HG2  ILE  11          HG22      ILE  11  -2.190   9.972  -5.130
   98   2HG2  ILE  11          HG21      ILE  11  -0.516  10.310  -4.706
   99   3HG2  ILE  11          HG23      ILE  11  -0.929   9.826  -6.349
  100   1HD1  ILE  11          HD12      ILE  11   1.487   8.272  -4.639
  101   2HD1  ILE  11          HD11      ILE  11   1.382   9.400  -3.288
  102   3HD1  ILE  11          HD13      ILE  11   1.684   7.690  -2.988
  103    H    ASP  12           HN       ASP  12  -2.533   7.173  -7.440
  104    HA   ASP  12           HA       ASP  12  -4.055   9.468  -8.119
  105   1HB   ASP  12           HB2      ASP  12  -2.797   7.832  -9.662
  106   2HB   ASP  12           HB1      ASP  12  -4.249   6.837  -9.593
  107    H    VAL  13           HN       VAL  13  -5.222   6.093  -7.760
  108    HA   VAL  13           HA       VAL  13  -7.950   6.523  -8.082
  109    HB   VAL  13           HB       VAL  13  -6.577   4.724  -6.067
  110   1HG1  VAL  13          HG11      VAL  13  -9.462   5.034  -6.879
  111   2HG1  VAL  13          HG13      VAL  13  -8.847   3.477  -6.326
  112   3HG1  VAL  13          HG12      VAL  13  -8.784   4.881  -5.259
  113   1HG2  VAL  13          HG22      VAL  13  -6.768   4.654  -8.883
  114   2HG2  VAL  13          HG21      VAL  13  -6.210   3.360  -7.825
  115   3HG2  VAL  13          HG23      VAL  13  -7.908   3.447  -8.291
  116    H    PHE  14           HN       PHE  14  -5.957   7.379  -5.306
  117    HA   PHE  14           HA       PHE  14  -8.067   7.936  -3.464
  118   1HB   PHE  14           HB2      PHE  14  -5.565   7.814  -2.975
  119   2HB   PHE  14           HB1      PHE  14  -5.451   9.447  -3.631
  120    HD1  PHE  14           HD2      PHE  14  -6.707  11.322  -2.551
  121    HD2  PHE  14           HD1      PHE  14  -6.513   7.400  -0.813
  122    HE1  PHE  14           HE2      PHE  14  -7.459  12.249  -0.377
  123    HE2  PHE  14           HE1      PHE  14  -7.265   8.328   1.361
  124    HZ   PHE  14           HZ       PHE  14  -7.737  10.752   1.579
  125    H    HIS  15           HN       HIS  15  -6.365  10.077  -5.765
  126    HA   HIS  15           HA       HIS  15  -8.075  12.337  -5.120
  127   1HB   HIS  15           HB2      HIS  15  -6.310  13.375  -6.062
  128   2HB   HIS  15           HB1      HIS  15  -5.683  11.845  -6.661
  129    HD1  HIS  15           HD1      HIS  15  -6.731  11.038  -9.034
  130    HD2  HIS  15           HD2      HIS  15  -7.312  15.045  -8.038
  131    HE1  HIS  15           HE1      HIS  15  -7.369  12.222 -11.178
  132    H    GLN  16           HN       GLN  16  -8.690   9.518  -6.749
  133    HA   GLN  16           HA       GLN  16 -10.478  10.769  -8.763
  134   1HB   GLN  16           HB2      GLN  16  -8.901   8.491  -8.834
  135   2HB   GLN  16           HB1      GLN  16 -10.517   7.844  -8.552
  136   1HG   GLN  16           HG2      GLN  16 -10.988   8.156 -10.726
  137   2HG   GLN  16           HG1      GLN  16 -10.785   9.893 -10.494
  138   1HE2  GLN  16          HE22      GLN  16  -7.209   9.644 -11.435
  139   2HE2  GLN  16          HE21      GLN  16  -8.100  10.248 -10.122
  140    H    TYR  17           HN       TYR  17 -10.526   8.902  -5.789
  141    HA   TYR  17           HA       TYR  17 -13.504   8.857  -5.859
  142   1HB   TYR  17           HB2      TYR  17 -11.415   7.271  -4.397
  143   2HB   TYR  17           HB1      TYR  17 -13.028   7.417  -3.700
  144    HD1  TYR  17           HD1      TYR  17 -12.356   7.452  -7.335
  145    HD2  TYR  17           HD2      TYR  17 -13.677   5.105  -3.992
  146    HE1  TYR  17           HE1      TYR  17 -13.191   5.707  -8.887
  147    HE2  TYR  17           HE2      TYR  17 -14.511   3.362  -5.544
  148    HH   TYR  17           HH       TYR  17 -13.830   3.474  -8.973
  149    H    SER  18           HN       SER  18 -10.877   9.489  -3.494
  150    HA   SER  18           HA       SER  18 -12.295  10.703  -1.458
  151   1HB   SER  18           HB2      SER  18  -9.703  10.438  -1.824
  152   2HB   SER  18           HB1      SER  18  -9.815  12.075  -2.462
  153    HG   SER  18           HG       SER  18 -10.698  12.733  -0.500
  154    H    GLY  19           HN       GLY  19 -11.533  12.052  -4.619
  155   1HA   GLY  19           HA2      GLY  19 -12.488  14.719  -3.991
  156   2HA   GLY  19           HA1      GLY  19 -12.168  14.090  -5.608
  157    H    ARG  20           HN       ARG  20 -13.928  13.748  -6.864
  158    HA   ARG  20           HA       ARG  20 -16.200  13.673  -7.469
  159   1HB   ARG  20           HB2      ARG  20 -16.226  11.861  -5.038
  160   2HB   ARG  20           HB1      ARG  20 -17.505  11.948  -6.248
  161   1HG   ARG  20           HG2      ARG  20 -15.680  11.424  -7.979
  162   2HG   ARG  20           HG1      ARG  20 -14.665  10.984  -6.606
  163   1HD   ARG  20           HD2      ARG  20 -15.673   8.978  -6.474
  164   2HD   ARG  20           HD1      ARG  20 -17.241   9.762  -6.275
  165    HE   ARG  20           HE       ARG  20 -16.471   9.797  -9.044
  166   1HH1  ARG  20          HH21      ARG  20 -18.671   8.561  -6.888
  167   2HH1  ARG  20          HH22      ARG  20 -18.997   7.100  -7.760
  168   1HH2  ARG  20          HH11      ARG  20 -16.413   7.557 -10.024
  169   2HH2  ARG  20          HH12      ARG  20 -17.720   6.533  -9.535
  170    H    GLU  21           HN       GLU  21 -15.276  15.685  -5.349
  171    HA   GLU  21           HA       GLU  21 -17.929  16.705  -4.734
  172   1HB   GLU  21           HB2      GLU  21 -16.561  15.070  -2.815
  173   2HB   GLU  21           HB1      GLU  21 -16.631  16.724  -2.213
  174   1HG   GLU  21           HG2      GLU  21 -19.057  15.391  -3.399
  175   2HG   GLU  21           HG1      GLU  21 -18.639  15.181  -1.699
  176    H    GLY  22           HN       GLY  22 -14.747  17.090  -3.153
  177   1HA   GLY  22           HA2      GLY  22 -13.871  19.363  -4.568
  178   2HA   GLY  22           HA1      GLY  22 -14.867  19.958  -3.243
  179    H    ASP  23           HN       ASP  23 -14.212  18.074  -1.275
  180    HA   ASP  23           HA       ASP  23 -11.927  19.148  -0.089
  181   1HB   ASP  23           HB2      ASP  23 -11.831  16.704   0.999
  182   2HB   ASP  23           HB1      ASP  23 -13.075  17.869   1.438
  183    H    LYS  24           HN       LYS  24 -11.977  15.887  -1.588
  184    HA   LYS  24           HA       LYS  24 -10.268  14.715  -2.688
  185   1HB   LYS  24           HB2      LYS  24  -9.130  17.458  -3.286
  186   2HB   LYS  24           HB1      LYS  24  -8.896  15.974  -4.211
  187   1HG   LYS  24           HG2      LYS  24 -11.291  15.924  -4.767
  188   2HG   LYS  24           HG1      LYS  24 -11.548  17.390  -3.820
  189   1HD   LYS  24           HD2      LYS  24 -11.354  18.060  -6.125
  190   2HD   LYS  24           HD1      LYS  24  -9.861  18.539  -5.316
  191   1HE   LYS  24           HE2      LYS  24  -8.630  16.773  -6.282
  192   2HE   LYS  24           HE1      LYS  24 -10.086  15.868  -6.698
  193   1HZ   LYS  24           HZ1      LYS  24 -10.468  18.164  -8.024
  194   2HZ   LYS  24           HZ3      LYS  24  -8.780  18.019  -8.118
  195   3HZ   LYS  24           HZ2      LYS  24  -9.771  16.771  -8.705
  196    H    HIS  25           HN       HIS  25  -9.938  15.715   0.184
  197    HA   HIS  25           HA       HIS  25  -7.030  15.109   0.333
  198   1HB   HIS  25           HB2      HIS  25  -8.408  17.567   1.378
  199   2HB   HIS  25           HB1      HIS  25  -7.016  16.916   2.243
  200    HD1  HIS  25           HD1      HIS  25  -6.940  19.655   0.688
  201    HD2  HIS  25           HD2      HIS  25  -5.594  16.011  -0.827
  202    HE1  HIS  25           HE1      HIS  25  -5.280  20.209  -1.141
  203    H    LYS  26           HN       LYS  26  -9.976  14.133   1.165
  204    HA   LYS  26           HA       LYS  26  -8.997  12.817   3.622
  205   1HB   LYS  26           HB2      LYS  26 -10.940  13.472   4.949
  206   2HB   LYS  26           HB1      LYS  26 -10.105  14.924   4.395
  207   1HG   LYS  26           HG2      LYS  26 -12.192  15.546   3.712
  208   2HG   LYS  26           HG1      LYS  26 -11.818  14.525   2.324
  209   1HD   LYS  26           HD2      LYS  26 -13.461  13.093   2.876
  210   2HD   LYS  26           HD1      LYS  26 -12.782  12.888   4.491
  211   1HE   LYS  26           HE2      LYS  26 -14.302  15.396   3.873
  212   2HE   LYS  26           HE1      LYS  26 -15.200  13.911   4.189
  213   1HZ   LYS  26           HZ1      LYS  26 -13.317  13.944   6.139
  214   2HZ   LYS  26           HZ3      LYS  26 -13.734  15.582   6.003
  215   3HZ   LYS  26           HZ2      LYS  26 -14.936  14.425   6.323
  216    H    LEU  27           HN       LEU  27  -9.817  10.748   3.751
  217    HA   LEU  27           HA       LEU  27 -11.740   9.966   1.625
  218   1HB   LEU  27           HB2      LEU  27  -9.430   8.735   2.790
  219   2HB   LEU  27           HB1      LEU  27 -10.829   7.708   3.106
  220    HG   LEU  27           HG       LEU  27  -9.641   7.267   0.902
  221   1HD1  LEU  27          HD11      LEU  27 -12.040   6.662   1.412
  222   2HD1  LEU  27          HD13      LEU  27 -12.521   8.176   0.648
  223   3HD1  LEU  27          HD12      LEU  27 -11.711   6.928  -0.300
  224   1HD2  LEU  27          HD21      LEU  27  -9.944  10.079   0.700
  225   2HD2  LEU  27          HD23      LEU  27  -9.272   8.984  -0.509
  226   3HD2  LEU  27          HD22      LEU  27 -10.993   9.373  -0.528
  227    H    LYS  28           HN       LYS  28 -12.865   7.723   2.722
  228    HA   LYS  28           HA       LYS  28 -14.020   8.429   5.340
  229   1HB   LYS  28           HB2      LYS  28 -15.340   9.126   2.930
  230   2HB   LYS  28           HB1      LYS  28 -16.191   7.722   3.577
  231   1HG   LYS  28           HG2      LYS  28 -16.701   8.801   5.597
  232   2HG   LYS  28           HG1      LYS  28 -15.432  10.007   5.381
  233   1HD   LYS  28           HD2      LYS  28 -17.004  11.382   4.538
  234   2HD   LYS  28           HD1      LYS  28 -17.093  10.307   3.143
  235   1HE   LYS  28           HE2      LYS  28 -19.026   9.305   3.864
  236   2HE   LYS  28           HE1      LYS  28 -18.591   9.456   5.566
  237   1HZ   LYS  28           HZ1      LYS  28 -19.057  11.833   5.423
  238   2HZ   LYS  28           HZ3      LYS  28 -19.516  11.657   3.802
  239   3HZ   LYS  28           HZ2      LYS  28 -20.426  10.909   5.025
  240    H    LYS  29           HN       LYS  29 -14.286   6.547   6.467
  241    HA   LYS  29           HA       LYS  29 -13.418   4.058   5.645
  242   1HB   LYS  29           HB2      LYS  29 -15.412   3.238   7.279
  243   2HB   LYS  29           HB1      LYS  29 -13.903   3.928   7.871
  244   1HG   LYS  29           HG2      LYS  29 -14.896   6.098   8.131
  245   2HG   LYS  29           HG1      LYS  29 -16.348   5.605   7.260
  246   1HD   LYS  29           HD2      LYS  29 -17.199   5.191   9.324
  247   2HD   LYS  29           HD1      LYS  29 -16.221   3.724   9.256
  248   1HE   LYS  29           HE2      LYS  29 -14.580   5.964  10.053
  249   2HE   LYS  29           HE1      LYS  29 -15.985   5.838  11.111
  250   1HZ   LYS  29           HZ2      LYS  29 -14.823   3.293  10.515
  251   2HZ   LYS  29           HZ1      LYS  29 -13.721   4.339  11.274
  252   3HZ   LYS  29           HZ3      LYS  29 -15.202   3.985  12.020
  253    H    SER  30           HN       SER  30 -16.421   5.583   4.723
  254    HA   SER  30           HA       SER  30 -17.668   3.112   3.796
  255   1HB   SER  30           HB2      SER  30 -18.305   6.025   3.690
  256   2HB   SER  30           HB1      SER  30 -19.052   4.989   2.478
  257    HG   SER  30           HG       SER  30 -20.326   4.279   3.978
  258    H    GLU  31           HN       GLU  31 -15.982   5.840   2.200
  259    HA   GLU  31           HA       GLU  31 -16.211   4.620  -0.430
  260   1HB   GLU  31           HB2      GLU  31 -15.912   7.100  -0.019
  261   2HB   GLU  31           HB1      GLU  31 -14.255   6.759   0.481
  262   1HG   GLU  31           HG2      GLU  31 -13.663   6.891  -1.688
  263   2HG   GLU  31           HG1      GLU  31 -14.568   5.399  -1.953
  264    H    LEU  32           HN       LEU  32 -14.226   4.127   2.293
  265    HA   LEU  32           HA       LEU  32 -11.929   3.085   0.799
  266   1HB   LEU  32           HB2      LEU  32 -11.421   3.998   2.969
  267   2HB   LEU  32           HB1      LEU  32 -12.701   3.054   3.730
  268    HG   LEU  32           HG       LEU  32 -11.513   0.978   3.236
  269   1HD1  LEU  32          HD13      LEU  32 -10.203   2.621   1.314
  270   2HD1  LEU  32          HD12      LEU  32  -8.969   2.021   2.420
  271   3HD1  LEU  32          HD11      LEU  32 -10.012   0.887   1.563
  272   1HD2  LEU  32          HD23      LEU  32 -10.940   2.357   5.287
  273   2HD2  LEU  32          HD22      LEU  32  -9.667   1.255   4.762
  274   3HD2  LEU  32          HD21      LEU  32  -9.550   2.976   4.396
  275    H    LYS  33           HN       LYS  33 -14.587   1.826   2.779
  276    HA   LYS  33           HA       LYS  33 -14.134  -0.932   2.564
  277   1HB   LYS  33           HB2      LYS  33 -16.021   0.424   3.762
  278   2HB   LYS  33           HB1      LYS  33 -16.897   0.231   2.249
  279   1HG   LYS  33           HG2      LYS  33 -16.202  -2.301   2.513
  280   2HG   LYS  33           HG1      LYS  33 -16.032  -1.866   4.213
  281   1HD   LYS  33           HD2      LYS  33 -18.519  -1.352   2.557
  282   2HD   LYS  33           HD1      LYS  33 -18.317  -2.716   3.655
  283   1HE   LYS  33           HE2      LYS  33 -17.706  -0.846   5.405
  284   2HE   LYS  33           HE1      LYS  33 -18.587   0.205   4.297
  285   1HZ   LYS  33           HZ3      LYS  33 -19.875  -2.314   4.925
  286   2HZ   LYS  33           HZ2      LYS  33 -19.747  -1.222   6.221
  287   3HZ   LYS  33           HZ1      LYS  33 -20.538  -0.759   4.791
  288    H    GLU  34           HN       GLU  34 -15.731   1.268   0.291
  289    HA   GLU  34           HA       GLU  34 -16.298  -0.825  -1.644
  290   1HB   GLU  34           HB2      GLU  34 -17.271   0.881  -2.925
  291   2HB   GLU  34           HB1      GLU  34 -17.417   1.541  -1.297
  292   1HG   GLU  34           HG2      GLU  34 -15.506   2.950  -1.597
  293   2HG   GLU  34           HG1      GLU  34 -15.089   2.168  -3.118
  294    H    LEU  35           HN       LEU  35 -13.876   1.714  -1.286
  295    HA   LEU  35           HA       LEU  35 -12.400   1.516  -3.617
  296   1HB   LEU  35           HB2      LEU  35 -11.991   2.659  -1.150
  297   2HB   LEU  35           HB1      LEU  35 -10.730   1.422  -1.185
  298    HG   LEU  35           HG       LEU  35  -9.973   3.605  -2.141
  299   1HD1  LEU  35          HD11      LEU  35  -9.679   0.997  -3.204
  300   2HD1  LEU  35          HD13      LEU  35  -9.860   2.077  -4.585
  301   3HD1  LEU  35          HD12      LEU  35  -8.584   2.364  -3.404
  302   1HD2  LEU  35          HD21      LEU  35 -12.447   3.765  -3.221
  303   2HD2  LEU  35          HD23      LEU  35 -11.063   4.642  -3.869
  304   3HD2  LEU  35          HD22      LEU  35 -11.563   3.119  -4.602
  305    H    ILE  36           HN       ILE  36 -12.322  -0.710  -0.847
  306    HA   ILE  36           HA       ILE  36 -10.324  -2.424  -2.119
  307    HB   ILE  36           HB       ILE  36 -12.023  -3.432   0.116
  308   1HG1  ILE  36          HG12      ILE  36 -10.177  -1.044   0.267
  309   2HG1  ILE  36          HG11      ILE  36 -11.798  -1.222   0.933
  310   1HG2  ILE  36          HG22      ILE  36  -9.828  -4.387  -1.076
  311   2HG2  ILE  36          HG21      ILE  36  -9.041  -3.344   0.108
  312   3HG2  ILE  36          HG23      ILE  36 -10.124  -4.626   0.645
  313   1HD1  ILE  36          HD11      ILE  36 -10.509  -3.262   2.200
  314   2HD1  ILE  36          HD13      ILE  36  -9.201  -2.088   2.049
  315   3HD1  ILE  36          HD12      ILE  36 -10.693  -1.644   2.879
  316    H    ASN  37           HN       ASN  37 -13.683  -3.102  -1.051
  317    HA   ASN  37           HA       ASN  37 -13.891  -5.441  -2.688
  318   1HB   ASN  37           HB2      ASN  37 -15.328  -4.995  -0.703
  319   2HB   ASN  37           HB1      ASN  37 -16.135  -3.714  -1.607
  320   1HD2  ASN  37          HD22      ASN  37 -17.742  -7.236  -1.978
  321   2HD2  ASN  37          HD21      ASN  37 -17.005  -6.562  -0.607
  322    H    ASN  38           HN       ASN  38 -15.585  -2.311  -3.095
  323    HA   ASN  38           HA       ASN  38 -16.702  -2.690  -5.587
  324   1HB   ASN  38           HB2      ASN  38 -16.840  -0.587  -4.208
  325   2HB   ASN  38           HB1      ASN  38 -15.238  -0.155  -4.806
  326   1HD2  ASN  38          HD22      ASN  38 -16.393   0.842  -7.991
  327   2HD2  ASN  38          HD21      ASN  38 -15.045   0.567  -6.999
  328    H    GLU  39           HN       GLU  39 -13.308  -1.737  -4.981
  329    HA   GLU  39           HA       GLU  39 -12.759  -1.940  -7.877
  330   1HB   GLU  39           HB2      GLU  39 -11.673  -0.434  -5.748
  331   2HB   GLU  39           HB1      GLU  39 -10.396  -1.527  -6.285
  332   1HG   GLU  39           HG2      GLU  39 -10.281   0.513  -7.604
  333   2HG   GLU  39           HG1      GLU  39 -10.833  -0.805  -8.639
  334    H    LEU  40           HN       LEU  40 -10.759  -3.091  -5.150
  335    HA   LEU  40           HA       LEU  40  -9.572  -5.191  -6.599
  336   1HB   LEU  40           HB2      LEU  40 -10.076  -4.963  -3.620
  337   2HB   LEU  40           HB1      LEU  40  -8.964  -6.101  -4.371
  338    HG   LEU  40           HG       LEU  40  -8.808  -3.080  -4.480
  339   1HD1  LEU  40          HD11      LEU  40  -7.668  -5.115  -2.761
  340   2HD1  LEU  40          HD13      LEU  40  -6.397  -4.240  -3.613
  341   3HD1  LEU  40          HD12      LEU  40  -7.562  -3.360  -2.624
  342   1HD2  LEU  40          HD22      LEU  40  -7.552  -5.235  -6.110
  343   2HD2  LEU  40          HD21      LEU  40  -7.936  -3.571  -6.550
  344   3HD2  LEU  40          HD23      LEU  40  -6.498  -3.919  -5.591
  345    H    SER  41           HN       SER  41 -11.317  -6.325  -3.800
  346    HA   SER  41           HA       SER  41 -12.657  -8.266  -3.627
  347   1HB   SER  41           HB2      SER  41 -14.344  -6.555  -4.072
  348   2HB   SER  41           HB1      SER  41 -14.069  -6.698  -5.804
  349    HG   SER  41           HG       SER  41 -15.395  -8.316  -5.787
  350    H    HIS  42           HN       HIS  42 -10.802  -9.543  -4.635
  351    HA   HIS  42           HA       HIS  42 -11.841 -10.951  -7.020
  352   1HB   HIS  42           HB2      HIS  42  -9.857  -8.993  -7.287
  353   2HB   HIS  42           HB1      HIS  42  -8.981 -10.523  -7.310
  354    HD1  HIS  42           HD1      HIS  42  -9.340  -8.784  -9.889
  355    HD2  HIS  42           HD2      HIS  42 -11.792 -11.986  -8.835
  356    HE1  HIS  42           HE1      HIS  42 -10.421  -9.596 -12.030
  357    H    PHE  43           HN       PHE  43  -9.168 -10.745  -4.656
  358    HA   PHE  43           HA       PHE  43  -8.925 -13.707  -4.778
  359   1HB   PHE  43           HB2      PHE  43  -7.110 -12.521  -2.885
  360   2HB   PHE  43           HB1      PHE  43  -6.734 -13.362  -4.386
  361    HD1  PHE  43           HD2      PHE  43  -7.399 -10.071  -2.843
  362    HD2  PHE  43           HD1      PHE  43  -6.294 -12.145  -6.439
  363    HE1  PHE  43           HE2      PHE  43  -6.723  -7.921  -3.875
  364    HE2  PHE  43           HE1      PHE  43  -5.619  -9.995  -7.470
  365    HZ   PHE  43           HZ       PHE  43  -5.833  -7.882  -6.188
  366    H    LEU  44           HN       LEU  44 -10.806 -14.291  -3.610
  367    HA   LEU  44           HA       LEU  44 -10.566 -13.865  -0.682
  368   1HB   LEU  44           HB2      LEU  44 -12.841 -13.005  -2.424
  369   2HB   LEU  44           HB1      LEU  44 -13.213 -13.643  -0.823
  370    HG   LEU  44           HG       LEU  44 -10.991 -11.812  -0.651
  371   1HD1  LEU  44          HD13      LEU  44 -13.008 -11.095  -2.579
  372   2HD1  LEU  44          HD12      LEU  44 -13.091  -9.996  -1.202
  373   3HD1  LEU  44          HD11      LEU  44 -11.579 -10.186  -2.089
  374   1HD2  LEU  44          HD23      LEU  44 -13.778 -12.062   0.464
  375   2HD2  LEU  44          HD22      LEU  44 -12.234 -12.212   1.302
  376   3HD2  LEU  44          HD21      LEU  44 -12.814 -10.624   0.802
  377    H    GLU  45           HN       GLU  45  -9.800 -16.182  -1.244
  378    HA   GLU  45           HA       GLU  45 -12.181 -17.981  -1.131
  379   1HB   GLU  45           HB2      GLU  45  -9.579 -18.691  -2.501
  380   2HB   GLU  45           HB1      GLU  45 -11.100 -19.583  -2.550
  381   1HG   GLU  45           HG2      GLU  45 -11.568 -16.876  -3.400
  382   2HG   GLU  45           HG1      GLU  45 -10.233 -17.555  -4.331
  383    H    GLU  46           HN       GLU  46  -8.664 -17.833  -0.559
  384    HA   GLU  46           HA       GLU  46  -9.123 -19.512   1.873
  385   1HB   GLU  46           HB2      GLU  46  -6.687 -19.372   0.070
  386   2HB   GLU  46           HB1      GLU  46  -6.770 -20.288   1.573
  387   1HG   GLU  46           HG2      GLU  46  -7.395 -21.964   0.130
  388   2HG   GLU  46           HG1      GLU  46  -8.984 -21.245   0.395
  389    H    ILE  47           HN       ILE  47  -9.547 -17.168   2.688
  390    HA   ILE  47           HA       ILE  47  -7.365 -15.332   2.957
  391    HB   ILE  47           HB       ILE  47  -9.817 -15.712   4.699
  392   1HG1  ILE  47          HG12      ILE  47  -9.756 -13.371   2.994
  393   2HG1  ILE  47          HG11      ILE  47  -9.549 -14.837   2.035
  394   1HG2  ILE  47          HG23      ILE  47  -7.956 -14.452   5.795
  395   2HG2  ILE  47          HG22      ILE  47  -7.967 -13.324   4.440
  396   3HG2  ILE  47          HG21      ILE  47  -9.375 -13.450   5.493
  397   1HD1  ILE  47          HD13      ILE  47 -11.739 -14.458   4.093
  398   2HD1  ILE  47          HD12      ILE  47 -11.952 -14.187   2.365
  399   3HD1  ILE  47          HD11      ILE  47 -11.569 -15.802   2.962
  400    H    LYS  48           HN       LYS  48  -5.611 -15.432   4.274
  401    HA   LYS  48           HA       LYS  48  -5.534 -17.590   6.316
  402   1HB   LYS  48           HB2      LYS  48  -3.608 -16.433   4.505
  403   2HB   LYS  48           HB1      LYS  48  -3.030 -16.282   6.164
  404   1HG   LYS  48           HG2      LYS  48  -3.261 -18.647   6.542
  405   2HG   LYS  48           HG1      LYS  48  -4.110 -18.867   5.012
  406   1HD   LYS  48           HD2      LYS  48  -2.143 -18.390   3.742
  407   2HD   LYS  48           HD1      LYS  48  -1.288 -17.790   5.164
  408   1HE   LYS  48           HE2      LYS  48  -1.637 -20.158   6.134
  409   2HE   LYS  48           HE1      LYS  48  -2.021 -20.636   4.482
  410   1HZ   LYS  48           HZ2      LYS  48   0.145 -19.526   3.862
  411   2HZ   LYS  48           HZ1      LYS  48   0.509 -19.513   5.521
  412   3HZ   LYS  48           HZ3      LYS  48   0.266 -20.987   4.719
  413    H    GLU  49           HN       GLU  49  -5.152 -14.082   5.946
  414    HA   GLU  49           HA       GLU  49  -4.790 -13.798   8.876
  415   1HB   GLU  49           HB2      GLU  49  -4.393 -12.037   6.499
  416   2HB   GLU  49           HB1      GLU  49  -4.825 -11.261   8.020
  417   1HG   GLU  49           HG2      GLU  49  -2.565 -13.253   7.761
  418   2HG   GLU  49           HG1      GLU  49  -2.339 -11.507   7.647
  419    H    GLN  50           HN       GLN  50  -7.180 -14.789   8.748
  420    HA   GLN  50           HA       GLN  50  -9.388 -13.227   7.963
  421   1HB   GLN  50           HB2      GLN  50  -9.296 -15.621   8.990
  422   2HB   GLN  50           HB1      GLN  50  -9.413 -14.787  10.540
  423   1HG   GLN  50           HG2      GLN  50 -11.563 -14.049  10.140
  424   2HG   GLN  50           HG1      GLN  50 -11.333 -14.000   8.393
  425   1HE2  GLN  50          HE22      GLN  50 -13.465 -16.930   8.781
  426   2HE2  GLN  50          HE21      GLN  50 -13.580 -15.238   8.720
  427    H    GLU  51           HN       GLU  51  -7.206 -12.809  10.654
  428    HA   GLU  51           HA       GLU  51  -8.933 -11.015  12.151
  429   1HB   GLU  51           HB2      GLU  51  -6.971 -12.333  13.095
  430   2HB   GLU  51           HB1      GLU  51  -5.915 -11.167  12.297
  431   1HG   GLU  51           HG2      GLU  51  -6.185  -9.759  14.029
  432   2HG   GLU  51           HG1      GLU  51  -7.911  -9.683  13.678
  433    H    VAL  52           HN       VAL  52  -6.413 -10.618   9.697
  434    HA   VAL  52           HA       VAL  52  -6.179  -7.768   9.928
  435    HB   VAL  52           HB       VAL  52  -5.669  -9.668   7.625
  436   1HG1  VAL  52          HG11      VAL  52  -5.450  -6.685   7.822
  437   2HG1  VAL  52          HG13      VAL  52  -4.258  -7.574   6.873
  438   3HG1  VAL  52          HG12      VAL  52  -5.970  -7.681   6.462
  439   1HG2  VAL  52          HG23      VAL  52  -4.280  -9.156   9.991
  440   2HG2  VAL  52          HG22      VAL  52  -3.623  -9.929   8.548
  441   3HG2  VAL  52          HG21      VAL  52  -3.436  -8.191   8.782
  442    H    VAL  53           HN       VAL  53  -7.978  -9.724   7.522
  443    HA   VAL  53           HA       VAL  53  -9.357  -7.450   6.428
  444    HB   VAL  53           HB       VAL  53 -10.108 -10.392   6.377
  445   1HG1  VAL  53          HG13      VAL  53 -11.413  -7.988   5.377
  446   2HG1  VAL  53          HG12      VAL  53 -11.011  -9.097   4.065
  447   3HG1  VAL  53          HG11      VAL  53 -12.008  -9.648   5.411
  448   1HG2  VAL  53          HG21      VAL  53  -8.180  -8.705   4.870
  449   2HG2  VAL  53          HG23      VAL  53  -8.145 -10.438   5.195
  450   3HG2  VAL  53          HG22      VAL  53  -9.163  -9.805   3.904
  451    H    ASP  54           HN       ASP  54  -9.985  -9.560   9.148
  452    HA   ASP  54           HA       ASP  54 -12.765  -8.744   9.447
  453   1HB   ASP  54           HB2      ASP  54 -10.803 -10.225  11.197
  454   2HB   ASP  54           HB1      ASP  54 -12.394  -9.756  11.795
  455    H    LYS  55           HN       LYS  55  -9.663  -7.507  10.428
  456    HA   LYS  55           HA       LYS  55 -10.747  -5.809  12.534
  457   1HB   LYS  55           HB2      LYS  55  -8.266  -6.762  12.075
  458   2HB   LYS  55           HB1      LYS  55  -8.112  -5.186  11.302
  459   1HG   LYS  55           HG2      LYS  55  -8.799  -5.798  14.175
  460   2HG   LYS  55           HG1      LYS  55  -7.491  -4.792  13.555
  461   1HD   LYS  55           HD2      LYS  55  -9.208  -3.217  12.641
  462   2HD   LYS  55           HD1      LYS  55 -10.455  -4.184  13.428
  463   1HE   LYS  55           HE2      LYS  55  -9.307  -3.802  15.616
  464   2HE   LYS  55           HE1      LYS  55  -8.171  -2.732  14.798
  465   1HZ   LYS  55           HZ3      LYS  55 -10.034  -1.351  14.109
  466   2HZ   LYS  55           HZ2      LYS  55 -11.117  -2.376  14.920
  467   3HZ   LYS  55           HZ1      LYS  55  -9.970  -1.483  15.797
  468    H    VAL  56           HN       VAL  56  -9.482  -5.266   9.225
  469    HA   VAL  56           HA       VAL  56 -10.156  -2.456   9.269
  470    HB   VAL  56           HB       VAL  56  -9.796  -2.632   6.792
  471   1HG1  VAL  56          HG13      VAL  56  -7.929  -2.296   8.451
  472   2HG1  VAL  56          HG12      VAL  56  -7.652  -4.037   8.398
  473   3HG1  VAL  56          HG11      VAL  56  -7.424  -3.064   6.946
  474   1HG2  VAL  56          HG22      VAL  56  -9.967  -5.502   7.484
  475   2HG2  VAL  56          HG21      VAL  56 -10.339  -4.688   5.968
  476   3HG2  VAL  56          HG23      VAL  56  -8.668  -5.073   6.375
  477    H    MET  57           HN       MET  57 -11.734  -5.362   8.015
  478    HA   MET  57           HA       MET  57 -13.973  -3.972   6.841
  479   1HB   MET  57           HB2      MET  57 -13.264  -6.340   6.312
  480   2HB   MET  57           HB1      MET  57 -13.888  -6.814   7.893
  481   1HG   MET  57           HG2      MET  57 -15.599  -7.220   6.207
  482   2HG   MET  57           HG1      MET  57 -16.114  -5.892   7.248
  483   1HE   MET  57           HE3      MET  57 -14.571  -7.110   4.122
  484   2HE   MET  57           HE2      MET  57 -14.626  -5.803   2.943
  485   3HE   MET  57           HE1      MET  57 -13.392  -5.793   4.199
  486    H    GLU  58           HN       GLU  58 -13.153  -4.974  10.075
  487    HA   GLU  58           HA       GLU  58 -15.884  -4.831  11.090
  488   1HB   GLU  58           HB2      GLU  58 -13.165  -5.190  12.275
  489   2HB   GLU  58           HB1      GLU  58 -14.452  -4.613  13.333
  490   1HG   GLU  58           HG2      GLU  58 -15.843  -6.533  12.755
  491   2HG   GLU  58           HG1      GLU  58 -14.636  -7.093  11.597
  492    H    THR  59           HN       THR  59 -12.998  -2.707  11.477
  493    HA   THR  59           HA       THR  59 -14.453  -0.613  12.797
  494    HB   THR  59           HB       THR  59 -11.932  -0.506  11.110
  495    HG1  THR  59           HG1      THR  59 -11.891  -1.741  13.067
  496   1HG2  THR  59          HG23      THR  59 -13.541   1.586  12.420
  497   2HG2  THR  59          HG22      THR  59 -11.829   1.614  12.845
  498   3HG2  THR  59          HG21      THR  59 -12.319   1.729  11.156
  499    H    LEU  60           HN       LEU  60 -13.948  -1.495   9.468
  500    HA   LEU  60           HA       LEU  60 -14.874   0.896   8.212
  501   1HB   LEU  60           HB2      LEU  60 -14.451  -1.948   7.450
  502   2HB   LEU  60           HB1      LEU  60 -15.554  -1.029   6.431
  503    HG   LEU  60           HG       LEU  60 -12.735  -0.186   7.163
  504   1HD1  LEU  60          HD13      LEU  60 -12.954  -2.147   5.576
  505   2HD1  LEU  60          HD12      LEU  60 -13.825  -1.078   4.480
  506   3HD1  LEU  60          HD11      LEU  60 -12.145  -0.738   4.892
  507   1HD2  LEU  60          HD22      LEU  60 -15.037   1.182   5.963
  508   2HD2  LEU  60          HD21      LEU  60 -13.549   1.859   6.622
  509   3HD2  LEU  60          HD23      LEU  60 -13.587   1.263   4.963
  510    H    ASP  61           HN       ASP  61 -16.585  -2.168   8.903
  511    HA   ASP  61           HA       ASP  61 -19.174  -0.963   8.278
  512   1HB   ASP  61           HB2      ASP  61 -18.220  -3.542   8.292
  513   2HB   ASP  61           HB1      ASP  61 -19.159  -3.494   9.784
  514    H    GLU  62           HN       GLU  62 -17.147  -0.730  10.902
  515    HA   GLU  62           HA       GLU  62 -19.052  -1.000  13.062
  516   1HB   GLU  62           HB2      GLU  62 -16.309  -0.707  12.896
  517   2HB   GLU  62           HB1      GLU  62 -16.829   0.851  13.537
  518   1HG   GLU  62           HG2      GLU  62 -17.736  -0.087  15.462
  519   2HG   GLU  62           HG1      GLU  62 -17.989  -1.658  14.699
  520    H    ASP  63           HN       ASP  63 -17.751   1.787  11.274
  521    HA   ASP  63           HA       ASP  63 -19.959   3.418  12.456
  522   1HB   ASP  63           HB2      ASP  63 -17.607   4.164  12.959
  523   2HB   ASP  63           HB1      ASP  63 -17.381   4.429  11.231
  524    H    GLY  64           HN       GLY  64 -17.992   3.210   9.486
  525   1HA   GLY  64           HA2      GLY  64 -18.791   3.113   7.246
  526   2HA   GLY  64           HA1      GLY  64 -20.434   3.315   7.855
  527    H    ASP  65           HN       ASP  65 -20.166   5.653   9.348
  528    HA   ASP  65           HA       ASP  65 -19.564   7.627   7.192
  529   1HB   ASP  65           HB2      ASP  65 -21.932   7.386   8.252
  530   2HB   ASP  65           HB1      ASP  65 -21.221   8.212   9.640
  531    H    GLY  66           HN       GLY  66 -17.253   7.339   7.999
  532   1HA   GLY  66           HA2      GLY  66 -16.778   9.263  10.217
  533   2HA   GLY  66           HA1      GLY  66 -15.894   7.737  10.169
  534    H    GLU  67           HN       GLU  67 -14.544  10.207  10.093
  535    HA   GLU  67           HA       GLU  67 -13.832  10.637   7.251
  536   1HB   GLU  67           HB2      GLU  67 -12.472  12.512   8.110
  537   2HB   GLU  67           HB1      GLU  67 -14.134  12.619   8.688
  538   1HG   GLU  67           HG2      GLU  67 -13.057  11.142  10.681
  539   2HG   GLU  67           HG1      GLU  67 -11.639  12.072  10.199
  540    H    CYS  68           HN       CYS  68 -11.981   9.849   6.357
  541    HA   CYS  68           HA       CYS  68 -10.025   8.516   8.184
  542   1HB   CYS  68           HB2      CYS  68 -10.842   7.744   5.365
  543   2HB   CYS  68           HB1      CYS  68  -9.570   6.959   6.291
  544    HG   CYS  68           HG       CYS  68 -11.984   6.850   7.994
  545    H    ASP  69           HN       ASP  69  -7.769   8.511   7.304
  546    HA   ASP  69           HA       ASP  69  -7.262  11.067   5.871
  547   1HB   ASP  69           HB2      ASP  69  -5.666   9.329   7.719
  548   2HB   ASP  69           HB1      ASP  69  -4.807  10.354   6.571
  549    H    PHE  70           HN       PHE  70  -5.006  10.745   4.569
  550    HA   PHE  70           HA       PHE  70  -5.700   8.829   2.449
  551   1HB   PHE  70           HB2      PHE  70  -3.392   9.822   1.547
  552   2HB   PHE  70           HB1      PHE  70  -4.893  10.733   1.422
  553    HD1  PHE  70           HD2      PHE  70  -1.888  10.231   3.586
  554    HD2  PHE  70           HD1      PHE  70  -5.141  12.818   2.502
  555    HE1  PHE  70           HE2      PHE  70  -0.910  12.044   4.968
  556    HE2  PHE  70           HE1      PHE  70  -4.163  14.631   3.882
  557    HZ   PHE  70           HZ       PHE  70  -2.048  14.243   5.114
  558    H    GLN  71           HN       GLN  71  -3.386   9.119   5.056
  559    HA   GLN  71           HA       GLN  71  -1.719   6.929   4.059
  560   1HB   GLN  71           HB2      GLN  71  -0.357   7.309   5.945
  561   2HB   GLN  71           HB1      GLN  71  -0.980   8.910   5.555
  562   1HG   GLN  71           HG2      GLN  71  -1.697   9.023   7.690
  563   2HG   GLN  71           HG1      GLN  71  -2.914   7.828   7.250
  564   1HE2  GLN  71          HE22      GLN  71  -0.313   5.228   8.309
  565   2HE2  GLN  71          HE21      GLN  71  -0.835   5.704   6.768
  566    H    GLU  72           HN       GLU  72  -4.490   7.258   6.205
  567    HA   GLU  72           HA       GLU  72  -4.137   4.660   7.430
  568   1HB   GLU  72           HB2      GLU  72  -6.058   5.159   8.622
  569   2HB   GLU  72           HB1      GLU  72  -5.551   6.780   8.180
  570   1HG   GLU  72           HG2      GLU  72  -7.167   6.943   6.460
  571   2HG   GLU  72           HG1      GLU  72  -7.464   5.209   6.463
  572    H    PHE  73           HN       PHE  73  -6.190   5.925   4.802
  573    HA   PHE  73           HA       PHE  73  -7.349   3.370   4.155
  574   1HB   PHE  73           HB2      PHE  73  -8.598   4.785   2.902
  575   2HB   PHE  73           HB1      PHE  73  -7.428   6.078   3.129
  576    HD1  PHE  73           HD2      PHE  73  -5.277   5.974   1.651
  577    HD2  PHE  73           HD1      PHE  73  -8.897   3.839   0.774
  578    HE1  PHE  73           HE2      PHE  73  -4.569   5.746  -0.714
  579    HE2  PHE  73           HE1      PHE  73  -8.188   3.608  -1.591
  580    HZ   PHE  73           HZ       PHE  73  -6.024   4.563  -2.335
  581    H    MET  74           HN       MET  74  -4.329   4.931   3.443
  582    HA   MET  74           HA       MET  74  -3.536   3.332   1.194
  583   1HB   MET  74           HB2      MET  74  -2.306   5.263   3.040
  584   2HB   MET  74           HB1      MET  74  -1.186   4.022   2.485
  585   1HG   MET  74           HG2      MET  74  -2.964   5.290   0.451
  586   2HG   MET  74           HG1      MET  74  -1.615   6.243   1.070
  587   1HE   MET  74           HE1      MET  74  -2.772   4.385  -1.580
  588   2HE   MET  74           HE3      MET  74  -1.622   3.137  -2.080
  589   3HE   MET  74           HE2      MET  74  -2.675   2.866  -0.694
  590    H    ALA  75           HN       ALA  75  -2.693   3.065   4.664
  591    HA   ALA  75           HA       ALA  75  -1.352   0.531   4.297
  592   1HB   ALA  75           HB2      ALA  75  -0.948   2.117   6.217
  593   2HB   ALA  75           HB1      ALA  75  -2.528   1.662   6.854
  594   3HB   ALA  75           HB3      ALA  75  -1.252   0.453   6.718
  595    H    PHE  76           HN       PHE  76  -4.651   1.491   4.657
  596    HA   PHE  76           HA       PHE  76  -5.610  -1.069   5.662
  597   1HB   PHE  76           HB2      PHE  76  -6.775   1.512   4.851
  598   2HB   PHE  76           HB1      PHE  76  -7.786   0.119   4.470
  599    HD1  PHE  76           HD2      PHE  76  -5.423   0.808   7.303
  600    HD2  PHE  76           HD1      PHE  76  -9.452  -0.065   6.097
  601    HE1  PHE  76           HE2      PHE  76  -6.102   0.647   9.683
  602    HE2  PHE  76           HE1      PHE  76 -10.129  -0.225   8.477
  603    HZ   PHE  76           HZ       PHE  76  -8.455   0.130  10.269
  604    H    VAL  77           HN       VAL  77  -5.053   0.385   2.504
  605    HA   VAL  77           HA       VAL  77  -6.521  -1.654   1.031
  606    HB   VAL  77           HB       VAL  77  -4.376   0.297   0.141
  607   1HG1  VAL  77          HG12      VAL  77  -5.224  -1.957  -1.197
  608   2HG1  VAL  77          HG11      VAL  77  -6.331  -0.729  -1.809
  609   3HG1  VAL  77          HG13      VAL  77  -4.590  -0.507  -1.975
  610   1HG2  VAL  77          HG22      VAL  77  -7.069   0.685   0.932
  611   2HG2  VAL  77          HG21      VAL  77  -6.013   1.849   0.135
  612   3HG2  VAL  77          HG23      VAL  77  -7.049   0.795  -0.827
  613    H    SER  78           HN       SER  78  -3.279  -1.336   2.300
  614    HA   SER  78           HA       SER  78  -2.188  -3.506   0.667
  615   1HB   SER  78           HB2      SER  78  -0.449  -3.253   2.757
  616   2HB   SER  78           HB1      SER  78  -0.391  -2.266   1.301
  617    HG   SER  78           HG       SER  78  -1.096  -0.613   2.408
  618    H    MET  79           HN       MET  79  -3.105  -3.158   4.109
  619    HA   MET  79           HA       MET  79  -2.501  -5.751   4.972
  620   1HB   MET  79           HB2      MET  79  -4.950  -4.175   5.799
  621   2HB   MET  79           HB1      MET  79  -4.078  -5.373   6.750
  622   1HG   MET  79           HG2      MET  79  -2.212  -3.391   5.865
  623   2HG   MET  79           HG1      MET  79  -3.588  -2.574   6.607
  624   1HE   MET  79           HE2      MET  79  -4.635  -3.312   8.876
  625   2HE   MET  79           HE1      MET  79  -3.476  -3.204  10.197
  626   3HE   MET  79           HE3      MET  79  -3.504  -1.964   8.937
  627    H    VAL  80           HN       VAL  80  -5.533  -4.608   3.464
  628    HA   VAL  80           HA       VAL  80  -6.788  -7.199   3.563
  629    HB   VAL  80           HB       VAL  80  -8.340  -6.132   1.849
  630   1HG1  VAL  80          HG13      VAL  80  -7.747  -5.155   4.606
  631   2HG1  VAL  80          HG12      VAL  80  -8.921  -4.249   3.653
  632   3HG1  VAL  80          HG11      VAL  80  -9.190  -5.959   3.988
  633   1HG2  VAL  80          HG21      VAL  80  -6.146  -4.266   1.780
  634   2HG2  VAL  80          HG23      VAL  80  -7.598  -4.294   0.785
  635   3HG2  VAL  80          HG22      VAL  80  -7.603  -3.438   2.325
  636    H    THR  81           HN       THR  81  -4.972  -5.477   1.021
  637    HA   THR  81           HA       THR  81  -5.411  -7.574  -0.943
  638    HB   THR  81           HB       THR  81  -3.133  -5.595  -1.007
  639    HG1  THR  81           HG1      THR  81  -5.767  -5.096  -1.895
  640   1HG2  THR  81          HG22      THR  81  -3.605  -7.502  -2.747
  641   2HG2  THR  81          HG21      THR  81  -4.897  -6.433  -3.292
  642   3HG2  THR  81          HG23      THR  81  -3.223  -5.881  -3.326
  643    H    THR  82           HN       THR  82  -3.647  -7.556   1.861
  644    HA   THR  82           HA       THR  82  -1.737  -9.573   0.754
  645    HB   THR  82           HB       THR  82  -0.130  -8.872   2.494
  646    HG1  THR  82           HG1      THR  82  -1.885  -8.051   3.872
  647   1HG2  THR  82          HG21      THR  82  -1.199  -6.905   0.504
  648   2HG2  THR  82          HG23      THR  82   0.079  -6.396   1.605
  649   3HG2  THR  82          HG22      THR  82   0.345  -7.757   0.515
  650    H    ALA  83           HN       ALA  83  -4.322  -8.986   2.843
  651    HA   ALA  83           HA       ALA  83  -3.578 -10.968   4.869
  652   1HB   ALA  83           HB3      ALA  83  -6.231  -9.607   4.309
  653   2HB   ALA  83           HB2      ALA  83  -5.863 -10.584   5.729
  654   3HB   ALA  83           HB1      ALA  83  -5.019  -9.059   5.466
  655    H    CYS  84           HN       CYS  84  -5.313 -10.894   1.840
  656    HA   CYS  84           HA       CYS  84  -6.897 -13.222   2.083
  657   1HB   CYS  84           HB2      CYS  84  -5.402 -12.308  -0.392
  658   2HB   CYS  84           HB1      CYS  84  -6.831 -13.341  -0.351
  659    HG   CYS  84           HG       CYS  84  -8.196 -11.286   0.589
  660    H    HIS  85           HN       HIS  85  -5.935 -14.962   0.062
  661    HA   HIS  85           HA       HIS  85  -4.227 -16.674   1.589
  662   1HB   HIS  85           HB2      HIS  85  -4.065 -17.977  -0.547
  663   2HB   HIS  85           HB1      HIS  85  -5.722 -17.565  -0.116
  664    HD1  HIS  85           HD1      HIS  85  -6.704 -17.363  -2.456
  665    HD2  HIS  85           HD2      HIS  85  -3.297 -15.018  -1.934
  666    HE1  HIS  85           HE1      HIS  85  -6.545 -15.866  -4.492
  667    H    GLU  86           HN       GLU  86  -2.532 -17.161  -1.030
  668    HA   GLU  86           HA       GLU  86  -0.251 -15.620  -0.099
  669   1HB   GLU  86           HB2      GLU  86  -0.662 -17.388  -2.527
  670   2HB   GLU  86           HB1      GLU  86   0.881 -16.649  -2.100
  671   1HG   GLU  86           HG2      GLU  86   0.719 -17.776   0.143
  672   2HG   GLU  86           HG1      GLU  86  -0.704 -18.633  -0.451
  673    H    PHE  87           HN       PHE  87  -0.771 -15.817  -3.543
  674    HA   PHE  87           HA       PHE  87  -1.995 -13.463  -4.242
  675   1HB   PHE  87           HB2      PHE  87   0.103 -11.933  -4.503
  676   2HB   PHE  87           HB1      PHE  87  -0.692 -12.027  -2.935
  677    HD1  PHE  87           HD2      PHE  87   1.170 -14.965  -4.052
  678    HD2  PHE  87           HD1      PHE  87   1.448 -11.256  -1.903
  679    HE1  PHE  87           HE2      PHE  87   3.293 -15.718  -3.018
  680    HE2  PHE  87           HE1      PHE  87   3.571 -12.009  -0.881
  681    HZ   PHE  87           HZ       PHE  87   4.494 -14.240  -1.432
  682    H    PHE  88           HN       PHE  88   1.254 -13.256  -5.370
  683    HA   PHE  88           HA       PHE  88   0.696 -13.708  -8.058
  684   1HB   PHE  88           HB2      PHE  88   3.278 -14.905  -7.433
  685   2HB   PHE  88           HB1      PHE  88   2.922 -13.459  -8.368
  686    HD1  PHE  88           HD2      PHE  88   2.209 -11.339  -6.943
  687    HD2  PHE  88           HD1      PHE  88   4.402 -14.697  -5.404
  688    HE1  PHE  88           HE2      PHE  88   3.045  -9.938  -5.070
  689    HE2  PHE  88           HE1      PHE  88   5.236 -13.291  -3.537
  690    HZ   PHE  88           HZ       PHE  88   4.556 -10.915  -3.372
  691    H    GLU  89           HN       GLU  89  -0.764 -15.434  -8.337
  692    HA   GLU  89           HA       GLU  89   0.451 -18.138  -8.029
  693   1HB   GLU  89           HB2      GLU  89  -1.283 -17.533  -6.271
  694   2HB   GLU  89           HB1      GLU  89  -2.466 -17.508  -7.572
  695   1HG   GLU  89           HG2      GLU  89  -2.631 -19.713  -6.791
  696   2HG   GLU  89           HG1      GLU  89  -1.519 -19.875  -8.151
  697    H    HIS  90           HN       HIS  90  -0.625 -15.913 -10.180
  698    HA   HIS  90           HA       HIS  90  -2.442 -17.164 -11.900
  699   1HB   HIS  90           HB2      HIS  90  -0.579 -15.007 -12.064
  700   2HB   HIS  90           HB1      HIS  90  -0.383 -15.996 -13.510
  701    HD1  HIS  90           HD1      HIS  90  -1.522 -13.577 -14.432
  702    HD2  HIS  90           HD2      HIS  90  -3.999 -16.324 -12.511
  703    HE1  HIS  90           HE1      HIS  90  -3.895 -12.981 -15.083
  704    H    GLU  91           HN       GLU  91  -2.245 -19.366 -12.288
  705    HA   GLU  91           HA       GLU  91   0.208 -20.214 -13.751
  706   1HB   GLU  91           HB2      GLU  91  -0.390 -20.991 -11.113
  707   2HB   GLU  91           HB1      GLU  91  -0.818 -22.374 -12.121
  708   1HG   GLU  91           HG2      GLU  91   1.521 -21.758 -13.275
  709   2HG   GLU  91           HG1      GLU  91   1.848 -21.118 -11.665
  710   1H    MET   0           HT3      MET   0  -6.767  -3.473 -14.325
  711   2H    MET   0           HT2      MET   0  -7.834  -4.795 -14.277
  712   3H    MET   0           HT1      MET   0  -6.531  -4.791 -15.367
  713    HA   MET   0           HA       MET   0  -7.493  -3.226 -16.749
  714   1HB   MET   0           HB2      MET   0  -9.074  -5.459 -15.851
  715   2HB   MET   0           HB1      MET   0 -10.141  -4.120 -16.276
  716   1HG   MET   0           HG2      MET   0  -8.621  -3.922 -18.396
  717   2HG   MET   0           HG1      MET   0  -8.161  -5.578 -18.005
  718   1HE   MET   0           HE2      MET   0  -9.808  -7.328 -17.329
  719   2HE   MET   0           HE1      MET   0 -11.117  -6.434 -16.560
  720   3HE   MET   0           HE3      MET   0 -11.454  -7.498 -17.932
  721    H    SER   1           HN       SER   1  -8.374  -2.926 -13.454
  722    HA   SER   1           HA       SER   1 -10.124  -0.587 -14.044
  723   1HB   SER   1           HB2      SER   1 -11.201  -1.006 -12.079
  724   2HB   SER   1           HB1      SER   1 -10.496  -2.610 -12.254
  725    HG   SER   1           HG       SER   1  -9.792  -0.495 -10.581
  726    H    GLU   2           HN       GLU   2  -9.719   0.962 -11.813
  727    HA   GLU   2           HA       GLU   2  -7.110   2.136 -12.401
  728   1HB   GLU   2           HB2      GLU   2  -9.537   3.128 -11.484
  729   2HB   GLU   2           HB1      GLU   2  -8.502   3.205 -10.061
  730   1HG   GLU   2           HG2      GLU   2  -8.162   4.575 -12.715
  731   2HG   GLU   2           HG1      GLU   2  -8.072   5.260 -11.095
  732    H    LEU   3           HN       LEU   3  -8.628   1.178  -9.312
  733    HA   LEU   3           HA       LEU   3  -6.097   1.078  -7.926
  734   1HB   LEU   3           HB2      LEU   3  -8.392   1.404  -6.883
  735   2HB   LEU   3           HB1      LEU   3  -8.659  -0.318  -7.132
  736    HG   LEU   3           HG       LEU   3  -6.295  -0.507  -5.936
  737   1HD1  LEU   3          HD11      LEU   3  -7.333   2.224  -5.257
  738   2HD1  LEU   3          HD13      LEU   3  -6.484   1.301  -4.017
  739   3HD1  LEU   3          HD12      LEU   3  -5.674   1.697  -5.532
  740   1HD2  LEU   3          HD23      LEU   3  -9.014  -0.759  -5.163
  741   2HD2  LEU   3          HD22      LEU   3  -7.612  -1.523  -4.415
  742   3HD2  LEU   3          HD21      LEU   3  -8.184   0.038  -3.827
  743    H    GLU   4           HN       GLU   4  -8.317  -1.458  -9.060
  744    HA   GLU   4           HA       GLU   4  -6.848  -3.698  -8.260
  745   1HB   GLU   4           HB2      GLU   4  -9.074  -3.880  -9.273
  746   2HB   GLU   4           HB1      GLU   4  -8.431  -3.346 -10.825
  747   1HG   GLU   4           HG2      GLU   4  -7.217  -5.728  -9.454
  748   2HG   GLU   4           HG1      GLU   4  -8.713  -5.915 -10.369
  749    H    LYS   5           HN       LYS   5  -6.307  -1.657 -11.123
  750    HA   LYS   5           HA       LYS   5  -4.191  -3.424 -12.105
  751   1HB   LYS   5           HB2      LYS   5  -5.365  -2.223 -13.792
  752   2HB   LYS   5           HB1      LYS   5  -5.193  -0.695 -12.929
  753   1HG   LYS   5           HG2      LYS   5  -2.627  -1.997 -13.500
  754   2HG   LYS   5           HG1      LYS   5  -3.530  -1.567 -14.952
  755   1HD   LYS   5           HD2      LYS   5  -3.899   0.678 -13.470
  756   2HD   LYS   5           HD1      LYS   5  -2.301   0.186 -12.905
  757   1HE   LYS   5           HE2      LYS   5  -1.700   1.432 -14.764
  758   2HE   LYS   5           HE1      LYS   5  -1.862  -0.162 -15.501
  759   1HZ   LYS   5           HZ1      LYS   5  -4.350   1.242 -15.356
  760   2HZ   LYS   5           HZ3      LYS   5  -3.189   2.090 -16.255
  761   3HZ   LYS   5           HZ2      LYS   5  -3.601   0.500 -16.688
  762    H    ALA   6           HN       ALA   6  -4.389  -0.366 -10.323
  763    HA   ALA   6           HA       ALA   6  -1.487  -0.014 -10.294
  764   1HB   ALA   6           HB2      ALA   6  -3.192   1.869 -10.188
  765   2HB   ALA   6           HB1      ALA   6  -3.528   1.365  -8.533
  766   3HB   ALA   6           HB3      ALA   6  -1.919   1.942  -8.969
  767    H    MET   7           HN       MET   7  -3.765  -0.284  -7.551
  768    HA   MET   7           HA       MET   7  -2.015  -0.934  -5.534
  769   1HB   MET   7           HB2      MET   7  -4.385  -0.729  -5.075
  770   2HB   MET   7           HB1      MET   7  -4.750  -2.135  -6.083
  771   1HG   MET   7           HG2      MET   7  -4.682  -2.554  -3.560
  772   2HG   MET   7           HG1      MET   7  -3.693  -3.628  -4.548
  773   1HE   MET   7           HE1      MET   7  -3.834  -3.156  -1.737
  774   2HE   MET   7           HE3      MET   7  -2.161  -3.203  -1.168
  775   3HE   MET   7           HE2      MET   7  -3.097  -1.715  -1.043
  776    H    VAL   8           HN       VAL   8  -3.545  -3.291  -7.727
  777    HA   VAL   8           HA       VAL   8  -2.049  -5.531  -6.729
  778    HB   VAL   8           HB       VAL   8  -3.228  -5.232  -9.499
  779   1HG1  VAL   8          HG11      VAL   8  -2.018  -7.397  -7.950
  780   2HG1  VAL   8          HG13      VAL   8  -3.630  -7.803  -8.537
  781   3HG1  VAL   8          HG12      VAL   8  -2.374  -7.320  -9.675
  782   1HG2  VAL   8          HG22      VAL   8  -4.554  -6.114  -6.916
  783   2HG2  VAL   8          HG21      VAL   8  -4.889  -4.613  -7.777
  784   3HG2  VAL   8          HG23      VAL   8  -5.295  -6.162  -8.515
  785    H    ALA   9           HN       ALA   9  -1.449  -3.182  -9.319
  786    HA   ALA   9           HA       ALA   9   0.737  -4.432 -10.594
  787   1HB   ALA   9           HB3      ALA   9   0.070  -1.543 -10.044
  788   2HB   ALA   9           HB2      ALA   9   1.584  -1.975 -10.835
  789   3HB   ALA   9           HB1      ALA   9   0.046  -2.408 -11.580
  790    H    LEU  10           HN       LEU  10   0.624  -2.553  -7.581
  791    HA   LEU  10           HA       LEU  10   3.406  -2.468  -7.038
  792   1HB   LEU  10           HB2      LEU  10   1.140  -1.677  -5.695
  793   2HB   LEU  10           HB1      LEU  10   1.683  -3.032  -4.707
  794    HG   LEU  10           HG       LEU  10   3.588  -0.870  -5.604
  795   1HD1  LEU  10          HD13      LEU  10   1.670   0.134  -4.341
  796   2HD1  LEU  10          HD12      LEU  10   2.034  -0.954  -3.002
  797   3HD1  LEU  10          HD11      LEU  10   3.207   0.269  -3.489
  798   1HD2  LEU  10          HD23      LEU  10   3.704  -3.300  -4.013
  799   2HD2  LEU  10          HD22      LEU  10   5.027  -2.293  -4.603
  800   3HD2  LEU  10          HD21      LEU  10   4.234  -1.902  -3.076
  801    H    ILE  11           HN       ILE  11   0.963  -4.945  -6.281
  802    HA   ILE  11           HA       ILE  11   2.601  -6.788  -4.918
  803    HB   ILE  11           HB       ILE  11   0.114  -6.927  -6.545
  804   1HG1  ILE  11          HG12      ILE  11   0.736  -8.386  -3.990
  805   2HG1  ILE  11          HG11      ILE  11   0.460  -6.644  -3.975
  806   1HG2  ILE  11          HG22      ILE  11   2.026  -9.184  -6.396
  807   2HG2  ILE  11          HG21      ILE  11   0.368  -9.571  -5.948
  808   3HG2  ILE  11          HG23      ILE  11   0.716  -8.892  -7.535
  809   1HD1  ILE  11          HD12      ILE  11  -1.620  -7.556  -5.540
  810   2HD1  ILE  11          HD11      ILE  11  -1.459  -8.840  -4.344
  811   3HD1  ILE  11          HD13      ILE  11  -1.739  -7.178  -3.822
  812    H    ASP  12           HN       ASP  12   2.276  -6.125  -8.366
  813    HA   ASP  12           HA       ASP  12   3.754  -8.319  -9.390
  814   1HB   ASP  12           HB2      ASP  12   2.437  -6.509 -10.661
  815   2HB   ASP  12           HB1      ASP  12   3.896  -5.530 -10.537
  816    H    VAL  13           HN       VAL  13   4.955  -5.014  -8.674
  817    HA   VAL  13           HA       VAL  13   7.663  -5.399  -9.172
  818    HB   VAL  13           HB       VAL  13   6.392  -3.858  -6.889
  819   1HG1  VAL  13          HG11      VAL  13   9.234  -4.068  -7.866
  820   2HG1  VAL  13          HG13      VAL  13   8.653  -2.589  -7.099
  821   3HG1  VAL  13          HG12      VAL  13   8.632  -4.111  -6.208
  822   1HG2  VAL  13          HG22      VAL  13   6.454  -3.446  -9.681
  823   2HG2  VAL  13          HG21      VAL  13   5.952  -2.292  -8.447
  824   3HG2  VAL  13          HG23      VAL  13   7.626  -2.320  -9.001
  825    H    PHE  14           HN       PHE  14   5.793  -6.587  -6.433
  826    HA   PHE  14           HA       PHE  14   7.980  -7.363  -4.769
  827   1HB   PHE  14           HB2      PHE  14   5.503  -7.301  -4.156
  828   2HB   PHE  14           HB1      PHE  14   5.352  -8.843  -5.000
  829    HD1  PHE  14           HD2      PHE  14   6.646 -10.835  -4.216
  830    HD2  PHE  14           HD1      PHE  14   6.549  -7.153  -2.005
  831    HE1  PHE  14           HE2      PHE  14   7.490 -12.018  -2.209
  832    HE2  PHE  14           HE1      PHE  14   7.393  -8.336   0.002
  833    HZ   PHE  14           HZ       PHE  14   7.863 -10.768  -0.098
  834    H    HIS  15           HN       HIS  15   6.165  -9.208  -7.236
  835    HA   HIS  15           HA       HIS  15   7.891 -11.530  -6.950
  836   1HB   HIS  15           HB2      HIS  15   6.080 -12.446  -7.931
  837   2HB   HIS  15           HB1      HIS  15   5.434 -10.856  -8.309
  838    HD1  HIS  15           HD1      HIS  15   6.378  -9.766 -10.612
  839    HD2  HIS  15           HD2      HIS  15   6.986 -13.863 -10.139
  840    HE1  HIS  15           HE1      HIS  15   6.913 -10.681 -12.910
  841    H    GLN  16           HN       GLN  16   8.446  -8.533  -8.249
  842    HA   GLN  16           HA       GLN  16  10.135  -9.530 -10.481
  843   1HB   GLN  16           HB2      GLN  16   8.568  -7.261 -10.200
  844   2HB   GLN  16           HB1      GLN  16  10.198  -6.652  -9.915
  845   1HG   GLN  16           HG2      GLN  16  10.571  -6.699 -12.129
  846   2HG   GLN  16           HG1      GLN  16  10.370  -8.450 -12.104
  847   1HE2  GLN  16          HE22      GLN  16   6.757  -8.091 -12.844
  848   2HE2  GLN  16          HE21      GLN  16   7.702  -8.849 -11.657
  849    H    TYR  17           HN       TYR  17  10.328  -8.038  -7.305
  850    HA   TYR  17           HA       TYR  17  13.299  -7.983  -7.504
  851   1HB   TYR  17           HB2      TYR  17  11.285  -6.588  -5.765
  852   2HB   TYR  17           HB1      TYR  17  12.927  -6.815  -5.166
  853    HD1  TYR  17           HD1      TYR  17  12.093  -6.408  -8.745
  854    HD2  TYR  17           HD2      TYR  17  13.575  -4.486  -5.204
  855    HE1  TYR  17           HE1      TYR  17  12.866  -4.489 -10.109
  856    HE2  TYR  17           HE2      TYR  17  14.350  -2.567  -6.567
  857    HH   TYR  17           HH       TYR  17  13.513  -2.262  -9.949
  858    H    SER  18           HN       SER  18  10.778  -8.898  -5.116
  859    HA   SER  18           HA       SER  18  12.280 -10.351  -3.311
  860   1HB   SER  18           HB2      SER  18   9.675 -10.043  -3.523
  861   2HB   SER  18           HB1      SER  18   9.750 -11.591  -4.361
  862    HG   SER  18           HG       SER  18  10.717 -12.481  -2.537
  863    H    GLY  19           HN       GLY  19  11.368 -11.307  -6.577
  864   1HA   GLY  19           HA2      GLY  19  12.338 -14.029  -6.323
  865   2HA   GLY  19           HA1      GLY  19  11.949 -13.210  -7.835
  866    H    ARG  20           HN       ARG  20  13.653 -12.716  -9.121
  867    HA   ARG  20           HA       ARG  20  15.896 -12.567  -9.815
  868   1HB   ARG  20           HB2      ARG  20  16.040 -11.063  -7.182
  869   2HB   ARG  20           HB1      ARG  20  17.262 -11.001  -8.453
  870   1HG   ARG  20           HG2      ARG  20  15.364 -10.273 -10.020
  871   2HG   ARG  20           HG1      ARG  20  14.414 -10.002  -8.559
  872   1HD   ARG  20           HD2      ARG  20  15.438  -8.028  -8.230
  873   2HD   ARG  20           HD1      ARG  20  17.008  -8.830  -8.198
  874    HE   ARG  20           HE       ARG  20  16.113  -8.530 -10.914
  875   1HH1  ARG  20          HH21      ARG  20  18.415  -7.563  -8.725
  876   2HH1  ARG  20          HH22      ARG  20  18.711  -6.006  -9.425
  877   1HH2  ARG  20          HH11      ARG  20  16.025  -6.189 -11.608
  878   2HH2  ARG  20          HH12      ARG  20  17.358  -5.231 -11.059
  879    H    GLU  21           HN       GLU  21  15.057 -14.821  -7.915
  880    HA   GLU  21           HA       GLU  21  17.730 -15.908  -7.551
  881   1HB   GLU  21           HB2      GLU  21  16.458 -14.518  -5.385
  882   2HB   GLU  21           HB1      GLU  21  16.547 -16.235  -4.995
  883   1HG   GLU  21           HG2      GLU  21  18.923 -14.765  -6.120
  884   2HG   GLU  21           HG1      GLU  21  18.584 -14.762  -4.390
  885    H    GLY  22           HN       GLY  22  14.621 -16.483  -5.887
  886   1HA   GLY  22           HA2      GLY  22  13.670 -18.566  -7.528
  887   2HA   GLY  22           HA1      GLY  22  14.721 -19.318  -6.332
  888    H    ASP  23           HN       ASP  23  14.165 -17.687  -4.120
  889    HA   ASP  23           HA       ASP  23  11.930 -18.898  -2.970
  890   1HB   ASP  23           HB2      ASP  23  11.896 -16.604  -1.588
  891   2HB   ASP  23           HB1      ASP  23  13.152 -17.813  -1.351
  892    H    LYS  24           HN       LYS  24  11.929 -15.480  -4.059
  893    HA   LYS  24           HA       LYS  24  10.180 -14.184  -4.929
  894   1HB   LYS  24           HB2      LYS  24   9.001 -16.833  -5.808
  895   2HB   LYS  24           HB1      LYS  24   8.734 -15.247  -6.531
  896   1HG   LYS  24           HG2      LYS  24  11.101 -15.130  -7.187
  897   2HG   LYS  24           HG1      LYS  24  11.395 -16.701  -6.439
  898   1HD   LYS  24           HD2      LYS  24  11.092 -17.087  -8.796
  899   2HD   LYS  24           HD1      LYS  24   9.635 -17.661  -7.986
  900   1HE   LYS  24           HE2      LYS  24   8.372 -15.792  -8.672
  901   2HE   LYS  24           HE1      LYS  24   9.811 -14.842  -9.039
  902   1HZ   LYS  24           HZ1      LYS  24  10.120 -16.959 -10.652
  903   2HZ   LYS  24           HZ3      LYS  24   8.431 -16.806 -10.650
  904   3HZ   LYS  24           HZ2      LYS  24   9.402 -15.495 -11.124
  905    H    HIS  25           HN       HIS  25   9.973 -15.522  -2.188
  906    HA   HIS  25           HA       HIS  25   7.078 -14.942  -1.837
  907   1HB   HIS  25           HB2      HIS  25   8.489 -17.507  -1.164
  908   2HB   HIS  25           HB1      HIS  25   7.142 -16.967  -0.162
  909    HD1  HIS  25           HD1      HIS  25   6.979 -19.497  -2.034
  910    HD2  HIS  25           HD2      HIS  25   5.585 -15.698  -3.030
  911    HE1  HIS  25           HE1      HIS  25   5.238 -19.826  -3.843
  912    H    LYS  26           HN       LYS  26  10.063 -14.073  -1.026
  913    HA   LYS  26           HA       LYS  26   9.203 -13.065   1.618
  914   1HB   LYS  26           HB2      LYS  26  11.200 -13.875   2.763
  915   2HB   LYS  26           HB1      LYS  26  10.334 -15.249   2.075
  916   1HG   LYS  26           HG2      LYS  26  12.385 -15.784   1.227
  917   2HG   LYS  26           HG1      LYS  26  11.955 -14.602  -0.009
  918   1HD   LYS  26           HD2      LYS  26  13.627 -13.246   0.641
  919   2HD   LYS  26           HD1      LYS  26  13.021 -13.239   2.297
  920   1HE   LYS  26           HE2      LYS  26  14.501 -15.653   1.308
  921   2HE   LYS  26           HE1      LYS  26  15.419 -14.216   1.762
  922   1HZ   LYS  26           HZ1      LYS  26  13.626 -14.487   3.778
  923   2HZ   LYS  26           HZ3      LYS  26  14.028 -16.096   3.421
  924   3HZ   LYS  26           HZ2      LYS  26  15.249 -14.986   3.827
  925    H    LEU  27           HN       LEU  27  10.039 -11.025   1.962
  926    HA   LEU  27           HA       LEU  27  11.868  -9.991  -0.139
  927   1HB   LEU  27           HB2      LEU  27   9.619  -8.912   1.273
  928   2HB   LEU  27           HB1      LEU  27  11.036  -7.930   1.647
  929    HG   LEU  27           HG       LEU  27   9.752  -7.226  -0.431
  930   1HD1  LEU  27          HD11      LEU  27  12.174  -6.687   0.040
  931   2HD1  LEU  27          HD13      LEU  27  12.613  -8.097  -0.927
  932   3HD1  LEU  27          HD12      LEU  27  11.767  -6.743  -1.674
  933   1HD2  LEU  27          HD21      LEU  27  10.030  -9.993  -0.989
  934   2HD2  LEU  27          HD23      LEU  27   9.312  -8.760  -2.023
  935   3HD2  LEU  27          HD22      LEU  27  11.027  -9.142  -2.168
  936    H    LYS  28           HN       LYS  28  13.054  -7.897   1.171
  937    HA   LYS  28           HA       LYS  28  14.321  -8.916   3.628
  938   1HB   LYS  28           HB2      LYS  28  15.526  -9.318   1.094
  939   2HB   LYS  28           HB1      LYS  28  16.414  -8.002   1.866
  940   1HG   LYS  28           HG2      LYS  28  17.007  -9.316   3.715
  941   2HG   LYS  28           HG1      LYS  28  15.725 -10.487   3.410
  942   1HD   LYS  28           HD2      LYS  28  17.250 -11.749   2.335
  943   2HD   LYS  28           HD1      LYS  28  17.281 -10.512   1.079
  944   1HE   LYS  28           HE2      LYS  28  19.250  -9.604   1.829
  945   2HE   LYS  28           HE1      LYS  28  18.891  -9.961   3.517
  946   1HZ   LYS  28           HZ1      LYS  28  19.337 -12.302   3.064
  947   2HZ   LYS  28           HZ3      LYS  28  19.725 -11.930   1.456
  948   3HZ   LYS  28           HZ2      LYS  28  20.692 -11.337   2.721
  949    H    LYS  29           HN       LYS  29  14.647  -7.184   4.963
  950    HA   LYS  29           HA       LYS  29  13.755  -4.614   4.492
  951   1HB   LYS  29           HB2      LYS  29  15.826  -3.999   6.123
  952   2HB   LYS  29           HB1      LYS  29  14.341  -4.756   6.694
  953   1HG   LYS  29           HG2      LYS  29  15.332  -6.940   6.641
  954   2HG   LYS  29           HG1      LYS  29  16.747  -6.345   5.770
  955   1HD   LYS  29           HD2      LYS  29  17.691  -6.183   7.829
  956   2HD   LYS  29           HD1      LYS  29  16.719  -4.720   7.985
  957   1HE   LYS  29           HE2      LYS  29  15.105  -7.040   8.576
  958   2HE   LYS  29           HE1      LYS  29  16.556  -7.043   9.577
  959   1HZ   LYS  29           HZ2      LYS  29  15.381  -4.444   9.352
  960   2HZ   LYS  29           HZ1      LYS  29  14.308  -5.576  10.027
  961   3HZ   LYS  29           HZ3      LYS  29  15.824  -5.313  10.742
  962    H    SER  30           HN       SER  30  16.705  -6.016   3.255
  963    HA   SER  30           HA       SER  30  17.922  -3.450   2.581
  964   1HB   SER  30           HB2      SER  30  18.538  -6.327   2.091
  965   2HB   SER  30           HB1      SER  30  19.235  -5.153   0.981
  966    HG   SER  30           HG       SER  30  20.578  -4.630   2.497
  967    H    GLU  31           HN       GLU  31  16.151  -5.963   0.743
  968    HA   GLU  31           HA       GLU  31  16.269  -4.434  -1.727
  969   1HB   GLU  31           HB2      GLU  31  15.976  -6.946  -1.608
  970   2HB   GLU  31           HB1      GLU  31  14.345  -6.669  -0.996
  971   1HG   GLU  31           HG2      GLU  31  13.655  -6.538  -3.136
  972   2HG   GLU  31           HG1      GLU  31  14.556  -5.025  -3.259
  973    H    LEU  32           HN       LEU  32  14.411  -4.277   1.124
  974    HA   LEU  32           HA       LEU  32  12.053  -3.062  -0.125
  975   1HB   LEU  32           HB2      LEU  32  11.642  -4.232   1.937
  976   2HB   LEU  32           HB1      LEU  32  12.960  -3.386   2.750
  977    HG   LEU  32           HG       LEU  32  11.758  -1.265   2.568
  978   1HD1  LEU  32          HD13      LEU  32  10.357  -2.665   0.522
  979   2HD1  LEU  32          HD12      LEU  32   9.177  -2.203   1.748
  980   3HD1  LEU  32          HD11      LEU  32  10.185  -0.973   0.989
  981   1HD2  LEU  32          HD23      LEU  32  11.271  -2.885   4.459
  982   2HD2  LEU  32          HD22      LEU  32   9.984  -1.726   4.131
  983   3HD2  LEU  32          HD21      LEU  32   9.840  -3.390   3.562
  984    H    LYS  33           HN       LYS  33  14.806  -2.051   1.871
  985    HA   LYS  33           HA       LYS  33  14.357   0.712   2.016
  986   1HB   LYS  33           HB2      LYS  33  16.290  -0.778   2.952
  987   2HB   LYS  33           HB1      LYS  33  17.097  -0.402   1.436
  988   1HG   LYS  33           HG2      LYS  33  16.428   2.078   2.038
  989   2HG   LYS  33           HG1      LYS  33  16.333   1.440   3.679
  990   1HD   LYS  33           HD2      LYS  33  18.739   1.131   1.860
  991   2HD   LYS  33           HD1      LYS  33  18.594   2.353   3.124
  992   1HE   LYS  33           HE2      LYS  33  18.053   0.284   4.658
  993   2HE   LYS  33           HE1      LYS  33  18.877  -0.624   3.391
  994   1HZ   LYS  33           HZ3      LYS  33  20.206   1.800   4.264
  995   2HZ   LYS  33           HZ2      LYS  33  20.131   0.560   5.421
  996   3HZ   LYS  33           HZ1      LYS  33  20.853   0.272   3.911
  997    H    GLU  34           HN       GLU  34  15.838  -1.195  -0.580
  998    HA   GLU  34           HA       GLU  34  16.329   1.117  -2.269
  999   1HB   GLU  34           HB2      GLU  34  17.235  -0.421  -3.792
 1000   2HB   GLU  34           HB1      GLU  34  17.452  -1.273  -2.265
 1001   1HG   GLU  34           HG2      GLU  34  15.521  -2.637  -2.647
 1002   2HG   GLU  34           HG1      GLU  34  15.040  -1.676  -4.041
 1003    H    LEU  35           HN       LEU  35  13.913  -1.447  -2.115
 1004    HA   LEU  35           HA       LEU  35  12.334  -0.969  -4.334
 1005   1HB   LEU  35           HB2      LEU  35  12.031  -2.404  -2.009
 1006   2HB   LEU  35           HB1      LEU  35  10.777  -1.171  -1.834
 1007    HG   LEU  35           HG       LEU  35   9.965  -3.222  -3.014
 1008   1HD1  LEU  35          HD11      LEU  35   9.638  -0.506  -3.737
 1009   2HD1  LEU  35          HD13      LEU  35   9.752  -1.411  -5.246
 1010   3HD1  LEU  35          HD12      LEU  35   8.527  -1.838  -4.052
 1011   1HD2  LEU  35          HD21      LEU  35  12.388  -3.250  -4.218
 1012   2HD2  LEU  35          HD23      LEU  35  10.970  -4.042  -4.906
 1013   3HD2  LEU  35          HD22      LEU  35  11.446  -2.440  -5.469
 1014    H    ILE  36           HN       ILE  36  12.394   0.905  -1.310
 1015    HA   ILE  36           HA       ILE  36  10.348   2.759  -2.272
 1016    HB   ILE  36           HB       ILE  36  12.151   3.489  -0.009
 1017   1HG1  ILE  36          HG12      ILE  36  10.301   1.101  -0.068
 1018   2HG1  ILE  36          HG11      ILE  36  11.951   1.196   0.539
 1019   1HG2  ILE  36          HG22      ILE  36   9.909   4.581  -0.975
 1020   2HG2  ILE  36          HG21      ILE  36   9.171   3.402   0.107
 1021   3HG2  ILE  36          HG23      ILE  36  10.283   4.611   0.748
 1022   1HD1  ILE  36          HD11      ILE  36  10.731   3.066   2.106
 1023   2HD1  ILE  36          HD13      ILE  36   9.413   1.919   1.872
 1024   3HD1  ILE  36          HD12      ILE  36  10.938   1.378   2.571
 1025    H    ASN  37           HN       ASN  37  13.755   3.306  -1.281
 1026    HA   ASN  37           HA       ASN  37  13.904   5.826  -2.629
 1027   1HB   ASN  37           HB2      ASN  37  15.426   5.140  -0.781
 1028   2HB   ASN  37           HB1      ASN  37  16.183   3.979  -1.873
 1029   1HD2  ASN  37          HD21      ASN  37  17.112   6.687  -0.571
 1030   2HD2  ASN  37          HD22      ASN  37  17.790   7.522  -1.881
 1031    H    ASN  38           HN       ASN  38  15.560   2.768  -3.494
 1032    HA   ASN  38           HA       ASN  38  16.564   3.446  -5.969
 1033   1HB   ASN  38           HB2      ASN  38  16.755   1.193  -4.865
 1034   2HB   ASN  38           HB1      ASN  38  15.126   0.834  -5.437
 1035   1HD2  ASN  38          HD22      ASN  38  16.130   0.232  -8.771
 1036   2HD2  ASN  38          HD21      ASN  38  14.830   0.384  -7.692
 1037    H    GLU  39           HN       GLU  39  13.197   2.424  -5.330
 1038    HA   GLU  39           HA       GLU  39  12.519   2.977  -8.152
 1039   1HB   GLU  39           HB2      GLU  39  11.524   1.223  -6.176
 1040   2HB   GLU  39           HB1      GLU  39  10.229   2.373  -6.513
 1041   1HG   GLU  39           HG2      GLU  39  10.044   0.509  -8.067
 1042   2HG   GLU  39           HG1      GLU  39  10.557   1.943  -8.957
 1043    H    LEU  40           HN       LEU  40  10.650   3.789  -5.216
 1044    HA   LEU  40           HA       LEU  40   9.410   6.049  -6.340
 1045   1HB   LEU  40           HB2      LEU  40  10.046   5.461  -3.437
 1046   2HB   LEU  40           HB1      LEU  40   8.907   6.682  -3.992
 1047    HG   LEU  40           HG       LEU  40   8.730   3.696  -4.463
 1048   1HD1  LEU  40          HD11      LEU  40   7.678   5.508  -2.457
 1049   2HD1  LEU  40          HD13      LEU  40   6.367   4.741  -3.353
 1050   3HD1  LEU  40          HD12      LEU  40   7.570   3.749  -2.533
 1051   1HD2  LEU  40          HD22      LEU  40   7.412   6.032  -5.759
 1052   2HD2  LEU  40          HD21      LEU  40   7.769   4.434  -6.417
 1053   3HD2  LEU  40          HD23      LEU  40   6.378   4.661  -5.357
 1054    H    SER  41           HN       SER  41  11.285   6.835  -3.506
 1055    HA   SER  41           HA       SER  41  12.642   8.740  -3.158
 1056   1HB   SER  41           HB2      SER  41  14.299   7.096  -3.886
 1057   2HB   SER  41           HB1      SER  41  13.947   7.449  -5.573
 1058    HG   SER  41           HG       SER  41  15.279   9.054  -5.419
 1059    H    HIS  42           HN       HIS  42  10.749  10.131  -3.916
 1060    HA   HIS  42           HA       HIS  42  11.688  11.817  -6.156
 1061   1HB   HIS  42           HB2      HIS  42   9.683   9.905  -6.570
 1062   2HB   HIS  42           HB1      HIS  42   8.815  11.428  -6.366
 1063    HD1  HIS  42           HD1      HIS  42   9.050  10.013  -9.152
 1064    HD2  HIS  42           HD2      HIS  42  11.563  13.065  -7.829
 1065    HE1  HIS  42           HE1      HIS  42  10.035  11.079 -11.226
 1066    H    PHE  43           HN       PHE  43   9.124  11.324  -3.714
 1067    HA   PHE  43           HA       PHE  43   8.889  14.279  -3.463
 1068   1HB   PHE  43           HB2      PHE  43   7.154  12.873  -1.650
 1069   2HB   PHE  43           HB1      PHE  43   6.717  13.888  -3.018
 1070    HD1  PHE  43           HD2      PHE  43   7.432  10.436  -1.919
 1071    HD2  PHE  43           HD1      PHE  43   6.179  12.930  -5.182
 1072    HE1  PHE  43           HE2      PHE  43   6.700   8.426  -3.174
 1073    HE2  PHE  43           HE1      PHE  43   5.446  10.919  -6.437
 1074    HZ   PHE  43           HZ       PHE  43   5.706   8.668  -5.432
 1075    H    LEU  44           HN       LEU  44  10.824  14.718  -2.319
 1076    HA   LEU  44           HA       LEU  44  10.713  13.941   0.542
 1077   1HB   LEU  44           HB2      LEU  44  12.903  13.300  -1.394
 1078   2HB   LEU  44           HB1      LEU  44  13.350  13.738   0.254
 1079    HG   LEU  44           HG       LEU  44  11.128  11.899   0.303
 1080   1HD1  LEU  44          HD13      LEU  44  13.052  11.423  -1.790
 1081   2HD1  LEU  44          HD12      LEU  44  13.193  10.165  -0.562
 1082   3HD1  LEU  44          HD11      LEU  44  11.643  10.459  -1.349
 1083   1HD2  LEU  44          HD23      LEU  44  13.963  12.014   1.310
 1084   2HD2  LEU  44          HD22      LEU  44  12.460  12.061   2.230
 1085   3HD2  LEU  44          HD21      LEU  44  13.008  10.546   1.514
 1086    H    GLU  45           HN       GLU  45   9.935  16.308   0.304
 1087    HA   GLU  45           HA       GLU  45  12.326  18.082   0.527
 1088   1HB   GLU  45           HB2      GLU  45   9.670  18.950  -0.626
 1089   2HB   GLU  45           HB1      GLU  45  11.192  19.843  -0.635
 1090   1HG   GLU  45           HG2      GLU  45  11.607  17.259  -1.830
 1091   2HG   GLU  45           HG1      GLU  45  10.235  18.045  -2.609
 1092    H    GLU  46           HN       GLU  46   8.840  17.864   1.236
 1093    HA   GLU  46           HA       GLU  46   9.415  19.236   3.832
 1094   1HB   GLU  46           HB2      GLU  46   6.902  19.313   2.137
 1095   2HB   GLU  46           HB1      GLU  46   7.055  20.040   3.738
 1096   1HG   GLU  46           HG2      GLU  46   7.625  21.880   2.483
 1097   2HG   GLU  46           HG1      GLU  46   9.219  21.134   2.585
 1098    H    ILE  47           HN       ILE  47   9.864  16.810   4.334
 1099    HA   ILE  47           HA       ILE  47   7.687  14.953   4.474
 1100    HB   ILE  47           HB       ILE  47  10.217  15.122   6.137
 1101   1HG1  ILE  47          HG12      ILE  47  10.066  13.004   4.163
 1102   2HG1  ILE  47          HG11      ILE  47   9.824  14.576   3.400
 1103   1HG2  ILE  47          HG23      ILE  47   8.400  13.737   7.154
 1104   2HG2  ILE  47          HG22      ILE  47   8.344  12.782   5.673
 1105   3HG2  ILE  47          HG21      ILE  47   9.799  12.779   6.669
 1106   1HD1  ILE  47          HD13      ILE  47  12.102  13.951   5.296
 1107   2HD1  ILE  47          HD12      ILE  47  12.237  13.893   3.539
 1108   3HD1  ILE  47          HD11      ILE  47  11.888  15.422   4.348
 1109    H    LYS  48           HN       LYS  48   5.994  14.892   5.873
 1110    HA   LYS  48           HA       LYS  48   6.021  16.787   8.166
 1111   1HB   LYS  48           HB2      LYS  48   4.009  15.857   6.316
 1112   2HB   LYS  48           HB1      LYS  48   3.505  15.507   7.970
 1113   1HG   LYS  48           HG2      LYS  48   3.766  17.809   8.623
 1114   2HG   LYS  48           HG1      LYS  48   4.546  18.212   7.095
 1115   1HD   LYS  48           HD2      LYS  48   2.520  17.892   5.866
 1116   2HD   LYS  48           HD1      LYS  48   1.728  17.124   7.242
 1117   1HE   LYS  48           HE2      LYS  48   2.133  19.358   8.478
 1118   2HE   LYS  48           HE1      LYS  48   2.444  20.033   6.881
 1119   1HZ   LYS  48           HZ2      LYS  48   0.246  19.004   6.228
 1120   2HZ   LYS  48           HZ1      LYS  48  -0.044  18.790   7.887
 1121   3HZ   LYS  48           HZ3      LYS  48   0.172  20.351   7.262
 1122    H    GLU  49           HN       GLU  49   5.605  13.351   7.389
 1123    HA   GLU  49           HA       GLU  49   5.373  12.713  10.274
 1124   1HB   GLU  49           HB2      GLU  49   4.860  11.253   7.721
 1125   2HB   GLU  49           HB1      GLU  49   5.356  10.298   9.114
 1126   1HG   GLU  49           HG2      GLU  49   3.097  12.308   9.203
 1127   2HG   GLU  49           HG1      GLU  49   2.857  10.588   8.887
 1128    H    GLN  50           HN       GLN  50   7.760  13.713  10.158
 1129    HA   GLN  50           HA       GLN  50   9.923  12.260   9.089
 1130   1HB   GLN  50           HB2      GLN  50   9.888  14.512  10.405
 1131   2HB   GLN  50           HB1      GLN  50  10.071  13.496  11.834
 1132   1HG   GLN  50           HG2      GLN  50  12.197  12.812  11.250
 1133   2HG   GLN  50           HG1      GLN  50  11.889  12.976   9.522
 1134   1HE2  GLN  50          HE22      GLN  50  14.050  15.837  10.167
 1135   2HE2  GLN  50          HE21      GLN  50  14.154  14.165   9.894
 1136    H    GLU  51           HN       GLU  51   7.860  11.517  11.806
 1137    HA   GLU  51           HA       GLU  51   9.645   9.556  12.992
 1138   1HB   GLU  51           HB2      GLU  51   7.734  10.749  14.180
 1139   2HB   GLU  51           HB1      GLU  51   6.637   9.689  13.294
 1140   1HG   GLU  51           HG2      GLU  51   6.976   8.081  14.827
 1141   2HG   GLU  51           HG1      GLU  51   8.684   8.047  14.389
 1142    H    VAL  52           HN       VAL  52   7.015   9.458  10.625
 1143    HA   VAL  52           HA       VAL  52   6.777   6.602  10.515
 1144    HB   VAL  52           HB       VAL  52   6.173   8.766   8.488
 1145   1HG1  VAL  52          HG11      VAL  52   5.948   5.782   8.328
 1146   2HG1  VAL  52          HG13      VAL  52   4.720   6.779   7.549
 1147   3HG1  VAL  52          HG12      VAL  52   6.412   6.935   7.078
 1148   1HG2  VAL  52          HG23      VAL  52   4.889   7.971  10.835
 1149   2HG2  VAL  52          HG22      VAL  52   4.172   8.912   9.529
 1150   3HG2  VAL  52          HG21      VAL  52   3.986   7.159   9.556
 1151    H    VAL  53           HN       VAL  53   8.475   8.836   8.287
 1152    HA   VAL  53           HA       VAL  53   9.793   6.712   6.862
 1153    HB   VAL  53           HB       VAL  53  10.556   9.638   7.136
 1154   1HG1  VAL  53          HG13      VAL  53  11.801   7.374   5.793
 1155   2HG1  VAL  53          HG12      VAL  53  11.347   8.632   4.645
 1156   3HG1  VAL  53          HG11      VAL  53  12.406   9.017   6.001
 1157   1HG2  VAL  53          HG21      VAL  53   8.553   8.145   5.526
 1158   2HG2  VAL  53          HG23      VAL  53   8.542   9.826   6.061
 1159   3HG2  VAL  53          HG22      VAL  53   9.499   9.354   4.657
 1160    H    ASP  54           HN       ASP  54  10.551   8.475   9.788
 1161    HA   ASP  54           HA       ASP  54  13.339   7.631   9.858
 1162   1HB   ASP  54           HB2      ASP  54  11.467   8.888  11.864
 1163   2HB   ASP  54           HB1      ASP  54  13.081   8.351  12.328
 1164    H    LYS  55           HN       LYS  55  10.279   6.284  10.820
 1165    HA   LYS  55           HA       LYS  55  11.447   4.343  12.651
 1166   1HB   LYS  55           HB2      LYS  55   8.952   5.343  12.427
 1167   2HB   LYS  55           HB1      LYS  55   8.756   3.872  11.473
 1168   1HG   LYS  55           HG2      LYS  55   9.574   4.132  14.367
 1169   2HG   LYS  55           HG1      LYS  55   8.235   3.207  13.687
 1170   1HD   LYS  55           HD2      LYS  55   9.902   1.758  12.511
 1171   2HD   LYS  55           HD1      LYS  55  11.188   2.623  13.354
 1172   1HE   LYS  55           HE2      LYS  55  10.137   1.976  15.528
 1173   2HE   LYS  55           HE1      LYS  55   8.960   1.013  14.636
 1174   1HZ   LYS  55           HZ3      LYS  55  10.784  -0.273  13.700
 1175   2HZ   LYS  55           HZ2      LYS  55  11.907   0.648  14.581
 1176   3HZ   LYS  55           HZ1      LYS  55  10.796  -0.348  15.394
 1177    H    VAL  56           HN       VAL  56  10.031   4.204   9.362
 1178    HA   VAL  56           HA       VAL  56  10.692   1.409   9.031
 1179    HB   VAL  56           HB       VAL  56  10.223   1.885   6.614
 1180   1HG1  VAL  56          HG13      VAL  56   8.432   1.350   8.303
 1181   2HG1  VAL  56          HG12      VAL  56   8.161   3.084   8.475
 1182   3HG1  VAL  56          HG11      VAL  56   7.862   2.294   6.927
 1183   1HG2  VAL  56          HG22      VAL  56  10.440   4.650   7.642
 1184   2HG2  VAL  56          HG21      VAL  56  10.739   4.025   6.023
 1185   3HG2  VAL  56          HG23      VAL  56   9.090   4.358   6.549
 1186    H    MET  57           HN       MET  57  12.228   4.447   8.071
 1187    HA   MET  57           HA       MET  57  14.405   3.210   6.635
 1188   1HB   MET  57           HB2      MET  57  13.684   5.625   6.432
 1189   2HB   MET  57           HB1      MET  57  14.381   5.904   8.029
 1190   1HG   MET  57           HG2      MET  57  16.017   6.512   6.329
 1191   2HG   MET  57           HG1      MET  57  16.571   5.069   7.175
 1192   1HE   MET  57           HE3      MET  57  14.896   6.654   4.295
 1193   2HE   MET  57           HE2      MET  57  14.890   5.501   2.964
 1194   3HE   MET  57           HE1      MET  57  13.715   5.338   4.265
 1195    H    GLU  58           HN       GLU  58  13.735   3.813  10.003
 1196    HA   GLU  58           HA       GLU  58  16.509   3.550  10.866
 1197   1HB   GLU  58           HB2      GLU  58  13.847   3.762  12.209
 1198   2HB   GLU  58           HB1      GLU  58  15.178   3.061  13.128
 1199   1HG   GLU  58           HG2      GLU  58  16.552   5.035  12.728
 1200   2HG   GLU  58           HG1      GLU  58  15.297   5.732  11.703
 1201    H    THR  59           HN       THR  59  13.631   1.393  11.121
 1202    HA   THR  59           HA       THR  59  15.135  -0.844  12.107
 1203    HB   THR  59           HB       THR  59  12.540  -0.747  10.537
 1204    HG1  THR  59           HG1      THR  59  12.593   0.242  12.630
 1205   1HG2  THR  59          HG23      THR  59  14.194  -2.981  11.506
 1206   2HG2  THR  59          HG22      THR  59  12.505  -3.061  12.003
 1207   3HG2  THR  59          HG21      THR  59  12.916  -2.971  10.292
 1208    H    LEU  60           HN       LEU  60  14.485   0.434   8.939
 1209    HA   LEU  60           HA       LEU  60  15.341  -1.787   7.359
 1210   1HB   LEU  60           HB2      LEU  60  14.899   1.128   6.970
 1211   2HB   LEU  60           HB1      LEU  60  15.951   0.340   5.797
 1212    HG   LEU  60           HG       LEU  60  13.164  -0.586   6.548
 1213   1HD1  LEU  60          HD13      LEU  60  13.321   1.554   5.204
 1214   2HD1  LEU  60          HD12      LEU  60  14.135   0.623   3.947
 1215   3HD1  LEU  60          HD11      LEU  60  12.474   0.238   4.391
 1216   1HD2  LEU  60          HD22      LEU  60  15.402  -1.797   5.086
 1217   2HD2  LEU  60          HD21      LEU  60  13.941  -2.551   5.724
 1218   3HD2  LEU  60          HD23      LEU  60  13.907  -1.757   4.151
 1219    H    ASP  61           HN       ASP  61  17.097   1.171   8.341
 1220    HA   ASP  61           HA       ASP  61  19.649   0.052   7.455
 1221   1HB   ASP  61           HB2      ASP  61  18.710   2.610   7.827
 1222   2HB   ASP  61           HB1      ASP  61  19.714   2.382   9.259
 1223    H    GLU  62           HN       GLU  62  17.740  -0.498  10.120
 1224    HA   GLU  62           HA       GLU  62  19.742  -0.490  12.208
 1225   1HB   GLU  62           HB2      GLU  62  16.994  -0.762  12.134
 1226   2HB   GLU  62           HB1      GLU  62  17.533  -2.386  12.555
 1227   1HG   GLU  62           HG2      GLU  62  18.530  -1.688  14.535
 1228   2HG   GLU  62           HG1      GLU  62  18.758  -0.037  13.961
 1229    H    ASP  63           HN       ASP  63  18.348  -3.041  10.152
 1230    HA   ASP  63           HA       ASP  63  20.598  -4.801  11.025
 1231   1HB   ASP  63           HB2      ASP  63  18.269  -5.604  11.541
 1232   2HB   ASP  63           HB1      ASP  63  17.964  -5.658   9.805
 1233    H    GLY  64           HN       GLY  64  18.500  -4.237   8.196
 1234   1HA   GLY  64           HA2      GLY  64  19.199  -3.869   5.950
 1235   2HA   GLY  64           HA1      GLY  64  20.868  -4.142   6.455
 1236    H    ASP  65           HN       ASP  65  20.654  -6.643   7.661
 1237    HA   ASP  65           HA       ASP  65  19.947  -8.341   5.310
 1238   1HB   ASP  65           HB2      ASP  65  22.361  -8.230   6.282
 1239   2HB   ASP  65           HB1      ASP  65  21.708  -9.218   7.589
 1240    H    GLY  66           HN       GLY  66  17.676  -8.154   6.249
 1241   1HA   GLY  66           HA2      GLY  66  17.290 -10.332   8.235
 1242   2HA   GLY  66           HA1      GLY  66  16.414  -8.814   8.415
 1243    H    GLU  67           HN       GLU  67  15.049 -11.255   8.098
 1244    HA   GLU  67           HA       GLU  67  14.207 -11.339   5.261
 1245   1HB   GLU  67           HB2      GLU  67  12.878 -13.306   5.945
 1246   2HB   GLU  67           HB1      GLU  67  14.564 -13.480   6.430
 1247   1HG   GLU  67           HG2      GLU  67  13.585 -12.257   8.636
 1248   2HG   GLU  67           HG1      GLU  67  12.141 -13.122   8.108
 1249    H    CYS  68           HN       CYS  68  12.322 -10.449   4.555
 1250    HA   CYS  68           HA       CYS  68  10.456  -9.348   6.619
 1251   1HB   CYS  68           HB2      CYS  68  11.151  -8.241   3.881
 1252   2HB   CYS  68           HB1      CYS  68   9.925  -7.574   4.954
 1253    HG   CYS  68           HG       CYS  68  12.415  -7.672   6.545
 1254    H    ASP  69           HN       ASP  69   8.163  -9.236   5.851
 1255    HA   ASP  69           HA       ASP  69   7.579 -11.601   4.139
 1256   1HB   ASP  69           HB2      ASP  69   6.077 -10.101   6.259
 1257   2HB   ASP  69           HB1      ASP  69   5.162 -10.977   5.034
 1258    H    PHE  70           HN       PHE  70   5.270 -11.125   2.991
 1259    HA   PHE  70           HA       PHE  70   5.877  -8.967   1.091
 1260   1HB   PHE  70           HB2      PHE  70   3.526  -9.843   0.181
 1261   2HB   PHE  70           HB1      PHE  70   5.014 -10.733  -0.123
 1262    HD1  PHE  70           HD2      PHE  70   2.112 -10.496   2.220
 1263    HD2  PHE  70           HD1      PHE  70   5.301 -12.931   0.683
 1264    HE1  PHE  70           HE2      PHE  70   1.188 -12.464   3.414
 1265    HE2  PHE  70           HE1      PHE  70   4.376 -14.898   1.874
 1266    HZ   PHE  70           HZ       PHE  70   2.320 -14.665   3.239
 1267    H    GLN  71           HN       GLN  71   3.683  -9.570   3.747
 1268    HA   GLN  71           HA       GLN  71   1.982  -7.277   3.102
 1269   1HB   GLN  71           HB2      GLN  71   0.705  -7.882   4.987
 1270   2HB   GLN  71           HB1      GLN  71   1.302  -9.424   4.378
 1271   1HG   GLN  71           HG2      GLN  71   2.113  -9.796   6.447
 1272   2HG   GLN  71           HG1      GLN  71   3.315  -8.555   6.102
 1273   1HE2  GLN  71          HE22      GLN  71   0.778  -6.104   7.590
 1274   2HE2  GLN  71          HE21      GLN  71   1.228  -6.390   5.979
 1275    H    GLU  72           HN       GLU  72   4.846  -7.862   5.063
 1276    HA   GLU  72           HA       GLU  72   4.561  -5.432   6.612
 1277   1HB   GLU  72           HB2      GLU  72   6.531  -6.071   7.646
 1278   2HB   GLU  72           HB1      GLU  72   5.995  -7.628   7.031
 1279   1HG   GLU  72           HG2      GLU  72   7.531  -7.579   5.232
 1280   2HG   GLU  72           HG1      GLU  72   7.838  -5.858   5.434
 1281    H    PHE  73           HN       PHE  73   6.486  -6.367   3.758
 1282    HA   PHE  73           HA       PHE  73   7.630  -3.753   3.376
 1283   1HB   PHE  73           HB2      PHE  73   8.813  -5.006   1.903
 1284   2HB   PHE  73           HB1      PHE  73   7.647  -6.318   2.024
 1285    HD1  PHE  73           HD2      PHE  73   5.433  -6.035   0.669
 1286    HD2  PHE  73           HD1      PHE  73   9.022  -3.808  -0.104
 1287    HE1  PHE  73           HE2      PHE  73   4.621  -5.523  -1.616
 1288    HE2  PHE  73           HE1      PHE  73   8.208  -3.293  -2.388
 1289    HZ   PHE  73           HZ       PHE  73   6.008  -4.151  -3.144
 1290    H    MET  74           HN       MET  74   4.573  -5.218   2.617
 1291    HA   MET  74           HA       MET  74   3.687  -3.359   0.620
 1292   1HB   MET  74           HB2      MET  74   2.531  -5.499   2.269
 1293   2HB   MET  74           HB1      MET  74   1.394  -4.200   1.922
 1294   1HG   MET  74           HG2      MET  74   3.071  -5.214  -0.331
 1295   2HG   MET  74           HG1      MET  74   1.746  -6.234   0.228
 1296   1HE   MET  74           HE1      MET  74   2.793  -4.068  -2.226
 1297   2HE   MET  74           HE3      MET  74   1.628  -2.770  -2.518
 1298   3HE   MET  74           HE2      MET  74   2.744  -2.668  -1.159
 1299    H    ALA  75           HN       ALA  75   3.002  -3.515   4.131
 1300    HA   ALA  75           HA       ALA  75   1.659  -0.957   4.138
 1301   1HB   ALA  75           HB2      ALA  75   1.333  -2.761   5.868
 1302   2HB   ALA  75           HB1      ALA  75   2.943  -2.388   6.482
 1303   3HB   ALA  75           HB3      ALA  75   1.669  -1.171   6.553
 1304    H    PHE  76           HN       PHE  76   4.965  -1.951   4.228
 1305    HA   PHE  76           HA       PHE  76   5.982   0.468   5.494
 1306   1HB   PHE  76           HB2      PHE  76   7.096  -1.995   4.321
 1307   2HB   PHE  76           HB1      PHE  76   8.095  -0.565   4.066
 1308    HD1  PHE  76           HD2      PHE  76   5.860  -1.593   6.899
 1309    HD2  PHE  76           HD1      PHE  76   9.834  -0.580   5.627
 1310    HE1  PHE  76           HE2      PHE  76   6.645  -1.721   9.246
 1311    HE2  PHE  76           HE1      PHE  76  10.619  -0.708   7.974
 1312    HZ   PHE  76           HZ       PHE  76   9.024  -1.278   9.784
 1313    H    VAL  77           HN       VAL  77   5.277  -0.591   2.209
 1314    HA   VAL  77           HA       VAL  77   6.688   1.612   0.931
 1315    HB   VAL  77           HB       VAL  77   4.494  -0.218  -0.092
 1316   1HG1  VAL  77          HG12      VAL  77   5.293   2.180  -1.183
 1317   2HG1  VAL  77          HG11      VAL  77   6.365   1.037  -1.989
 1318   3HG1  VAL  77          HG13      VAL  77   4.617   0.836  -2.101
 1319   1HG2  VAL  77          HG22      VAL  77   7.218  -0.698   0.522
 1320   2HG2  VAL  77          HG21      VAL  77   6.120  -1.757  -0.363
 1321   3HG2  VAL  77          HG23      VAL  77   7.118  -0.595  -1.236
 1322    H    SER  78           HN       SER  78   3.503   1.141   2.299
 1323    HA   SER  78           HA       SER  78   2.352   3.492   0.994
 1324   1HB   SER  78           HB2      SER  78   0.707   2.987   3.115
 1325   2HB   SER  78           HB1      SER  78   0.578   2.184   1.553
 1326    HG   SER  78           HG       SER  78   1.325   0.409   2.416
 1327    H    MET  79           HN       MET  79   3.419   2.730   4.323
 1328    HA   MET  79           HA       MET  79   2.870   5.198   5.524
 1329   1HB   MET  79           HB2      MET  79   5.345   3.534   6.039
 1330   2HB   MET  79           HB1      MET  79   4.523   4.608   7.168
 1331   1HG   MET  79           HG2      MET  79   2.608   2.747   6.134
 1332   2HG   MET  79           HG1      MET  79   4.012   1.848   6.707
 1333   1HE   MET  79           HE2      MET  79   5.165   2.305   8.997
 1334   2HE   MET  79           HE1      MET  79   4.066   2.037  10.348
 1335   3HE   MET  79           HE3      MET  79   4.029   0.959   8.945
 1336    H    VAL  80           HN       VAL  80   5.824   4.249   3.752
 1337    HA   VAL  80           HA       VAL  80   7.096   6.809   4.106
 1338    HB   VAL  80           HB       VAL  80   8.564   5.958   2.207
 1339   1HG1  VAL  80          HG13      VAL  80   8.091   4.654   4.847
 1340   2HG1  VAL  80          HG12      VAL  80   9.216   3.869   3.740
 1341   3HG1  VAL  80          HG11      VAL  80   9.509   5.526   4.267
 1342   1HG2  VAL  80          HG21      VAL  80   6.360   4.112   2.010
 1343   2HG2  VAL  80          HG23      VAL  80   7.765   4.261   0.960
 1344   3HG2  VAL  80          HG22      VAL  80   7.835   3.225   2.383
 1345    H    THR  81           HN       THR  81   5.159   5.407   1.459
 1346    HA   THR  81           HA       THR  81   5.520   7.726  -0.252
 1347    HB   THR  81           HB       THR  81   3.231   5.768  -0.452
 1348    HG1  THR  81           HG1      THR  81   5.819   5.382  -1.516
 1349   1HG2  THR  81          HG22      THR  81   3.634   7.872  -1.965
 1350   2HG2  THR  81          HG21      THR  81   4.894   6.878  -2.696
 1351   3HG2  THR  81          HG23      THR  81   3.218   6.334  -2.721
 1352    H    THR  82           HN       THR  82   3.883   7.368   2.605
 1353    HA   THR  82           HA       THR  82   1.935   9.504   1.844
 1354    HB   THR  82           HB       THR  82   0.407   8.595   3.555
 1355    HG1  THR  82           HG1      THR  82   2.217   7.616   4.740
 1356   1HG2  THR  82          HG21      THR  82   1.373   6.885   1.294
 1357   2HG2  THR  82          HG23      THR  82   0.143   6.245   2.383
 1358   3HG2  THR  82          HG22      THR  82  -0.165   7.728   1.480
 1359    H    ALA  83           HN       ALA  83   4.610   8.669   3.725
 1360    HA   ALA  83           HA       ALA  83   3.967  10.391   6.010
 1361   1HB   ALA  83           HB3      ALA  83   6.585   9.107   5.169
 1362   2HB   ALA  83           HB2      ALA  83   6.286   9.906   6.713
 1363   3HB   ALA  83           HB1      ALA  83   5.423   8.424   6.304
 1364    H    CYS  84           HN       CYS  84   5.566  10.682   2.919
 1365    HA   CYS  84           HA       CYS  84   7.171  12.966   3.372
 1366   1HB   CYS  84           HB2      CYS  84   5.561  12.359   0.876
 1367   2HB   CYS  84           HB1      CYS  84   6.995  13.379   0.978
 1368    HG   CYS  84           HG       CYS  84   8.389  11.225   1.596
 1369    H    HIS  85           HN       HIS  85   6.128  14.939   1.627
 1370    HA   HIS  85           HA       HIS  85   4.497  16.452   3.427
 1371   1HB   HIS  85           HB2      HIS  85   4.247  18.003   1.476
 1372   2HB   HIS  85           HB1      HIS  85   5.920  17.542   1.777
 1373    HD1  HIS  85           HD1      HIS  85   6.794  17.625  -0.614
 1374    HD2  HIS  85           HD2      HIS  85   3.402  15.234  -0.226
 1375    HE1  HIS  85           HE1      HIS  85   6.535  16.387  -2.808
 1376    H    GLU  86           HN       GLU  86   2.690  17.252   0.965
 1377    HA   GLU  86           HA       GLU  86   0.444  15.608   1.805
 1378   1HB   GLU  86           HB2      GLU  86   0.752  17.660  -0.404
 1379   2HB   GLU  86           HB1      GLU  86  -0.773  16.872  -0.001
 1380   1HG   GLU  86           HG2      GLU  86  -0.505  17.719   2.354
 1381   2HG   GLU  86           HG1      GLU  86   0.896  18.641   1.804
 1382    H    PHE  87           HN       PHE  87   0.808  16.223  -1.609
 1383    HA   PHE  87           HA       PHE  87   1.989  13.972  -2.646
 1384   1HB   PHE  87           HB2      PHE  87  -0.127  12.483  -2.997
 1385   2HB   PHE  87           HB1      PHE  87   0.739  12.385  -1.467
 1386    HD1  PHE  87           HD2      PHE  87  -1.157  15.434  -2.130
 1387    HD2  PHE  87           HD1      PHE  87  -1.357  11.493  -0.441
 1388    HE1  PHE  87           HE2      PHE  87  -3.226  16.058  -0.916
 1389    HE2  PHE  87           HE1      PHE  87  -3.428  12.117   0.763
 1390    HZ   PHE  87           HZ       PHE  87  -4.363  14.399   0.532
 1391    H    PHE  88           HN       PHE  88  -1.306  13.898  -3.642
 1392    HA   PHE  88           HA       PHE  88  -0.871  14.671  -6.279
 1393   1HB   PHE  88           HB2      PHE  88  -3.412  15.786  -5.392
 1394   2HB   PHE  88           HB1      PHE  88  -3.109  14.464  -6.512
 1395    HD1  PHE  88           HD2      PHE  88  -2.343  12.188  -5.391
 1396    HD2  PHE  88           HD1      PHE  88  -4.446  15.333  -3.356
 1397    HE1  PHE  88           HE2      PHE  88  -3.104  10.570  -3.666
 1398    HE2  PHE  88           HE1      PHE  88  -5.204  13.712  -1.638
 1399    HZ   PHE  88           HZ       PHE  88  -4.531  11.334  -1.796
 1400    H    GLU  89           HN       GLU  89   0.587  16.420  -6.410
 1401    HA   GLU  89           HA       GLU  89  -0.600  19.066  -5.717
 1402   1HB   GLU  89           HB2      GLU  89   1.209  18.254  -4.127
 1403   2HB   GLU  89           HB1      GLU  89   2.333  18.387  -5.474
 1404   1HG   GLU  89           HG2      GLU  89   2.542  20.484  -4.439
 1405   2HG   GLU  89           HG1      GLU  89   1.370  20.806  -5.716
 1406    H    HIS  90           HN       HIS  90   0.366  17.120  -8.171
 1407    HA   HIS  90           HA       HIS  90   2.111  18.572  -9.807
 1408   1HB   HIS  90           HB2      HIS  90   0.228  16.449 -10.148
 1409   2HB   HIS  90           HB1      HIS  90  -0.024  17.608 -11.453
 1410    HD1  HIS  90           HD1      HIS  90   1.060  15.314 -12.710
 1411    HD2  HIS  90           HD2      HIS  90   3.634  17.812 -10.586
 1412    HE1  HIS  90           HE1      HIS  90   3.398  14.808 -13.541
 1413    H    GLU  91           HN       GLU  91   1.908  20.805  -9.914
 1414    HA   GLU  91           HA       GLU  91  -0.605  21.822 -11.148
 1415   1HB   GLU  91           HB2      GLU  91   0.115  22.276  -8.463
 1416   2HB   GLU  91           HB1      GLU  91   0.506  23.769  -9.315
 1417   1HG   GLU  91           HG2      GLU  91  -1.887  23.297 -10.426
 1418   2HG   GLU  91           HG1      GLU  91  -2.144  22.466  -8.893
   
  No H/Q in entry =        1418
  Start of MODEL    8
    1   1H    MET   0           HT1      MET   0  10.694   3.842 -15.488
    2   2H    MET   0           HT3      MET   0   9.917   5.334 -15.701
    3   3H    MET   0           HT2      MET   0  10.060   4.667 -14.146
    4    HA   MET   0           HA       MET   0   7.839   4.302 -14.840
    5   1HB   MET   0           HB2      MET   0   7.449   2.991 -16.966
    6   2HB   MET   0           HB1      MET   0   8.083   4.618 -17.220
    7   1HG   MET   0           HG2      MET   0  10.174   2.586 -16.852
    8   2HG   MET   0           HG1      MET   0   9.174   2.320 -18.280
    9   1HE   MET   0           HE2      MET   0  10.291   2.719 -20.143
   10   2HE   MET   0           HE1      MET   0  11.395   4.025 -20.567
   11   3HE   MET   0           HE3      MET   0  11.885   2.789 -19.399
   12    H    SER   1           HN       SER   1   7.944   2.952 -13.003
   13    HA   SER   1           HA       SER   1   8.632   0.106 -13.600
   14   1HB   SER   1           HB2      SER   1   9.372  -0.067 -11.200
   15   2HB   SER   1           HB1      SER   1  10.399   0.966 -12.192
   16    HG   SER   1           HG       SER   1   9.066   1.586  -9.983
   17    H    GLU   2           HN       GLU   2   7.630  -1.309 -11.714
   18    HA   GLU   2           HA       GLU   2   4.769  -0.862 -11.807
   19   1HB   GLU   2           HB2      GLU   2   6.155  -2.807  -9.963
   20   2HB   GLU   2           HB1      GLU   2   4.575  -2.961 -10.727
   21   1HG   GLU   2           HG2      GLU   2   7.284  -3.113 -12.071
   22   2HG   GLU   2           HG1      GLU   2   6.081  -4.395 -11.940
   23    H    LEU   3           HN       LEU   3   7.280  -0.476  -9.336
   24    HA   LEU   3           HA       LEU   3   5.468   0.092  -7.172
   25   1HB   LEU   3           HB2      LEU   3   8.080  -0.439  -7.237
   26   2HB   LEU   3           HB1      LEU   3   8.188   1.320  -7.228
   27    HG   LEU   3           HG       LEU   3   6.488   1.197  -5.270
   28   1HD1  LEU   3          HD13      LEU   3   7.444  -1.651  -5.520
   29   2HD1  LEU   3          HD12      LEU   3   6.950  -0.997  -3.960
   30   3HD1  LEU   3          HD11      LEU   3   5.800  -1.059  -5.295
   31   1HD2  LEU   3          HD22      LEU   3   8.852   1.881  -5.037
   32   2HD2  LEU   3          HD21      LEU   3   8.341   0.910  -3.657
   33   3HD2  LEU   3          HD23      LEU   3   9.332   0.188  -4.923
   34    H    GLU   4           HN       GLU   4   7.212   2.169  -9.471
   35    HA   GLU   4           HA       GLU   4   6.300   4.631  -8.264
   36   1HB   GLU   4           HB2      GLU   4   8.284   4.703  -9.612
   37   2HB   GLU   4           HB1      GLU   4   7.446   3.991 -10.989
   38   1HG   GLU   4           HG2      GLU   4   6.010   6.327 -10.141
   39   2HG   GLU   4           HG1      GLU   4   7.709   6.749 -10.358
   40    H    LYS   5           HN       LYS   5   5.406   3.228 -11.445
   41    HA   LYS   5           HA       LYS   5   3.181   4.948 -11.837
   42   1HB   LYS   5           HB2      LYS   5   2.562   3.508 -13.637
   43   2HB   LYS   5           HB1      LYS   5   4.323   3.463 -13.562
   44   1HG   LYS   5           HG2      LYS   5   3.952   1.415 -11.979
   45   2HG   LYS   5           HG1      LYS   5   2.343   1.367 -12.702
   46   1HD   LYS   5           HD2      LYS   5   4.616   1.657 -14.591
   47   2HD   LYS   5           HD1      LYS   5   4.473   0.096 -13.781
   48   1HE   LYS   5           HE2      LYS   5   2.137  -0.094 -14.527
   49   2HE   LYS   5           HE1      LYS   5   2.250   1.481 -15.312
   50   1HZ   LYS   5           HZ1      LYS   5   4.346   0.260 -16.381
   51   2HZ   LYS   5           HZ3      LYS   5   3.343  -1.085 -16.129
   52   3HZ   LYS   5           HZ2      LYS   5   2.795   0.217 -17.073
   53    H    ALA   6           HN       ALA   6   3.371   1.780 -10.227
   54    HA   ALA   6           HA       ALA   6   0.472   1.645  -9.887
   55   1HB   ALA   6           HB1      ALA   6   2.236  -0.303  -9.968
   56   2HB   ALA   6           HB3      ALA   6   2.380   0.021  -8.242
   57   3HB   ALA   6           HB2      ALA   6   0.822  -0.442  -8.923
   58    H    MET   7           HN       MET   7   3.143   1.882  -7.492
   59    HA   MET   7           HA       MET   7   1.557   2.468  -5.255
   60   1HB   MET   7           HB2      MET   7   4.078   2.096  -5.316
   61   2HB   MET   7           HB1      MET   7   4.228   3.786  -5.800
   62   1HG   MET   7           HG2      MET   7   4.480   3.654  -3.390
   63   2HG   MET   7           HG1      MET   7   2.935   4.424  -3.747
   64   1HE   MET   7           HE1      MET   7   2.512   3.888  -1.158
   65   2HE   MET   7           HE3      MET   7   1.131   3.975  -2.259
   66   3HE   MET   7           HE2      MET   7   1.197   2.723  -1.022
   67    H    VAL   8           HN       VAL   8   3.161   4.845  -7.386
   68    HA   VAL   8           HA       VAL   8   1.899   7.138  -6.262
   69    HB   VAL   8           HB       VAL   8   2.695   6.856  -9.167
   70   1HG1  VAL   8          HG12      VAL   8   1.627   8.967  -7.752
   71   2HG1  VAL   8          HG11      VAL   8   3.358   9.276  -7.631
   72   3HG1  VAL   8          HG13      VAL   8   2.598   9.126  -9.214
   73   1HG2  VAL   8          HG21      VAL   8   4.329   6.242  -6.996
   74   2HG2  VAL   8          HG23      VAL   8   4.884   6.701  -8.604
   75   3HG2  VAL   8          HG22      VAL   8   4.721   7.924  -7.347
   76    H    ALA   9           HN       ALA   9   0.784   4.741  -8.540
   77    HA   ALA   9           HA       ALA   9  -1.405   6.204  -9.676
   78   1HB   ALA   9           HB2      ALA   9  -0.498   3.420  -9.569
   79   2HB   ALA   9           HB1      ALA   9  -2.254   3.561  -9.558
   80   3HB   ALA   9           HB3      ALA   9  -1.320   4.279 -10.870
   81    H    LEU  10           HN       LEU  10  -1.175   4.098  -6.808
   82    HA   LEU  10           HA       LEU  10  -3.904   4.154  -6.065
   83   1HB   LEU  10           HB2      LEU  10  -1.377   3.451  -4.820
   84   2HB   LEU  10           HB1      LEU  10  -2.447   4.247  -3.666
   85    HG   LEU  10           HG       LEU  10  -3.908   2.352  -5.315
   86   1HD1  LEU  10          HD13      LEU  10  -1.381   1.462  -4.974
   87   2HD1  LEU  10          HD12      LEU  10  -2.087   0.927  -3.450
   88   3HD1  LEU  10          HD11      LEU  10  -2.779   0.387  -4.980
   89   1HD2  LEU  10          HD21      LEU  10  -3.688   3.274  -2.560
   90   2HD2  LEU  10          HD23      LEU  10  -5.079   2.591  -3.399
   91   3HD2  LEU  10          HD22      LEU  10  -3.896   1.525  -2.644
   92    H    ILE  11           HN       ILE  11  -1.324   6.516  -5.563
   93    HA   ILE  11           HA       ILE  11  -2.770   8.207  -3.750
   94    HB   ILE  11           HB       ILE  11  -0.486   8.691  -5.671
   95   1HG1  ILE  11          HG12      ILE  11   0.799   8.892  -3.604
   96   2HG1  ILE  11          HG11      ILE  11  -0.674   8.766  -2.644
   97   1HG2  ILE  11          HG23      ILE  11  -2.077  10.644  -4.046
   98   2HG2  ILE  11          HG22      ILE  11  -0.344  10.899  -4.234
   99   3HG2  ILE  11          HG21      ILE  11  -1.386  10.840  -5.655
  100   1HD1  ILE  11          HD12      ILE  11   0.262   6.611  -4.551
  101   2HD1  ILE  11          HD11      ILE  11   0.629   6.610  -2.828
  102   3HD1  ILE  11          HD13      ILE  11  -1.044   6.495  -3.372
  103    H    ASP  12           HN       ASP  12  -2.709   7.910  -7.260
  104    HA   ASP  12           HA       ASP  12  -4.137  10.343  -7.830
  105   1HB   ASP  12           HB2      ASP  12  -2.815   8.806  -9.442
  106   2HB   ASP  12           HB1      ASP  12  -4.291   7.847  -9.518
  107    H    VAL  13           HN       VAL  13  -5.257   6.942  -7.715
  108    HA   VAL  13           HA       VAL  13  -8.007   7.439  -8.052
  109    HB   VAL  13           HB       VAL  13  -6.348   5.242  -7.332
  110   1HG1  VAL  13          HG12      VAL  13  -8.669   5.643  -5.441
  111   2HG1  VAL  13          HG11      VAL  13  -7.952   4.064  -5.759
  112   3HG1  VAL  13          HG13      VAL  13  -6.982   5.344  -5.031
  113   1HG2  VAL  13          HG23      VAL  13  -8.099   5.445  -9.137
  114   2HG2  VAL  13          HG22      VAL  13  -8.179   3.944  -8.213
  115   3HG2  VAL  13          HG21      VAL  13  -9.323   5.244  -7.883
  116    H    PHE  14           HN       PHE  14  -6.240   7.098  -4.976
  117    HA   PHE  14           HA       PHE  14  -8.238   7.630  -3.147
  118   1HB   PHE  14           HB2      PHE  14  -5.921   7.218  -2.469
  119   2HB   PHE  14           HB1      PHE  14  -5.435   8.786  -3.116
  120    HD1  PHE  14           HD1      PHE  14  -7.691   7.174  -0.615
  121    HD2  PHE  14           HD2      PHE  14  -5.631  10.748  -1.816
  122    HE1  PHE  14           HE1      PHE  14  -8.317   8.255   1.526
  123    HE2  PHE  14           HE2      PHE  14  -6.257  11.829   0.326
  124    HZ   PHE  14           HZ       PHE  14  -7.599  10.582   1.996
  125    H    HIS  15           HN       HIS  15  -6.670   9.977  -5.281
  126    HA   HIS  15           HA       HIS  15  -8.004  12.250  -4.008
  127   1HB   HIS  15           HB2      HIS  15  -5.766  12.035  -5.546
  128   2HB   HIS  15           HB1      HIS  15  -6.939  12.575  -6.748
  129    HD1  HIS  15           HD1      HIS  15  -7.460  15.020  -6.768
  130    HD2  HIS  15           HD2      HIS  15  -5.727  13.841  -3.166
  131    HE1  HIS  15           HE1      HIS  15  -7.096  17.135  -5.424
  132    H    GLN  16           HN       GLN  16  -8.506  10.244  -6.884
  133    HA   GLN  16           HA       GLN  16 -10.536  11.825  -8.099
  134   1HB   GLN  16           HB2      GLN  16  -9.282   9.556  -8.818
  135   2HB   GLN  16           HB1      GLN  16 -10.794   8.861  -8.232
  136   1HG   GLN  16           HG2      GLN  16 -11.777   9.444 -10.168
  137   2HG   GLN  16           HG1      GLN  16 -11.489  11.139  -9.773
  138   1HE2  GLN  16          HE22      GLN  16  -9.294   9.375 -12.668
  139   2HE2  GLN  16          HE21      GLN  16 -10.568   8.567 -11.892
  140    H    TYR  17           HN       TYR  17 -10.845   9.082  -5.814
  141    HA   TYR  17           HA       TYR  17 -13.693   9.214  -5.623
  142   1HB   TYR  17           HB2      TYR  17 -11.546   8.125  -3.805
  143   2HB   TYR  17           HB1      TYR  17 -13.250   8.061  -3.356
  144    HD1  TYR  17           HD2      TYR  17 -10.706   6.872  -5.751
  145    HD2  TYR  17           HD1      TYR  17 -14.822   6.641  -4.546
  146    HE1  TYR  17           HE2      TYR  17 -11.016   4.872  -7.184
  147    HE2  TYR  17           HE1      TYR  17 -15.130   4.641  -5.981
  148    HH   TYR  17           HH       TYR  17 -13.928   3.724  -8.133
  149    H    SER  18           HN       SER  18 -11.125  10.797  -3.735
  150    HA   SER  18           HA       SER  18 -13.193  12.237  -2.173
  151   1HB   SER  18           HB2      SER  18 -11.424  11.476  -0.785
  152   2HB   SER  18           HB1      SER  18 -10.193  11.978  -1.939
  153    HG   SER  18           HG       SER  18 -10.273  13.520  -0.351
  154    H    GLY  19           HN       GLY  19 -12.104  12.628  -5.135
  155   1HA   GLY  19           HA2      GLY  19 -11.362  15.482  -4.955
  156   2HA   GLY  19           HA1      GLY  19 -11.318  14.500  -6.417
  157    H    ARG  20           HN       ARG  20 -13.880  13.439  -6.448
  158    HA   ARG  20           HA       ARG  20 -15.414  15.439  -7.670
  159   1HB   ARG  20           HB2      ARG  20 -17.342  13.938  -7.386
  160   2HB   ARG  20           HB1      ARG  20 -15.909  13.016  -7.843
  161   1HG   ARG  20           HG2      ARG  20 -15.509  12.515  -5.433
  162   2HG   ARG  20           HG1      ARG  20 -17.015  13.341  -5.042
  163   1HD   ARG  20           HD2      ARG  20 -16.749  10.921  -6.847
  164   2HD   ARG  20           HD1      ARG  20 -17.377  10.910  -5.200
  165    HE   ARG  20           HE       ARG  20 -18.921  12.787  -6.616
  166   1HH1  ARG  20          HH11      ARG  20 -18.269   9.409  -6.426
  167   2HH1  ARG  20          HH12      ARG  20 -19.724   8.944  -7.241
  168   1HH2  ARG  20          HH21      ARG  20 -20.766  12.203  -7.806
  169   2HH2  ARG  20          HH22      ARG  20 -21.137  10.524  -8.021
  170    H    GLU  21           HN       GLU  21 -15.471  14.381  -4.279
  171    HA   GLU  21           HA       GLU  21 -16.722  16.987  -3.588
  172   1HB   GLU  21           HB2      GLU  21 -17.954  14.354  -3.372
  173   2HB   GLU  21           HB1      GLU  21 -17.869  15.168  -1.811
  174   1HG   GLU  21           HG2      GLU  21 -19.408  16.720  -2.411
  175   2HG   GLU  21           HG1      GLU  21 -18.682  16.943  -4.003
  176    H    GLY  22           HN       GLY  22 -16.978  16.482  -0.832
  177   1HA   GLY  22           HA2      GLY  22 -15.723  16.301   1.150
  178   2HA   GLY  22           HA1      GLY  22 -14.550  15.334   0.255
  179    H    ASP  23           HN       ASP  23 -12.724  16.447   1.065
  180    HA   ASP  23           HA       ASP  23 -12.499  19.287   0.148
  181   1HB   ASP  23           HB2      ASP  23 -11.935  18.040   2.727
  182   2HB   ASP  23           HB1      ASP  23 -10.535  18.901   2.086
  183    H    LYS  24           HN       LYS  24 -11.775  16.514  -1.032
  184    HA   LYS  24           HA       LYS  24 -10.065  15.688  -2.401
  185   1HB   LYS  24           HB2      LYS  24  -9.581  18.617  -2.270
  186   2HB   LYS  24           HB1      LYS  24  -8.225  17.628  -2.813
  187   1HG   LYS  24           HG2      LYS  24  -9.454  18.173  -4.786
  188   2HG   LYS  24           HG1      LYS  24  -9.868  16.499  -4.412
  189   1HD   LYS  24           HD2      LYS  24 -11.934  17.622  -4.903
  190   2HD   LYS  24           HD1      LYS  24 -11.885  17.395  -3.154
  191   1HE   LYS  24           HE2      LYS  24 -11.767  19.627  -2.751
  192   2HE   LYS  24           HE1      LYS  24 -10.627  19.895  -4.069
  193   1HZ   LYS  24           HZ2      LYS  24 -13.486  19.312  -4.557
  194   2HZ   LYS  24           HZ1      LYS  24 -12.918  20.897  -4.321
  195   3HZ   LYS  24           HZ3      LYS  24 -12.348  19.980  -5.628
  196    H    HIS  25           HN       HIS  25  -9.781  16.127   0.729
  197    HA   HIS  25           HA       HIS  25  -7.009  15.060   0.782
  198   1HB   HIS  25           HB2      HIS  25  -6.796  17.458   1.279
  199   2HB   HIS  25           HB1      HIS  25  -8.013  17.313   2.547
  200    HD1  HIS  25           HD1      HIS  25  -7.307  16.221   4.770
  201    HD2  HIS  25           HD2      HIS  25  -4.263  16.262   1.923
  202    HE1  HIS  25           HE1      HIS  25  -5.184  15.555   5.979
  203    H    LYS  26           HN       LYS  26 -10.083  14.420   1.418
  204    HA   LYS  26           HA       LYS  26  -9.387  12.647   3.682
  205   1HB   LYS  26           HB2      LYS  26 -11.284  13.359   5.031
  206   2HB   LYS  26           HB1      LYS  26 -10.266  14.761   4.690
  207   1HG   LYS  26           HG2      LYS  26 -11.748  15.449   2.880
  208   2HG   LYS  26           HG1      LYS  26 -12.731  14.001   3.101
  209   1HD   LYS  26           HD2      LYS  26 -12.716  15.019   5.636
  210   2HD   LYS  26           HD1      LYS  26 -12.682  16.497   4.674
  211   1HE   LYS  26           HE2      LYS  26 -14.976  16.082   4.826
  212   2HE   LYS  26           HE1      LYS  26 -14.571  15.315   3.292
  213   1HZ   LYS  26           HZ3      LYS  26 -14.095  13.456   5.306
  214   2HZ   LYS  26           HZ2      LYS  26 -15.620  14.134   5.617
  215   3HZ   LYS  26           HZ1      LYS  26 -15.300  13.409   4.115
  216    H    LEU  27           HN       LEU  27 -10.688  10.782   3.742
  217    HA   LEU  27           HA       LEU  27 -12.635  10.523   1.483
  218   1HB   LEU  27           HB2      LEU  27 -10.371   8.877   2.329
  219   2HB   LEU  27           HB1      LEU  27 -11.863   7.945   2.206
  220    HG   LEU  27           HG       LEU  27 -10.668   9.712   0.049
  221   1HD1  LEU  27          HD11      LEU  27  -9.763   7.307   0.640
  222   2HD1  LEU  27          HD13      LEU  27 -11.226   6.772  -0.185
  223   3HD1  LEU  27          HD12      LEU  27 -10.037   7.754  -1.043
  224   1HD2  LEU  27          HD23      LEU  27 -13.316   8.328   0.356
  225   2HD2  LEU  27          HD22      LEU  27 -12.960   9.914  -0.332
  226   3HD2  LEU  27          HD21      LEU  27 -12.595   8.451  -1.247
  227    H    LYS  28           HN       LYS  28 -13.710   8.039   2.312
  228    HA   LYS  28           HA       LYS  28 -14.782   8.590   5.032
  229   1HB   LYS  28           HB2      LYS  28 -16.198   9.072   2.659
  230   2HB   LYS  28           HB1      LYS  28 -16.825   7.534   3.258
  231   1HG   LYS  28           HG2      LYS  28 -17.657   8.470   5.194
  232   2HG   LYS  28           HG1      LYS  28 -16.430   9.738   5.229
  233   1HD   LYS  28           HD2      LYS  28 -17.643  11.139   3.891
  234   2HD   LYS  28           HD1      LYS  28 -18.290   9.815   2.923
  235   1HE   LYS  28           HE2      LYS  28 -19.875   9.238   4.673
  236   2HE   LYS  28           HE1      LYS  28 -19.166  10.435   5.756
  237   1HZ   LYS  28           HZ3      LYS  28 -19.716  11.934   3.619
  238   2HZ   LYS  28           HZ2      LYS  28 -20.976  10.799   3.522
  239   3HZ   LYS  28           HZ1      LYS  28 -20.778  11.734   4.926
  240    H    LYS  29           HN       LYS  29 -15.154   6.710   6.218
  241    HA   LYS  29           HA       LYS  29 -13.861   4.309   5.464
  242   1HB   LYS  29           HB2      LYS  29 -14.969   3.287   7.376
  243   2HB   LYS  29           HB1      LYS  29 -14.486   4.928   7.805
  244   1HG   LYS  29           HG2      LYS  29 -16.847   5.630   7.058
  245   2HG   LYS  29           HG1      LYS  29 -17.243   3.911   7.119
  246   1HD   LYS  29           HD2      LYS  29 -16.245   5.637   9.397
  247   2HD   LYS  29           HD1      LYS  29 -17.819   4.855   9.262
  248   1HE   LYS  29           HE2      LYS  29 -16.877   3.170  10.453
  249   2HE   LYS  29           HE1      LYS  29 -16.096   2.735   8.934
  250   1HZ   LYS  29           HZ1      LYS  29 -14.953   4.640  10.899
  251   2HZ   LYS  29           HZ3      LYS  29 -14.546   2.995  10.828
  252   3HZ   LYS  29           HZ2      LYS  29 -14.192   4.015   9.516
  253    H    SER  30           HN       SER  30 -17.034   5.495   4.664
  254    HA   SER  30           HA       SER  30 -18.082   2.864   3.910
  255   1HB   SER  30           HB2      SER  30 -19.759   4.553   2.670
  256   2HB   SER  30           HB1      SER  30 -19.866   4.237   4.399
  257    HG   SER  30           HG       SER  30 -19.487   6.281   4.632
  258    H    GLU  31           HN       GLU  31 -16.620   5.643   2.243
  259    HA   GLU  31           HA       GLU  31 -17.006   4.474  -0.397
  260   1HB   GLU  31           HB2      GLU  31 -16.682   6.971   0.151
  261   2HB   GLU  31           HB1      GLU  31 -14.969   6.592   0.325
  262   1HG   GLU  31           HG2      GLU  31 -14.677   6.463  -1.910
  263   2HG   GLU  31           HG1      GLU  31 -16.102   5.442  -2.105
  264    H    LEU  32           HN       LEU  32 -14.729   4.126   2.168
  265    HA   LEU  32           HA       LEU  32 -12.576   3.084   0.478
  266   1HB   LEU  32           HB2      LEU  32 -11.923   4.121   2.564
  267   2HB   LEU  32           HB1      LEU  32 -13.024   3.089   3.478
  268    HG   LEU  32           HG       LEU  32 -11.726   1.109   2.879
  269   1HD1  LEU  32          HD12      LEU  32 -10.155   3.102   1.231
  270   2HD1  LEU  32          HD11      LEU  32  -9.506   1.523   1.675
  271   3HD1  LEU  32          HD13      LEU  32 -10.957   1.632   0.679
  272   1HD2  LEU  32          HD21      LEU  32 -10.232   3.471   4.014
  273   2HD2  LEU  32          HD23      LEU  32 -10.903   2.081   4.866
  274   3HD2  LEU  32          HD22      LEU  32  -9.455   1.894   3.877
  275    H    LYS  33           HN       LYS  33 -15.101   1.812   2.615
  276    HA   LYS  33           HA       LYS  33 -14.453  -0.949   2.454
  277   1HB   LYS  33           HB2      LYS  33 -16.311   0.373   3.801
  278   2HB   LYS  33           HB1      LYS  33 -17.315  -0.042   2.417
  279   1HG   LYS  33           HG2      LYS  33 -16.703  -2.435   2.719
  280   2HG   LYS  33           HG1      LYS  33 -15.771  -1.996   4.147
  281   1HD   LYS  33           HD2      LYS  33 -17.735  -1.248   5.306
  282   2HD   LYS  33           HD1      LYS  33 -18.712  -1.361   3.841
  283   1HE   LYS  33           HE2      LYS  33 -17.645  -3.906   4.072
  284   2HE   LYS  33           HE1      LYS  33 -17.968  -3.458   5.746
  285   1HZ   LYS  33           HZ1      LYS  33 -20.218  -2.715   4.908
  286   2HZ   LYS  33           HZ3      LYS  33 -19.866  -3.560   3.481
  287   3HZ   LYS  33           HZ2      LYS  33 -19.946  -4.391   4.961
  288    H    GLU  34           HN       GLU  34 -16.283   1.172   0.320
  289    HA   GLU  34           HA       GLU  34 -16.978  -0.989  -1.526
  290   1HB   GLU  34           HB2      GLU  34 -18.325   0.582  -2.549
  291   2HB   GLU  34           HB1      GLU  34 -18.133   1.378  -0.992
  292   1HG   GLU  34           HG2      GLU  34 -17.552   3.139  -2.334
  293   2HG   GLU  34           HG1      GLU  34 -15.969   2.384  -2.211
  294    H    LEU  35           HN       LEU  35 -14.534   1.468  -1.183
  295    HA   LEU  35           HA       LEU  35 -13.405   1.481  -3.776
  296   1HB   LEU  35           HB2      LEU  35 -12.790   2.626  -1.327
  297   2HB   LEU  35           HB1      LEU  35 -11.418   1.556  -1.621
  298    HG   LEU  35           HG       LEU  35 -10.855   3.637  -2.652
  299   1HD1  LEU  35          HD12      LEU  35 -11.059   1.287  -4.086
  300   2HD1  LEU  35          HD11      LEU  35 -11.868   2.448  -5.136
  301   3HD1  LEU  35          HD13      LEU  35 -10.205   2.732  -4.625
  302   1HD2  LEU  35          HD21      LEU  35 -13.685   3.515  -3.705
  303   2HD2  LEU  35          HD23      LEU  35 -12.939   4.779  -2.729
  304   3HD2  LEU  35          HD22      LEU  35 -12.473   4.580  -4.417
  305    H    ILE  36           HN       ILE  36 -12.752  -0.696  -1.026
  306    HA   ILE  36           HA       ILE  36 -10.784  -2.216  -2.554
  307    HB   ILE  36           HB       ILE  36 -12.058  -3.374  -0.120
  308   1HG1  ILE  36          HG12      ILE  36 -10.576  -0.750  -0.220
  309   2HG1  ILE  36          HG11      ILE  36 -12.006  -1.178   0.711
  310   1HG2  ILE  36          HG22      ILE  36  -9.997  -4.192  -1.512
  311   2HG2  ILE  36          HG21      ILE  36  -9.130  -2.927  -0.640
  312   3HG2  ILE  36          HG23      ILE  36  -9.914  -4.233   0.249
  313   1HD1  ILE  36          HD12      ILE  36 -10.579  -2.759   2.056
  314   2HD1  ILE  36          HD11      ILE  36  -9.170  -2.115   1.214
  315   3HD1  ILE  36          HD13      ILE  36 -10.137  -1.061   2.243
  316    H    ASN  37           HN       ASN  37 -14.069  -2.905  -1.313
  317    HA   ASN  37           HA       ASN  37 -14.246  -5.457  -2.631
  318   1HB   ASN  37           HB2      ASN  37 -15.667  -4.986  -0.727
  319   2HB   ASN  37           HB1      ASN  37 -16.388  -3.608  -1.557
  320   1HD2  ASN  37          HD22      ASN  37 -18.746  -5.583  -3.267
  321   2HD2  ASN  37          HD21      ASN  37 -18.206  -4.028  -2.852
  322    H    ASN  38           HN       ASN  38 -14.182  -2.400  -3.977
  323    HA   ASN  38           HA       ASN  38 -15.995  -3.209  -6.206
  324   1HB   ASN  38           HB2      ASN  38 -16.357  -0.976  -5.055
  325   2HB   ASN  38           HB1      ASN  38 -14.808  -0.465  -5.726
  326   1HD2  ASN  38          HD22      ASN  38 -16.654   0.633  -8.544
  327   2HD2  ASN  38          HD21      ASN  38 -15.693   1.090  -7.221
  328    H    GLU  39           HN       GLU  39 -12.999  -1.255  -5.961
  329    HA   GLU  39           HA       GLU  39 -12.123  -1.810  -8.601
  330   1HB   GLU  39           HB2      GLU  39 -10.432  -1.211  -6.154
  331   2HB   GLU  39           HB1      GLU  39  -9.911  -1.047  -7.831
  332   1HG   GLU  39           HG2      GLU  39 -12.396   0.368  -6.921
  333   2HG   GLU  39           HG1      GLU  39 -10.817   1.061  -6.545
  334    H    LEU  40           HN       LEU  40 -10.675  -3.189  -5.621
  335    HA   LEU  40           HA       LEU  40  -9.373  -5.308  -7.044
  336   1HB   LEU  40           HB2      LEU  40 -10.090  -5.054  -4.107
  337   2HB   LEU  40           HB1      LEU  40  -8.976  -6.240  -4.778
  338    HG   LEU  40           HG       LEU  40  -8.672  -3.231  -4.761
  339   1HD1  LEU  40          HD13      LEU  40  -6.972  -5.501  -3.684
  340   2HD1  LEU  40          HD12      LEU  40  -6.556  -3.789  -3.598
  341   3HD1  LEU  40          HD11      LEU  40  -7.959  -4.402  -2.722
  342   1HD2  LEU  40          HD21      LEU  40  -7.415  -5.337  -6.473
  343   2HD2  LEU  40          HD23      LEU  40  -7.816  -3.666  -6.866
  344   3HD2  LEU  40          HD22      LEU  40  -6.391  -4.024  -5.892
  345    H    SER  41           HN       SER  41 -11.432  -6.280  -4.381
  346    HA   SER  41           HA       SER  41 -12.944  -8.088  -4.291
  347   1HB   SER  41           HB2      SER  41 -14.434  -6.291  -4.991
  348   2HB   SER  41           HB1      SER  41 -13.972  -6.521  -6.673
  349    HG   SER  41           HG       SER  41 -14.915  -8.727  -5.242
  350    H    HIS  42           HN       HIS  42 -10.541  -8.757  -5.685
  351    HA   HIS  42           HA       HIS  42 -11.652 -10.788  -7.564
  352   1HB   HIS  42           HB2      HIS  42 -10.038  -8.574  -8.322
  353   2HB   HIS  42           HB1      HIS  42  -9.019 -10.010  -8.418
  354    HD1  HIS  42           HD1      HIS  42  -9.323 -11.445 -10.444
  355    HD2  HIS  42           HD2      HIS  42 -12.602  -8.955  -9.813
  356    HE1  HIS  42           HE1      HIS  42 -10.862 -11.771 -12.428
  357    H    PHE  43           HN       PHE  43 -10.413 -10.529  -4.707
  358    HA   PHE  43           HA       PHE  43  -8.668 -12.923  -5.019
  359   1HB   PHE  43           HB2      PHE  43  -8.022 -10.401  -3.470
  360   2HB   PHE  43           HB1      PHE  43  -7.186 -11.931  -3.208
  361    HD1  PHE  43           HD1      PHE  43  -6.584 -13.120  -5.629
  362    HD2  PHE  43           HD2      PHE  43  -6.879  -8.908  -4.838
  363    HE1  PHE  43           HE1      PHE  43  -5.112 -12.651  -7.569
  364    HE2  PHE  43           HE2      PHE  43  -5.407  -8.439  -6.777
  365    HZ   PHE  43           HZ       PHE  43  -4.524 -10.310  -8.142
  366    H    LEU  44           HN       LEU  44 -11.413 -12.799  -4.213
  367    HA   LEU  44           HA       LEU  44 -11.263 -13.199  -1.264
  368   1HB   LEU  44           HB2      LEU  44 -13.432 -12.473  -3.180
  369   2HB   LEU  44           HB1      LEU  44 -13.887 -13.418  -1.762
  370    HG   LEU  44           HG       LEU  44 -12.095 -11.371  -0.901
  371   1HD1  LEU  44          HD12      LEU  44 -12.942 -10.346  -3.124
  372   2HD1  LEU  44          HD11      LEU  44 -14.494 -10.197  -2.302
  373   3HD1  LEU  44          HD13      LEU  44 -13.076  -9.363  -1.667
  374   1HD2  LEU  44          HD22      LEU  44 -14.821 -12.366  -0.399
  375   2HD2  LEU  44          HD21      LEU  44 -13.587 -11.844   0.747
  376   3HD2  LEU  44          HD23      LEU  44 -14.614 -10.650  -0.046
  377    H    GLU  45           HN       GLU  45 -10.010 -15.260  -2.269
  378    HA   GLU  45           HA       GLU  45 -11.883 -17.396  -3.046
  379   1HB   GLU  45           HB2      GLU  45  -8.972 -17.811  -2.398
  380   2HB   GLU  45           HB1      GLU  45  -9.986 -18.697  -3.535
  381   1HG   GLU  45           HG2      GLU  45 -10.111 -16.713  -4.987
  382   2HG   GLU  45           HG1      GLU  45  -9.116 -15.807  -3.847
  383    H    GLU  46           HN       GLU  46  -9.276 -17.426  -0.614
  384    HA   GLU  46           HA       GLU  46 -11.240 -18.601   1.300
  385   1HB   GLU  46           HB2      GLU  46 -10.042 -20.516   1.155
  386   2HB   GLU  46           HB1      GLU  46  -8.777 -19.730   0.220
  387   1HG   GLU  46           HG2      GLU  46  -7.778 -20.540   2.257
  388   2HG   GLU  46           HG1      GLU  46  -7.883 -18.784   2.385
  389    H    ILE  47           HN       ILE  47  -8.371 -16.616   0.794
  390    HA   ILE  47           HA       ILE  47  -7.462 -14.906   2.114
  391    HB   ILE  47           HB       ILE  47 -10.014 -15.247   3.718
  392   1HG1  ILE  47          HG12      ILE  47  -9.298 -13.539   1.322
  393   2HG1  ILE  47          HG11      ILE  47 -10.601 -14.721   1.448
  394   1HG2  ILE  47          HG21      ILE  47  -8.130 -14.020   4.841
  395   2HG2  ILE  47          HG23      ILE  47  -8.132 -12.879   3.496
  396   3HG2  ILE  47          HG22      ILE  47  -9.545 -13.012   4.541
  397   1HD1  ILE  47          HD11      ILE  47 -10.417 -12.200   3.118
  398   2HD1  ILE  47          HD13      ILE  47 -11.399 -12.359   1.664
  399   3HD1  ILE  47          HD12      ILE  47 -11.760 -13.343   3.081
  400    H    LYS  48           HN       LYS  48  -5.793 -15.244   3.490
  401    HA   LYS  48           HA       LYS  48  -6.012 -17.479   5.441
  402   1HB   LYS  48           HB2      LYS  48  -4.002 -16.783   3.676
  403   2HB   LYS  48           HB1      LYS  48  -3.417 -16.123   5.203
  404   1HG   LYS  48           HG2      LYS  48  -4.539 -18.734   5.666
  405   2HG   LYS  48           HG1      LYS  48  -3.356 -18.828   4.363
  406   1HD   LYS  48           HD2      LYS  48  -1.743 -17.569   5.819
  407   2HD   LYS  48           HD1      LYS  48  -2.914 -17.684   7.133
  408   1HE   LYS  48           HE2      LYS  48  -2.360 -20.250   5.798
  409   2HE   LYS  48           HE1      LYS  48  -0.965 -19.550   6.617
  410   1HZ   LYS  48           HZ3      LYS  48  -2.727 -19.162   8.491
  411   2HZ   LYS  48           HZ2      LYS  48  -3.516 -20.459   7.731
  412   3HZ   LYS  48           HZ1      LYS  48  -1.941 -20.655   8.334
  413    H    GLU  49           HN       GLU  49  -5.623 -14.006   5.222
  414    HA   GLU  49           HA       GLU  49  -5.164 -13.839   8.154
  415   1HB   GLU  49           HB2      GLU  49  -4.719 -12.027   5.833
  416   2HB   GLU  49           HB1      GLU  49  -5.160 -11.265   7.359
  417   1HG   GLU  49           HG2      GLU  49  -2.963 -13.330   7.170
  418   2HG   GLU  49           HG1      GLU  49  -2.657 -11.604   6.962
  419    H    GLN  50           HN       GLN  50  -7.516 -14.721   8.236
  420    HA   GLN  50           HA       GLN  50  -9.739 -13.163   7.444
  421   1HB   GLN  50           HB2      GLN  50  -9.968 -15.454   8.312
  422   2HB   GLN  50           HB1      GLN  50  -9.436 -14.914   9.903
  423   1HG   GLN  50           HG2      GLN  50 -11.381 -13.314   9.929
  424   2HG   GLN  50           HG1      GLN  50 -11.953 -14.073   8.443
  425   1HE2  GLN  50          HE22      GLN  50 -12.303 -17.307  10.312
  426   2HE2  GLN  50          HE21      GLN  50 -11.360 -16.794   8.999
  427    H    GLU  51           HN       GLU  51  -7.437 -12.674  10.003
  428    HA   GLU  51           HA       GLU  51  -9.125 -10.813  11.497
  429   1HB   GLU  51           HB2      GLU  51  -6.645 -12.159  11.917
  430   2HB   GLU  51           HB1      GLU  51  -6.354 -10.427  12.082
  431   1HG   GLU  51           HG2      GLU  51  -8.289 -10.280  13.642
  432   2HG   GLU  51           HG1      GLU  51  -8.486 -12.030  13.526
  433    H    VAL  52           HN       VAL  52  -6.661 -10.594   8.982
  434    HA   VAL  52           HA       VAL  52  -6.293  -7.736   9.201
  435    HB   VAL  52           HB       VAL  52  -5.816  -9.588   6.846
  436   1HG1  VAL  52          HG11      VAL  52  -5.949  -7.179   6.244
  437   2HG1  VAL  52          HG13      VAL  52  -4.710  -6.828   7.447
  438   3HG1  VAL  52          HG12      VAL  52  -4.319  -7.821   6.045
  439   1HG2  VAL  52          HG23      VAL  52  -4.622  -9.843   9.217
  440   2HG2  VAL  52          HG22      VAL  52  -3.717 -10.022   7.715
  441   3HG2  VAL  52          HG21      VAL  52  -3.655  -8.501   8.604
  442    H    VAL  53           HN       VAL  53  -8.243  -9.778   7.006
  443    HA   VAL  53           HA       VAL  53  -9.468  -7.449   5.753
  444    HB   VAL  53           HB       VAL  53 -10.148 -10.404   5.685
  445   1HG1  VAL  53          HG11      VAL  53 -11.407  -8.028   4.299
  446   2HG1  VAL  53          HG13      VAL  53 -11.550  -9.670   3.672
  447   3HG1  VAL  53          HG12      VAL  53 -12.206  -9.273   5.260
  448   1HG2  VAL  53          HG21      VAL  53  -8.232  -8.741   4.336
  449   2HG2  VAL  53          HG23      VAL  53  -8.525 -10.468   4.126
  450   3HG2  VAL  53          HG22      VAL  53  -9.425  -9.297   3.163
  451    H    ASP  54           HN       ASP  54 -10.237  -9.604   8.416
  452    HA   ASP  54           HA       ASP  54 -12.958  -8.580   8.707
  453   1HB   ASP  54           HB2      ASP  54 -12.352 -10.873   9.452
  454   2HB   ASP  54           HB1      ASP  54 -11.256 -10.177  10.646
  455    H    LYS  55           HN       LYS  55  -9.794  -7.606   9.618
  456    HA   LYS  55           HA       LYS  55 -10.629  -6.037  11.941
  457   1HB   LYS  55           HB2      LYS  55  -8.353  -6.831  11.929
  458   2HB   LYS  55           HB1      LYS  55  -8.064  -6.139  10.332
  459   1HG   LYS  55           HG2      LYS  55  -9.027  -4.054  12.028
  460   2HG   LYS  55           HG1      LYS  55  -7.727  -4.890  12.878
  461   1HD   LYS  55           HD2      LYS  55  -6.423  -4.727  10.658
  462   2HD   LYS  55           HD1      LYS  55  -7.633  -3.536  10.183
  463   1HE   LYS  55           HE2      LYS  55  -5.908  -2.240  11.153
  464   2HE   LYS  55           HE1      LYS  55  -7.109  -2.386  12.436
  465   1HZ   LYS  55           HZ2      LYS  55  -5.811  -4.395  13.180
  466   2HZ   LYS  55           HZ1      LYS  55  -4.577  -3.885  12.129
  467   3HZ   LYS  55           HZ3      LYS  55  -5.055  -2.891  13.416
  468    H    VAL  56           HN       VAL  56  -9.590  -5.296   8.591
  469    HA   VAL  56           HA       VAL  56 -10.251  -2.476   8.878
  470    HB   VAL  56           HB       VAL  56 -10.090  -2.611   6.290
  471   1HG1  VAL  56          HG11      VAL  56  -7.886  -3.155   8.256
  472   2HG1  VAL  56          HG13      VAL  56  -7.524  -3.063   6.534
  473   3HG1  VAL  56          HG12      VAL  56  -8.230  -1.675   7.361
  474   1HG2  VAL  56          HG21      VAL  56 -10.201  -5.337   6.835
  475   2HG2  VAL  56          HG23      VAL  56  -9.713  -4.609   5.307
  476   3HG2  VAL  56          HG22      VAL  56  -8.495  -5.046   6.503
  477    H    MET  57           HN       MET  57 -11.845  -5.358   7.674
  478    HA   MET  57           HA       MET  57 -14.141  -3.989   6.552
  479   1HB   MET  57           HB2      MET  57 -13.369  -6.354   5.997
  480   2HB   MET  57           HB1      MET  57 -13.999  -6.839   7.573
  481   1HG   MET  57           HG2      MET  57 -16.073  -6.964   6.724
  482   2HG   MET  57           HG1      MET  57 -15.991  -5.270   6.242
  483   1HE   MET  57           HE1      MET  57 -13.895  -4.891   4.762
  484   2HE   MET  57           HE3      MET  57 -13.244  -6.071   3.617
  485   3HE   MET  57           HE2      MET  57 -14.500  -4.946   3.109
  486    H    GLU  58           HN       GLU  58 -13.141  -4.974   9.720
  487    HA   GLU  58           HA       GLU  58 -15.801  -4.980  10.897
  488   1HB   GLU  58           HB2      GLU  58 -13.014  -5.266  11.848
  489   2HB   GLU  58           HB1      GLU  58 -14.115  -4.518  13.003
  490   1HG   GLU  58           HG2      GLU  58 -15.595  -6.395  12.953
  491   2HG   GLU  58           HG1      GLU  58 -14.783  -7.085  11.549
  492    H    THR  59           HN       THR  59 -13.038  -2.673  11.115
  493    HA   THR  59           HA       THR  59 -14.545  -0.640  12.453
  494    HB   THR  59           HB       THR  59 -12.359  -0.002  10.476
  495    HG1  THR  59           HG1      THR  59 -10.969  -1.066  11.618
  496   1HG2  THR  59          HG22      THR  59 -13.765   1.375  12.539
  497   2HG2  THR  59          HG21      THR  59 -12.088   1.201  13.051
  498   3HG2  THR  59          HG23      THR  59 -12.464   1.984  11.517
  499    H    LEU  60           HN       LEU  60 -14.067  -1.465   9.077
  500    HA   LEU  60           HA       LEU  60 -15.289   0.750   7.820
  501   1HB   LEU  60           HB2      LEU  60 -14.932  -2.153   7.160
  502   2HB   LEU  60           HB1      LEU  60 -16.004  -1.195   6.148
  503    HG   LEU  60           HG       LEU  60 -13.153  -0.416   6.810
  504   1HD1  LEU  60          HD11      LEU  60 -14.159  -2.375   4.972
  505   2HD1  LEU  60          HD13      LEU  60 -13.513  -1.014   4.053
  506   3HD1  LEU  60          HD12      LEU  60 -12.492  -1.856   5.216
  507   1HD2  LEU  60          HD22      LEU  60 -15.354   1.024   5.744
  508   2HD2  LEU  60          HD21      LEU  60 -13.673   1.549   5.840
  509   3HD2  LEU  60          HD23      LEU  60 -14.256   0.712   4.402
  510    H    ASP  61           HN       ASP  61 -16.791  -2.369   8.709
  511    HA   ASP  61           HA       ASP  61 -19.484  -1.292   8.348
  512   1HB   ASP  61           HB2      ASP  61 -18.613  -3.753   8.032
  513   2HB   ASP  61           HB1      ASP  61 -18.882  -3.871   9.771
  514    H    GLU  62           HN       GLU  62 -17.227  -0.916  10.744
  515    HA   GLU  62           HA       GLU  62 -18.848  -1.324  13.099
  516   1HB   GLU  62           HB2      GLU  62 -16.373  -1.233  13.179
  517   2HB   GLU  62           HB1      GLU  62 -16.432   0.468  12.711
  518   1HG   GLU  62           HG2      GLU  62 -18.216   0.119  14.906
  519   2HG   GLU  62           HG1      GLU  62 -16.692  -0.660  15.330
  520    H    ASP  63           HN       ASP  63 -18.356   1.359  10.878
  521    HA   ASP  63           HA       ASP  63 -20.509   2.820  12.337
  522   1HB   ASP  63           HB2      ASP  63 -17.805   3.630  12.121
  523   2HB   ASP  63           HB1      ASP  63 -18.727   4.666  11.031
  524    H    GLY  64           HN       GLY  64 -18.600   3.030   9.326
  525   1HA   GLY  64           HA2      GLY  64 -19.373   3.023   7.092
  526   2HA   GLY  64           HA1      GLY  64 -20.996   2.697   7.698
  527    H    ASP  65           HN       ASP  65 -20.087   5.242   9.503
  528    HA   ASP  65           HA       ASP  65 -20.853   7.267   7.452
  529   1HB   ASP  65           HB2      ASP  65 -22.724   6.443   9.081
  530   2HB   ASP  65           HB1      ASP  65 -21.874   7.421  10.275
  531    H    GLY  66           HN       GLY  66 -18.219   6.675   8.454
  532   1HA   GLY  66           HA2      GLY  66 -17.696   9.153  10.027
  533   2HA   GLY  66           HA1      GLY  66 -16.746   7.684  10.235
  534    H    GLU  67           HN       GLU  67 -15.044   9.478   9.703
  535    HA   GLU  67           HA       GLU  67 -14.703   9.598   6.733
  536   1HB   GLU  67           HB2      GLU  67 -13.335  11.451   8.681
  537   2HB   GLU  67           HB1      GLU  67 -13.624  11.688   6.957
  538   1HG   GLU  67           HG2      GLU  67 -15.992  11.969   7.319
  539   2HG   GLU  67           HG1      GLU  67 -15.839  11.501   9.012
  540    H    CYS  68           HN       CYS  68 -12.455   9.407   5.983
  541    HA   CYS  68           HA       CYS  68 -10.693   7.968   7.923
  542   1HB   CYS  68           HB2      CYS  68 -11.384   7.251   5.069
  543   2HB   CYS  68           HB1      CYS  68  -9.940   6.628   5.866
  544    HG   CYS  68           HG       CYS  68 -11.449   4.908   6.816
  545    H    ASP  69           HN       ASP  69  -8.378   7.798   6.730
  546    HA   ASP  69           HA       ASP  69  -7.816  10.543   5.671
  547   1HB   ASP  69           HB2      ASP  69  -6.148   8.753   7.454
  548   2HB   ASP  69           HB1      ASP  69  -5.509  10.192   6.661
  549    H    PHE  70           HN       PHE  70  -5.592  10.486   4.441
  550    HA   PHE  70           HA       PHE  70  -5.910   8.595   2.259
  551   1HB   PHE  70           HB2      PHE  70  -3.970   9.714   1.282
  552   2HB   PHE  70           HB1      PHE  70  -5.071  10.926   1.936
  553    HD1  PHE  70           HD1      PHE  70  -4.576  12.001   4.148
  554    HD2  PHE  70           HD2      PHE  70  -1.772   9.409   2.182
  555    HE1  PHE  70           HE1      PHE  70  -2.760  12.866   5.597
  556    HE2  PHE  70           HE2      PHE  70   0.043  10.276   3.630
  557    HZ   PHE  70           HZ       PHE  70  -0.451  12.004   5.338
  558    H    GLN  71           HN       GLN  71  -3.873   8.837   5.106
  559    HA   GLN  71           HA       GLN  71  -2.078   6.687   4.256
  560   1HB   GLN  71           HB2      GLN  71  -2.496   8.230   6.814
  561   2HB   GLN  71           HB1      GLN  71  -1.469   6.798   6.786
  562   1HG   GLN  71           HG2      GLN  71  -0.828   8.452   4.528
  563   2HG   GLN  71           HG1      GLN  71  -0.781   9.435   5.991
  564   1HE2  GLN  71          HE22      GLN  71   1.585   6.084   6.190
  565   2HE2  GLN  71          HE21      GLN  71  -0.022   5.940   5.661
  566    H    GLU  72           HN       GLU  72  -5.132   6.976   5.868
  567    HA   GLU  72           HA       GLU  72  -5.031   4.345   7.125
  568   1HB   GLU  72           HB2      GLU  72  -6.981   6.568   6.870
  569   2HB   GLU  72           HB1      GLU  72  -7.678   4.958   7.057
  570   1HG   GLU  72           HG2      GLU  72  -5.489   5.195   8.879
  571   2HG   GLU  72           HG1      GLU  72  -6.517   6.615   9.069
  572    H    PHE  73           HN       PHE  73  -6.758   5.734   4.313
  573    HA   PHE  73           HA       PHE  73  -7.831   3.206   3.462
  574   1HB   PHE  73           HB2      PHE  73  -8.977   4.621   2.125
  575   2HB   PHE  73           HB1      PHE  73  -7.922   5.945   2.599
  576    HD1  PHE  73           HD2      PHE  73  -5.692   6.214   1.357
  577    HD2  PHE  73           HD1      PHE  73  -8.891   3.725  -0.061
  578    HE1  PHE  73           HE2      PHE  73  -4.706   6.246  -0.916
  579    HE2  PHE  73           HE1      PHE  73  -7.905   3.754  -2.335
  580    HZ   PHE  73           HZ       PHE  73  -5.812   5.016  -2.762
  581    H    MET  74           HN       MET  74  -4.736   4.739   3.142
  582    HA   MET  74           HA       MET  74  -3.821   3.140   0.894
  583   1HB   MET  74           HB2      MET  74  -2.775   5.259   2.580
  584   2HB   MET  74           HB1      MET  74  -1.578   3.985   2.364
  585   1HG   MET  74           HG2      MET  74  -3.018   4.669  -0.105
  586   2HG   MET  74           HG1      MET  74  -2.076   6.006   0.555
  587   1HE   MET  74           HE1      MET  74  -2.523   3.009  -1.068
  588   2HE   MET  74           HE3      MET  74  -1.247   3.331  -2.250
  589   3HE   MET  74           HE2      MET  74  -1.061   2.027  -1.080
  590    H    ALA  75           HN       ALA  75  -3.141   3.059   4.412
  591    HA   ALA  75           HA       ALA  75  -1.701   0.556   4.228
  592   1HB   ALA  75           HB2      ALA  75  -3.002   1.918   6.607
  593   2HB   ALA  75           HB1      ALA  75  -1.904   0.543   6.709
  594   3HB   ALA  75           HB3      ALA  75  -1.322   2.094   6.103
  595    H    PHE  76           HN       PHE  76  -5.009   1.410   4.207
  596    HA   PHE  76           HA       PHE  76  -6.004  -1.115   5.301
  597   1HB   PHE  76           HB2      PHE  76  -7.145   1.411   4.301
  598   2HB   PHE  76           HB1      PHE  76  -8.102  -0.015   3.901
  599    HD1  PHE  76           HD2      PHE  76  -5.919   0.526   6.874
  600    HD2  PHE  76           HD1      PHE  76  -9.931   0.128   5.399
  601    HE1  PHE  76           HE2      PHE  76  -6.766   0.440   9.203
  602    HE2  PHE  76           HE1      PHE  76 -10.780   0.042   7.727
  603    HZ   PHE  76           HZ       PHE  76  -9.197   0.198   9.629
  604    H    VAL  77           HN       VAL  77  -5.645   0.343   2.064
  605    HA   VAL  77           HA       VAL  77  -6.810  -1.879   0.651
  606    HB   VAL  77           HB       VAL  77  -4.818   0.217  -0.271
  607   1HG1  VAL  77          HG11      VAL  77  -4.976  -1.941  -1.635
  608   2HG1  VAL  77          HG13      VAL  77  -6.646  -1.489  -1.973
  609   3HG1  VAL  77          HG12      VAL  77  -5.326  -0.449  -2.508
  610   1HG2  VAL  77          HG21      VAL  77  -7.167   0.883   0.596
  611   2HG2  VAL  77          HG23      VAL  77  -6.691   1.468  -0.998
  612   3HG2  VAL  77          HG22      VAL  77  -7.778   0.086  -0.852
  613    H    SER  78           HN       SER  78  -3.592  -1.230   1.893
  614    HA   SER  78           HA       SER  78  -2.315  -3.347   0.359
  615   1HB   SER  78           HB2      SER  78  -1.308  -2.136   2.938
  616   2HB   SER  78           HB1      SER  78  -0.362  -2.870   1.648
  617    HG   SER  78           HG       SER  78  -1.555  -1.076   0.376
  618    H    MET  79           HN       MET  79  -3.668  -3.057   3.629
  619    HA   MET  79           HA       MET  79  -2.801  -5.571   4.626
  620   1HB   MET  79           HB2      MET  79  -5.290  -3.958   5.227
  621   2HB   MET  79           HB1      MET  79  -4.751  -5.340   6.174
  622   1HG   MET  79           HG2      MET  79  -2.549  -3.525   5.783
  623   2HG   MET  79           HG1      MET  79  -3.925  -2.653   6.455
  624   1HE   MET  79           HE2      MET  79  -4.708  -2.567   8.276
  625   2HE   MET  79           HE1      MET  79  -4.696  -3.676   9.645
  626   3HE   MET  79           HE3      MET  79  -3.390  -2.499   9.443
  627    H    VAL  80           HN       VAL  80  -5.899  -4.697   3.057
  628    HA   VAL  80           HA       VAL  80  -6.873  -7.403   3.040
  629    HB   VAL  80           HB       VAL  80  -8.427  -6.412   1.214
  630   1HG1  VAL  80          HG13      VAL  80  -8.208  -5.497   4.074
  631   2HG1  VAL  80          HG12      VAL  80  -9.533  -4.945   3.049
  632   3HG1  VAL  80          HG11      VAL  80  -9.328  -6.667   3.375
  633   1HG2  VAL  80          HG22      VAL  80  -6.498  -4.381   1.319
  634   2HG2  VAL  80          HG21      VAL  80  -8.062  -4.297   0.515
  635   3HG2  VAL  80          HG23      VAL  80  -7.891  -3.719   2.171
  636    H    THR  81           HN       THR  81  -5.132  -5.436   0.627
  637    HA   THR  81           HA       THR  81  -5.329  -7.389  -1.478
  638    HB   THR  81           HB       THR  81  -3.117  -5.351  -1.091
  639    HG1  THR  81           HG1      THR  81  -5.790  -5.083  -1.674
  640   1HG2  THR  81          HG22      THR  81  -3.064  -7.241  -2.894
  641   2HG2  THR  81          HG21      THR  81  -4.305  -6.276  -3.693
  642   3HG2  THR  81          HG23      THR  81  -2.713  -5.583  -3.385
  643    H    THR  82           HN       THR  82  -3.550  -7.327   1.430
  644    HA   THR  82           HA       THR  82  -1.569  -9.285   0.366
  645    HB   THR  82           HB       THR  82  -0.601  -8.936   2.764
  646    HG1  THR  82           HG1      THR  82  -2.167  -7.796   3.735
  647   1HG2  THR  82          HG22      THR  82  -0.034  -7.851   0.332
  648   2HG2  THR  82          HG21      THR  82  -0.352  -6.394   1.273
  649   3HG2  THR  82          HG23      THR  82   0.898  -7.523   1.793
  650    H    ALA  83           HN       ALA  83  -4.478  -9.071   2.122
  651    HA   ALA  83           HA       ALA  83  -4.017 -11.485   3.732
  652   1HB   ALA  83           HB2      ALA  83  -6.207  -9.496   3.396
  653   2HB   ALA  83           HB1      ALA  83  -6.675 -11.115   3.917
  654   3HB   ALA  83           HB3      ALA  83  -5.525 -10.179   4.872
  655    H    CYS  84           HN       CYS  84  -3.578 -12.010   1.007
  656    HA   CYS  84           HA       CYS  84  -5.987 -13.171  -0.168
  657   1HB   CYS  84           HB2      CYS  84  -3.109 -13.661  -0.974
  658   2HB   CYS  84           HB1      CYS  84  -4.550 -13.871  -1.968
  659    HG   CYS  84           HG       CYS  84  -3.102 -11.242  -1.515
  660    H    HIS  85           HN       HIS  85  -5.338 -15.630  -1.062
  661    HA   HIS  85           HA       HIS  85  -5.364 -17.214   1.407
  662   1HB   HIS  85           HB2      HIS  85  -6.912 -17.814  -0.380
  663   2HB   HIS  85           HB1      HIS  85  -5.573 -18.022  -1.508
  664    HD1  HIS  85           HD1      HIS  85  -5.876 -19.276   2.078
  665    HD2  HIS  85           HD2      HIS  85  -5.439 -20.780  -1.783
  666    HE1  HIS  85           HE1      HIS  85  -5.558 -21.778   2.316
  667    H    GLU  86           HN       GLU  86  -3.785 -18.510  -1.432
  668    HA   GLU  86           HA       GLU  86  -1.489 -19.309   0.140
  669   1HB   GLU  86           HB2      GLU  86  -2.560 -19.851  -2.491
  670   2HB   GLU  86           HB1      GLU  86  -0.831 -19.515  -2.595
  671   1HG   GLU  86           HG2      GLU  86  -0.794 -21.789  -2.117
  672   2HG   GLU  86           HG1      GLU  86  -0.719 -21.115  -0.490
  673    H    PHE  87           HN       PHE  87  -1.107 -17.706  -2.994
  674    HA   PHE  87           HA       PHE  87   0.070 -15.302  -1.867
  675   1HB   PHE  87           HB2      PHE  87   1.769 -17.360  -1.665
  676   2HB   PHE  87           HB1      PHE  87   2.095 -16.919  -3.341
  677    HD1  PHE  87           HD1      PHE  87   1.830 -15.475   0.096
  678    HD2  PHE  87           HD2      PHE  87   3.476 -15.081  -3.850
  679    HE1  PHE  87           HE1      PHE  87   3.218 -13.571   0.863
  680    HE2  PHE  87           HE2      PHE  87   4.865 -13.176  -3.082
  681    HZ   PHE  87           HZ       PHE  87   4.735 -12.421  -0.726
  682    H    PHE  88           HN       PHE  88  -1.459 -14.462  -3.444
  683    HA   PHE  88           HA       PHE  88  -1.951 -13.498  -5.519
  684   1HB   PHE  88           HB2      PHE  88   0.814 -14.401  -6.306
  685   2HB   PHE  88           HB1      PHE  88  -0.100 -13.050  -6.978
  686    HD1  PHE  88           HD1      PHE  88  -1.218 -12.180  -4.195
  687    HD2  PHE  88           HD2      PHE  88   2.731 -13.043  -5.642
  688    HE1  PHE  88           HE1      PHE  88  -0.256 -10.692  -2.462
  689    HE2  PHE  88           HE2      PHE  88   3.693 -11.553  -3.909
  690    HZ   PHE  88           HZ       PHE  88   2.199 -10.377  -2.319
  691    H    GLU  89           HN       GLU  89  -2.555 -16.317  -5.004
  692    HA   GLU  89           HA       GLU  89  -3.392 -18.150  -6.190
  693   1HB   GLU  89           HB2      GLU  89  -4.053 -16.015  -7.628
  694   2HB   GLU  89           HB1      GLU  89  -2.949 -16.754  -8.787
  695   1HG   GLU  89           HG2      GLU  89  -4.229 -18.771  -8.865
  696   2HG   GLU  89           HG1      GLU  89  -5.170 -18.312  -7.448
  697    H    HIS  90           HN       HIS  90  -0.285 -17.257  -6.214
  698    HA   HIS  90           HA       HIS  90   1.703 -18.084  -7.197
  699   1HB   HIS  90           HB2      HIS  90   0.416 -19.936  -5.646
  700   2HB   HIS  90           HB1      HIS  90   0.619 -20.828  -7.154
  701    HD1  HIS  90           HD1      HIS  90   2.655 -18.932  -4.573
  702    HD2  HIS  90           HD2      HIS  90   3.238 -21.658  -7.669
  703    HE1  HIS  90           HE1      HIS  90   5.082 -19.644  -4.453
  704    H    GLU  91           HN       GLU  91  -0.435 -17.435  -9.183
  705    HA   GLU  91           HA       GLU  91   0.813 -18.565 -11.498
  706   1HB   GLU  91           HB2      GLU  91  -0.926 -20.360 -10.302
  707   2HB   GLU  91           HB1      GLU  91  -1.931 -19.604 -11.539
  708   1HG   GLU  91           HG2      GLU  91  -0.851 -20.693 -13.188
  709   2HG   GLU  91           HG1      GLU  91   0.721 -20.193 -12.566
  710   1H    MET   0           HT1      MET   0 -11.282  -1.863 -15.335
  711   2H    MET   0           HT3      MET   0 -10.520  -3.316 -15.765
  712   3H    MET   0           HT2      MET   0 -10.590  -2.845 -14.133
  713    HA   MET   0           HA       MET   0  -8.401  -2.391 -14.879
  714   1HB   MET   0           HB2      MET   0  -8.104  -0.828 -16.844
  715   2HB   MET   0           HB1      MET   0  -8.755  -2.413 -17.266
  716   1HG   MET   0           HG2      MET   0 -10.821  -0.447 -16.558
  717   2HG   MET   0           HG1      MET   0  -9.886  -0.006 -17.987
  718   1HE   MET   0           HE2      MET   0 -11.087  -0.175 -19.832
  719   2HE   MET   0           HE1      MET   0 -12.215  -1.422 -20.361
  720   3HE   MET   0           HE3      MET   0 -12.646  -0.341 -19.030
  721    H    SER   1           HN       SER   1  -8.419  -1.279 -12.888
  722    HA   SER   1           HA       SER   1  -9.126   1.619 -13.102
  723   1HB   SER   1           HB2      SER   1  -9.755   1.492 -10.668
  724   2HB   SER   1           HB1      SER   1 -10.829   0.587 -11.730
  725    HG   SER   1           HG       SER   1  -9.398  -0.297  -9.676
  726    H    GLU   2           HN       GLU   2  -8.035   2.793 -11.105
  727    HA   GLU   2           HA       GLU   2  -5.182   2.369 -11.382
  728   1HB   GLU   2           HB2      GLU   2  -6.478   4.068  -9.254
  729   2HB   GLU   2           HB1      GLU   2  -4.933   4.319 -10.064
  730   1HG   GLU   2           HG2      GLU   2  -7.700   4.628 -11.254
  731   2HG   GLU   2           HG1      GLU   2  -6.487   5.888 -11.022
  732    H    LEU   3           HN       LEU   3  -7.579   1.674  -8.865
  733    HA   LEU   3           HA       LEU   3  -5.671   0.850  -6.871
  734   1HB   LEU   3           HB2      LEU   3  -8.282   1.378  -6.752
  735   2HB   LEU   3           HB1      LEU   3  -8.394  -0.369  -6.953
  736    HG   LEU   3           HG       LEU   3  -6.607  -0.483  -5.074
  737   1HD1  LEU   3          HD13      LEU   3  -7.565   2.372  -4.930
  738   2HD1  LEU   3          HD12      LEU   3  -7.002   1.532  -3.486
  739   3HD1  LEU   3          HD11      LEU   3  -5.914   1.761  -4.855
  740   1HD2  LEU   3          HD22      LEU   3  -8.960  -1.198  -4.818
  741   2HD2  LEU   3          HD21      LEU   3  -8.383  -0.402  -3.355
  742   3HD2  LEU   3          HD23      LEU   3  -9.428   0.466  -4.477
  743    H    GLU   4           HN       GLU   4  -7.524  -0.933  -9.325
  744    HA   GLU   4           HA       GLU   4  -6.566  -3.524  -8.470
  745   1HB   GLU   4           HB2      GLU   4  -8.609  -3.435  -9.725
  746   2HB   GLU   4           HB1      GLU   4  -7.832  -2.555 -11.041
  747   1HG   GLU   4           HG2      GLU   4  -6.366  -4.974 -10.550
  748   2HG   GLU   4           HG1      GLU   4  -8.074  -5.370 -10.740
  749    H    LYS   5           HN       LYS   5  -5.813  -1.737 -11.493
  750    HA   LYS   5           HA       LYS   5  -3.613  -3.390 -12.192
  751   1HB   LYS   5           HB2      LYS   5  -3.073  -1.737 -13.829
  752   2HB   LYS   5           HB1      LYS   5  -4.828  -1.706 -13.669
  753   1HG   LYS   5           HG2      LYS   5  -4.379   0.132 -11.867
  754   2HG   LYS   5           HG1      LYS   5  -2.806   0.274 -12.651
  755   1HD   LYS   5           HD2      LYS   5  -5.163   0.212 -14.456
  756   2HD   LYS   5           HD1      LYS   5  -4.978   1.661 -13.469
  757   1HE   LYS   5           HE2      LYS   5  -2.679   1.948 -14.291
  758   2HE   LYS   5           HE1      LYS   5  -2.832   0.481 -15.257
  759   1HZ   LYS   5           HZ1      LYS   5  -4.970   1.819 -16.072
  760   2HZ   LYS   5           HZ3      LYS   5  -3.954   3.125 -15.704
  761   3HZ   LYS   5           HZ2      LYS   5  -3.454   1.951 -16.825
  762    H    ALA   6           HN       ALA   6  -3.720  -0.443 -10.200
  763    HA   ALA   6           HA       ALA   6  -0.808  -0.344  -9.979
  764   1HB   ALA   6           HB1      ALA   6  -2.568   1.596  -9.742
  765   2HB   ALA   6           HB3      ALA   6  -2.635   1.061  -8.063
  766   3HB   ALA   6           HB2      ALA   6  -1.108   1.609  -8.754
  767    H    MET   7           HN       MET   7  -3.369  -0.880  -7.511
  768    HA   MET   7           HA       MET   7  -1.684  -1.734  -5.438
  769   1HB   MET   7           HB2      MET   7  -4.205  -1.363  -5.339
  770   2HB   MET   7           HB1      MET   7  -4.381  -2.982  -6.018
  771   1HG   MET   7           HG2      MET   7  -4.522  -3.149  -3.600
  772   2HG   MET   7           HG1      MET   7  -2.996  -3.864  -4.119
  773   1HE   MET   7           HE1      MET   7  -2.455  -3.648  -1.506
  774   2HE   MET   7           HE3      MET   7  -1.126  -3.597  -2.671
  775   3HE   MET   7           HE2      MET   7  -1.132  -2.506  -1.289
  776    H    VAL   8           HN       VAL   8  -3.390  -3.834  -7.768
  777    HA   VAL   8           HA       VAL   8  -2.086  -6.245  -6.990
  778    HB   VAL   8           HB       VAL   8  -3.012  -5.610  -9.800
  779   1HG1  VAL   8          HG12      VAL   8  -1.885  -7.877  -8.703
  780   2HG1  VAL   8          HG11      VAL   8  -3.611  -8.202  -8.542
  781   3HG1  VAL   8          HG13      VAL   8  -2.923  -7.857 -10.128
  782   1HG2  VAL   8          HG21      VAL   8  -4.543  -5.272  -7.498
  783   2HG2  VAL   8          HG23      VAL   8  -5.173  -5.531  -9.123
  784   3HG2  VAL   8          HG22      VAL   8  -4.956  -6.900  -8.034
  785    H    ALA   9           HN       ALA   9  -1.068  -3.583  -9.008
  786    HA   ALA   9           HA       ALA   9   1.062  -4.889 -10.411
  787   1HB   ALA   9           HB2      ALA   9   0.169  -2.141  -9.925
  788   2HB   ALA   9           HB1      ALA   9   1.924  -2.277 -10.011
  789   3HB   ALA   9           HB3      ALA   9   0.929  -2.832 -11.356
  790    H    LEU  10           HN       LEU  10   0.970  -3.152  -7.300
  791    HA   LEU  10           HA       LEU  10   3.730  -3.292  -6.696
  792   1HB   LEU  10           HB2      LEU  10   1.264  -2.754  -5.260
  793   2HB   LEU  10           HB1      LEU  10   2.383  -3.683  -4.261
  794    HG   LEU  10           HG       LEU  10   3.773  -1.596  -5.732
  795   1HD1  LEU  10          HD13      LEU  10   1.266  -0.762  -5.172
  796   2HD1  LEU  10          HD12      LEU  10   2.043  -0.416  -3.627
  797   3HD1  LEU  10          HD11      LEU  10   2.666   0.310  -5.108
  798   1HD2  LEU  10          HD21      LEU  10   3.676  -2.850  -3.103
  799   2HD2  LEU  10          HD23      LEU  10   5.030  -2.065  -3.915
  800   3HD2  LEU  10          HD22      LEU  10   3.885  -1.104  -2.982
  801    H    ILE  11           HN       ILE  11   1.168  -5.705  -6.368
  802    HA   ILE  11           HA       ILE  11   2.691  -7.602  -4.843
  803    HB   ILE  11           HB       ILE  11   0.320  -7.853  -6.702
  804   1HG1  ILE  11          HG12      ILE  11  -0.869  -8.310  -4.619
  805   2HG1  ILE  11          HG11      ILE  11   0.646  -8.299  -3.718
  806   1HG2  ILE  11          HG23      ILE  11   1.978  -9.986  -5.402
  807   2HG2  ILE  11          HG22      ILE  11   0.238 -10.220  -5.541
  808   3HG2  ILE  11          HG21      ILE  11   1.214  -9.985  -6.989
  809   1HD1  ILE  11          HD12      ILE  11  -0.370  -5.929  -5.305
  810   2HD1  ILE  11          HD11      ILE  11  -0.658  -6.141  -3.579
  811   3HD1  ILE  11          HD13      ILE  11   0.988  -5.955  -4.181
  812    H    ASP  12           HN       ASP  12   2.471  -6.875  -8.283
  813    HA   ASP  12           HA       ASP  12   3.865  -9.217  -9.210
  814   1HB   ASP  12           HB2      ASP  12   2.475  -7.497 -10.561
  815   2HB   ASP  12           HB1      ASP  12   3.949  -6.531 -10.586
  816    H    VAL  13           HN       VAL  13   4.997  -5.853  -8.733
  817    HA   VAL  13           HA       VAL  13   7.729  -6.297  -9.252
  818    HB   VAL  13           HB       VAL  13   6.110  -4.210  -8.196
  819   1HG1  VAL  13          HG12      VAL  13   8.515  -4.834  -6.476
  820   2HG1  VAL  13          HG11      VAL  13   7.788  -3.229  -6.565
  821   3HG1  VAL  13          HG13      VAL  13   6.848  -4.592  -5.955
  822   1HG2  VAL  13          HG23      VAL  13   7.776  -4.184 -10.089
  823   2HG2  VAL  13          HG22      VAL  13   7.903  -2.808  -8.993
  824   3HG2  VAL  13          HG21      VAL  13   9.057  -4.135  -8.878
  825    H    PHE  14           HN       PHE  14   6.105  -6.340  -6.081
  826    HA   PHE  14           HA       PHE  14   8.183  -7.089  -4.423
  827   1HB   PHE  14           HB2      PHE  14   5.900  -6.770  -3.596
  828   2HB   PHE  14           HB1      PHE  14   5.380  -8.247  -4.407
  829    HD1  PHE  14           HD1      PHE  14   7.752  -6.949  -1.832
  830    HD2  PHE  14           HD2      PHE  14   5.629 -10.355  -3.365
  831    HE1  PHE  14           HE1      PHE  14   8.472  -8.284   0.129
  832    HE2  PHE  14           HE2      PHE  14   6.349 -11.688  -1.403
  833    HZ   PHE  14           HZ       PHE  14   7.771 -10.653   0.344
  834    H    HIS  15           HN       HIS  15   6.512  -9.160  -6.754
  835    HA   HIS  15           HA       HIS  15   7.896 -11.568  -5.829
  836   1HB   HIS  15           HB2      HIS  15   5.591 -11.172  -7.227
  837   2HB   HIS  15           HB1      HIS  15   6.706 -11.557  -8.537
  838    HD1  HIS  15           HD1      HIS  15   7.219 -13.980  -8.879
  839    HD2  HIS  15           HD2      HIS  15   5.656 -13.258  -5.085
  840    HE1  HIS  15           HE1      HIS  15   6.910 -16.245  -7.788
  841    H    GLN  16           HN       GLN  16   8.272  -9.222  -8.460
  842    HA   GLN  16           HA       GLN  16  10.240 -10.636  -9.950
  843   1HB   GLN  16           HB2      GLN  16   8.961  -8.300 -10.329
  844   2HB   GLN  16           HB1      GLN  16  10.500  -7.678  -9.732
  845   1HG   GLN  16           HG2      GLN  16  11.392  -8.016 -11.766
  846   2HG   GLN  16           HG1      GLN  16  11.118  -9.748 -11.568
  847   1HE2  GLN  16          HE22      GLN  16   8.797  -7.647 -14.123
  848   2HE2  GLN  16          HE21      GLN  16  10.109  -6.937 -13.313
  849    H    TYR  17           HN       TYR  17  10.661  -8.195  -7.363
  850    HA   TYR  17           HA       TYR  17  13.515  -8.341  -7.320
  851   1HB   TYR  17           HB2      TYR  17  11.455  -7.490  -5.286
  852   2HB   TYR  17           HB1      TYR  17  13.179  -7.477  -4.911
  853    HD1  TYR  17           HD2      TYR  17  10.531  -6.009  -7.024
  854    HD2  TYR  17           HD1      TYR  17  14.699  -5.916  -5.990
  855    HE1  TYR  17           HE2      TYR  17  10.780  -3.848  -8.216
  856    HE2  TYR  17           HE1      TYR  17  14.947  -3.755  -7.182
  857    HH   TYR  17           HH       TYR  17  13.651  -2.584  -9.149
  858    H    SER  18           HN       SER  18  11.030 -10.151  -5.524
  859    HA   SER  18           HA       SER  18  13.164 -11.768  -4.244
  860   1HB   SER  18           HB2      SER  18  11.462 -11.187  -2.696
  861   2HB   SER  18           HB1      SER  18  10.178 -11.547  -3.845
  862    HG   SER  18           HG       SER  18  10.325 -13.272  -2.462
  863    H    GLY  19           HN       GLY  19  11.940 -11.794  -7.180
  864   1HA   GLY  19           HA2      GLY  19  11.198 -14.651  -7.315
  865   2HA   GLY  19           HA1      GLY  19  11.091 -13.497  -8.643
  866    H    ARG  20           HN       ARG  20  13.652 -12.433  -8.660
  867    HA   ARG  20           HA       ARG  20  15.121 -14.264 -10.186
  868   1HB   ARG  20           HB2      ARG  20  17.065 -12.803  -9.809
  869   2HB   ARG  20           HB1      ARG  20  15.616 -11.835 -10.084
  870   1HG   ARG  20           HG2      ARG  20  15.327 -11.635  -7.616
  871   2HG   ARG  20           HG1      ARG  20  16.848 -12.500  -7.398
  872   1HD   ARG  20           HD2      ARG  20  16.506  -9.876  -8.880
  873   2HD   ARG  20           HD1      ARG  20  17.208 -10.066  -7.275
  874    HE   ARG  20           HE       ARG  20  18.682 -11.751  -8.977
  875   1HH1  ARG  20          HH11      ARG  20  18.048  -8.424  -8.348
  876   2HH1  ARG  20          HH12      ARG  20  19.466  -7.859  -9.165
  877   1HH2  ARG  20          HH21      ARG  20  20.472 -11.021 -10.170
  878   2HH2  ARG  20          HH22      ARG  20  20.837  -9.327 -10.195
  879    H    GLU  21           HN       GLU  21  15.336 -13.630  -6.698
  880    HA   GLU  21           HA       GLU  21  16.611 -16.298  -6.388
  881   1HB   GLU  21           HB2      GLU  21  17.860 -13.707  -5.909
  882   2HB   GLU  21           HB1      GLU  21  17.843 -14.707  -4.456
  883   1HG   GLU  21           HG2      GLU  21  19.348 -16.170  -5.311
  884   2HG   GLU  21           HG1      GLU  21  18.550 -16.198  -6.883
  885    H    GLY  22           HN       GLY  22  16.994 -16.135  -3.605
  886   1HA   GLY  22           HA2      GLY  22  15.830 -16.202  -1.561
  887   2HA   GLY  22           HA1      GLY  22  14.621 -15.136  -2.277
  888    H    ASP  23           HN       ASP  23  12.831 -16.345  -1.528
  889    HA   ASP  23           HA       ASP  23  12.556 -19.052  -2.773
  890   1HB   ASP  23           HB2      ASP  23  12.114 -18.133  -0.038
  891   2HB   ASP  23           HB1      ASP  23  10.683 -18.913  -0.713
  892    H    LYS  24           HN       LYS  24  11.787 -16.156  -3.570
  893    HA   LYS  24           HA       LYS  24  10.018 -15.173  -4.750
  894   1HB   LYS  24           HB2      LYS  24   9.531 -18.097  -4.955
  895   2HB   LYS  24           HB1      LYS  24   8.156 -17.053  -5.312
  896   1HG   LYS  24           HG2      LYS  24   9.293 -17.348  -7.389
  897   2HG   LYS  24           HG1      LYS  24   9.728 -15.731  -6.833
  898   1HD   LYS  24           HD2      LYS  24  11.765 -16.780  -7.550
  899   2HD   LYS  24           HD1      LYS  24  11.797 -16.769  -5.787
  900   1HE   LYS  24           HE2      LYS  24  11.690 -19.033  -5.654
  901   2HE   LYS  24           HE1      LYS  24  10.492 -19.141  -6.943
  902   1HZ   LYS  24           HZ2      LYS  24  13.326 -18.496  -7.486
  903   2HZ   LYS  24           HZ1      LYS  24  12.766 -20.098  -7.418
  904   3HZ   LYS  24           HZ3      LYS  24  12.139 -19.029  -8.576
  905    H    HIS  25           HN       HIS  25   9.875 -15.994  -1.688
  906    HA   HIS  25           HA       HIS  25   7.112 -14.950  -1.377
  907   1HB   HIS  25           HB2      HIS  25   6.915 -17.391  -1.167
  908   2HB   HIS  25           HB1      HIS  25   8.189 -17.400   0.052
  909    HD1  HIS  25           HD1      HIS  25   7.588 -16.592   2.420
  910    HD2  HIS  25           HD2      HIS  25   4.418 -16.291  -0.268
  911    HE1  HIS  25           HE1      HIS  25   5.526 -16.085   3.796
  912    H    LYS  26           HN       LYS  26  10.214 -14.383  -0.810
  913    HA   LYS  26           HA       LYS  26   9.627 -12.904   1.683
  914   1HB   LYS  26           HB2      LYS  26  11.582 -13.773   2.848
  915   2HB   LYS  26           HB1      LYS  26  10.545 -15.124   2.385
  916   1HG   LYS  26           HG2      LYS  26  11.940 -15.581   0.438
  917   2HG   LYS  26           HG1      LYS  26  12.937 -14.168   0.789
  918   1HD   LYS  26           HD2      LYS  26  13.035 -15.489   3.180
  919   2HD   LYS  26           HD1      LYS  26  12.953 -16.839   2.047
  920   1HE   LYS  26           HE2      LYS  26  15.253 -16.438   2.143
  921   2HE   LYS  26           HE1      LYS  26  14.779 -15.490   0.734
  922   1HZ   LYS  26           HZ3      LYS  26  14.401 -13.894   2.980
  923   2HZ   LYS  26           HZ2      LYS  26  15.937 -14.601   3.136
  924   3HZ   LYS  26           HZ1      LYS  26  15.552 -13.699   1.750
  925    H    LEU  27           HN       LEU  27  10.935 -11.059   1.910
  926    HA   LEU  27           HA       LEU  27  12.777 -10.518  -0.385
  927   1HB   LEU  27           HB2      LEU  27  10.559  -8.994   0.756
  928   2HB   LEU  27           HB1      LEU  27  12.045  -8.050   0.680
  929    HG   LEU  27           HG       LEU  27  10.750  -9.542  -1.620
  930   1HD1  LEU  27          HD11      LEU  27   9.879  -7.229  -0.699
  931   2HD1  LEU  27          HD13      LEU  27  11.304  -6.593  -1.519
  932   3HD1  LEU  27          HD12      LEU  27  10.075  -7.465  -2.434
  933   1HD2  LEU  27          HD23      LEU  27  13.414  -8.198  -1.266
  934   2HD2  LEU  27          HD22      LEU  27  13.021  -9.688  -2.126
  935   3HD2  LEU  27          HD21      LEU  27  12.619  -8.125  -2.838
  936    H    LYS  28           HN       LYS  28  13.896  -8.152   0.690
  937    HA   LYS  28           HA       LYS  28  15.090  -9.028   3.270
  938   1HB   LYS  28           HB2      LYS  28  16.395  -9.212   0.794
  939   2HB   LYS  28           HB1      LYS  28  17.053  -7.759   1.547
  940   1HG   LYS  28           HG2      LYS  28  17.968  -8.922   3.315
  941   2HG   LYS  28           HG1      LYS  28  16.742 -10.189   3.252
  942   1HD   LYS  28           HD2      LYS  28  17.888 -11.411   1.699
  943   2HD   LYS  28           HD1      LYS  28  18.495  -9.977   0.870
  944   1HE   LYS  28           HE2      LYS  28  20.159  -9.615   2.604
  945   2HE   LYS  28           HE1      LYS  28  19.497 -10.938   3.563
  946   1HZ   LYS  28           HZ3      LYS  28  19.944 -12.162   1.238
  947   2HZ   LYS  28           HZ2      LYS  28  21.202 -11.018   1.223
  948   3HZ   LYS  28           HZ1      LYS  28  21.065 -12.120   2.510
  949    H    LYS  29           HN       LYS  29  15.521  -7.309   4.658
  950    HA   LYS  29           HA       LYS  29  14.202  -4.836   4.262
  951   1HB   LYS  29           HB2      LYS  29  15.399  -4.054   6.233
  952   2HB   LYS  29           HB1      LYS  29  14.931  -5.736   6.480
  953   1HG   LYS  29           HG2      LYS  29  17.254  -6.335   5.546
  954   2HG   LYS  29           HG1      LYS  29  17.657  -4.636   5.798
  955   1HD   LYS  29           HD2      LYS  29  16.757  -6.631   7.892
  956   2HD   LYS  29           HD1      LYS  29  18.327  -5.835   7.781
  957   1HE   LYS  29           HE2      LYS  29  17.445  -4.312   9.210
  958   2HE   LYS  29           HE1      LYS  29  16.597  -3.694   7.793
  959   1HZ   LYS  29           HZ1      LYS  29  15.539  -5.830   9.561
  960   2HZ   LYS  29           HZ3      LYS  29  15.134  -4.190   9.710
  961   3HZ   LYS  29           HZ2      LYS  29  14.717  -5.042   8.300
  962    H    SER  30           HN       SER  30  17.332  -5.907   3.181
  963    HA   SER  30           HA       SER  30  18.352  -3.200   2.707
  964   1HB   SER  30           HB2      SER  30  19.965  -4.718   1.194
  965   2HB   SER  30           HB1      SER  30  20.151  -4.616   2.942
  966    HG   SER  30           HG       SER  30  19.778  -6.676   2.941
  967    H    GLU  31           HN       GLU  31  16.807  -5.757   0.782
  968    HA   GLU  31           HA       GLU  31  17.076  -4.272  -1.710
  969   1HB   GLU  31           HB2      GLU  31  16.770  -6.817  -1.457
  970   2HB   GLU  31           HB1      GLU  31  15.067  -6.466  -1.161
  971   1HG   GLU  31           HG2      GLU  31  14.674  -6.065  -3.348
  972   2HG   GLU  31           HG1      GLU  31  16.093  -5.024  -3.482
  973    H    LEU  32           HN       LEU  32  14.919  -4.248   0.978
  974    HA   LEU  32           HA       LEU  32  12.694  -3.010  -0.473
  975   1HB   LEU  32           HB2      LEU  32  12.134  -4.299   1.499
  976   2HB   LEU  32           HB1      LEU  32  13.278  -3.384   2.482
  977    HG   LEU  32           HG       LEU  32  11.960  -1.349   2.187
  978   1HD1  LEU  32          HD12      LEU  32  10.310  -3.128   0.382
  979   2HD1  LEU  32          HD11      LEU  32   9.686  -1.618   1.043
  980   3HD1  LEU  32          HD13      LEU  32  11.091  -1.599  -0.022
  981   1HD2  LEU  32          HD21      LEU  32  10.511  -3.837   3.093
  982   2HD2  LEU  32          HD23      LEU  32  11.225  -2.559   4.076
  983   3HD2  LEU  32          HD22      LEU  32   9.735  -2.257   3.184
  984    H    LYS  33           HN       LYS  33  15.318  -2.004   1.686
  985    HA   LYS  33           HA       LYS  33  14.671   0.754   1.893
  986   1HB   LYS  33           HB2      LYS  33  16.585  -0.719   2.983
  987   2HB   LYS  33           HB1      LYS  33  17.525  -0.135   1.615
  988   1HG   LYS  33           HG2      LYS  33  16.935   2.202   2.234
  989   2HG   LYS  33           HG1      LYS  33  16.068   1.588   3.640
  990   1HD   LYS  33           HD2      LYS  33  18.080   0.709   4.607
  991   2HD   LYS  33           HD1      LYS  33  18.990   1.004   3.124
  992   1HE   LYS  33           HE2      LYS  33  17.943   3.498   3.713
  993   2HE   LYS  33           HE1      LYS  33  18.340   2.849   5.304
  994   1HZ   LYS  33           HZ1      LYS  33  20.547   2.220   4.279
  995   2HZ   LYS  33           HZ3      LYS  33  20.132   3.233   2.984
  996   3HZ   LYS  33           HZ2      LYS  33  20.282   3.876   4.548
  997    H    GLU  34           HN       GLU  34  16.395  -1.084  -0.565
  998    HA   GLU  34           HA       GLU  34  17.012   1.289  -2.162
  999   1HB   GLU  34           HB2      GLU  34  18.307  -0.139  -3.430
 1000   2HB   GLU  34           HB1      GLU  34  18.183  -1.122  -1.975
 1001   1HG   GLU  34           HG2      GLU  34  17.537  -2.706  -3.494
 1002   2HG   GLU  34           HG1      GLU  34  15.963  -1.976  -3.208
 1003    H    LEU  35           HN       LEU  35  14.579  -1.198  -2.012
 1004    HA   LEU  35           HA       LEU  35  13.333  -0.895  -4.532
 1005   1HB   LEU  35           HB2      LEU  35  12.828  -2.333  -2.216
 1006   2HB   LEU  35           HB1      LEU  35  11.446  -1.240  -2.315
 1007    HG   LEU  35           HG       LEU  35  10.830  -3.180  -3.565
 1008   1HD1  LEU  35          HD12      LEU  35  10.976  -0.670  -4.709
 1009   2HD1  LEU  35          HD11      LEU  35  11.733  -1.690  -5.929
 1010   3HD1  LEU  35          HD13      LEU  35  10.094  -2.041  -5.381
 1011   1HD2  LEU  35          HD21      LEU  35  13.610  -2.920  -4.723
 1012   2HD2  LEU  35          HD23      LEU  35  12.906  -4.298  -3.875
 1013   3HD2  LEU  35          HD22      LEU  35  12.365  -3.895  -5.504
 1014    H    ILE  36           HN       ILE  36  12.812   0.925  -1.511
 1015    HA   ILE  36           HA       ILE  36  10.780   2.616  -2.750
 1016    HB   ILE  36           HB       ILE  36  12.168   3.471  -0.254
 1017   1HG1  ILE  36          HG12      ILE  36  10.675   0.875  -0.605
 1018   2HG1  ILE  36          HG11      ILE  36  12.147   1.189   0.304
 1019   1HG2  ILE  36          HG22      ILE  36  10.047   4.448  -1.440
 1020   2HG2  ILE  36          HG21      ILE  36   9.218   3.083  -0.691
 1021   3HG2  ILE  36          HG23      ILE  36  10.045   4.273   0.314
 1022   1HD1  ILE  36          HD12      ILE  36  10.788   2.588   1.895
 1023   2HD1  ILE  36          HD11      ILE  36   9.340   2.050   1.046
 1024   3HD1  ILE  36          HD13      ILE  36  10.351   0.879   1.894
 1025    H    ASN  37           HN       ASN  37  14.122   3.156  -1.586
 1026    HA   ASN  37           HA       ASN  37  14.245   5.853  -2.588
 1027   1HB   ASN  37           HB2      ASN  37  15.750   5.155  -0.823
 1028   2HB   ASN  37           HB1      ASN  37  16.429   3.891  -1.848
 1029   1HD2  ASN  37          HD22      ASN  37  18.711   6.068  -3.410
 1030   2HD2  ASN  37          HD21      ASN  37  18.188   4.473  -3.163
 1031    H    ASN  38           HN       ASN  38  14.111   2.984  -4.294
 1032    HA   ASN  38           HA       ASN  38  15.824   4.066  -6.488
 1033   1HB   ASN  38           HB2      ASN  38  16.231   1.708  -5.635
 1034   2HB   ASN  38           HB1      ASN  38  14.651   1.280  -6.292
 1035   1HD2  ASN  38          HD22      ASN  38  16.363   0.542  -9.304
 1036   2HD2  ASN  38          HD21      ASN  38  15.463  -0.077  -8.005
 1037    H    GLU  39           HN       GLU  39  12.835   2.089  -6.346
 1038    HA   GLU  39           HA       GLU  39  11.842   2.961  -8.856
 1039   1HB   GLU  39           HB2      GLU  39  10.263   2.061  -6.427
 1040   2HB   GLU  39           HB1      GLU  39   9.665   2.104  -8.086
 1041   1HG   GLU  39           HG2      GLU  39  12.185   0.593  -7.469
 1042   2HG   GLU  39           HG1      GLU  39  10.623  -0.144  -7.109
 1043    H    LEU  40           HN       LEU  40  10.535   3.959  -5.669
 1044    HA   LEU  40           HA       LEU  40   9.175   6.235  -6.760
 1045   1HB   LEU  40           HB2      LEU  40  10.026   5.624  -3.912
 1046   2HB   LEU  40           HB1      LEU  40   8.885   6.879  -4.383
 1047    HG   LEU  40           HG       LEU  40   8.574   3.890  -4.719
 1048   1HD1  LEU  40          HD13      LEU  40   6.931   6.006  -3.296
 1049   2HD1  LEU  40          HD12      LEU  40   6.515   4.295  -3.400
 1050   3HD1  LEU  40          HD11      LEU  40   7.958   4.800  -2.521
 1051   1HD2  LEU  40          HD21      LEU  40   7.246   6.187  -6.101
 1052   2HD2  LEU  40          HD23      LEU  40   7.624   4.579  -6.714
 1053   3HD2  LEU  40          HD22      LEU  40   6.247   4.809  -5.640
 1054    H    SER  41           HN       SER  41  11.357   6.877  -4.095
 1055    HA   SER  41           HA       SER  41  12.876   8.665  -3.855
 1056   1HB   SER  41           HB2      SER  41  14.328   6.970  -4.836
 1057   2HB   SER  41           HB1      SER  41  13.790   7.404  -6.455
 1058    HG   SER  41           HG       SER  41  14.804   9.421  -4.808
 1059    H    HIS  42           HN       HIS  42  10.414   9.493  -5.047
 1060    HA   HIS  42           HA       HIS  42  11.443  11.742  -6.711
 1061   1HB   HIS  42           HB2      HIS  42   9.791   9.634  -7.660
 1062   2HB   HIS  42           HB1      HIS  42   8.773  11.068  -7.534
 1063    HD1  HIS  42           HD1      HIS  42   8.988  12.743  -9.382
 1064    HD2  HIS  42           HD2      HIS  42  12.287  10.202  -9.208
 1065    HE1  HIS  42           HE1      HIS  42  10.436  13.315 -11.378
 1066    H    PHE  43           HN       PHE  43  10.337  11.131  -3.855
 1067    HA   PHE  43           HA       PHE  43   8.585  13.540  -3.793
 1068   1HB   PHE  43           HB2      PHE  43   8.004  10.846  -2.534
 1069   2HB   PHE  43           HB1      PHE  43   7.185  12.330  -2.050
 1070    HD1  PHE  43           HD1      PHE  43   6.476  13.806  -4.279
 1071    HD2  PHE  43           HD2      PHE  43   6.796   9.529  -4.021
 1072    HE1  PHE  43           HE1      PHE  43   4.916  13.575  -6.191
 1073    HE2  PHE  43           HE2      PHE  43   5.236   9.297  -5.934
 1074    HZ   PHE  43           HZ       PHE  43   4.296  11.320  -7.019
 1075    H    LEU  44           HN       LEU  44  11.364  13.326  -3.134
 1076    HA   LEU  44           HA       LEU  44  11.351  13.359  -0.155
 1077   1HB   LEU  44           HB2      LEU  44  13.427  12.881  -2.241
 1078   2HB   LEU  44           HB1      LEU  44  13.950  13.646  -0.741
 1079    HG   LEU  44           HG       LEU  44  12.193  11.504  -0.055
 1080   1HD1  LEU  44          HD12      LEU  44  12.933  10.761  -2.423
 1081   2HD1  LEU  44          HD11      LEU  44  14.521  10.516  -1.697
 1082   3HD1  LEU  44          HD13      LEU  44  13.131   9.607  -1.104
 1083   1HD2  LEU  44          HD22      LEU  44  14.941  12.437   0.440
 1084   2HD2  LEU  44          HD21      LEU  44  13.760  11.774   1.569
 1085   3HD2  LEU  44          HD23      LEU  44  14.746  10.690   0.590
 1086    H    GLU  45           HN       GLU  45  10.058  15.526  -0.842
 1087    HA   GLU  45           HA       GLU  45  11.899  17.747  -1.437
 1088   1HB   GLU  45           HB2      GLU  45   9.023  18.070  -0.612
 1089   2HB   GLU  45           HB1      GLU  45   9.987  19.092  -1.677
 1090   1HG   GLU  45           HG2      GLU  45  10.039  17.303  -3.365
 1091   2HG   GLU  45           HG1      GLU  45   9.095  16.261  -2.299
 1092    H    GLU  46           HN       GLU  46   9.407  17.470   1.096
 1093    HA   GLU  46           HA       GLU  46  11.460  18.407   3.048
 1094   1HB   GLU  46           HB2      GLU  46  10.261  20.321   3.192
 1095   2HB   GLU  46           HB1      GLU  46   8.952  19.652   2.227
 1096   1HG   GLU  46           HG2      GLU  46   8.050  20.203   4.391
 1097   2HG   GLU  46           HG1      GLU  46   8.155  18.446   4.299
 1098    H    ILE  47           HN       ILE  47   8.564  16.490   2.434
 1099    HA   ILE  47           HA       ILE  47   7.711  14.629   3.577
 1100    HB   ILE  47           HB       ILE  47  10.335  14.776   5.093
 1101   1HG1  ILE  47          HG12      ILE  47   9.505  13.373   2.539
 1102   2HG1  ILE  47          HG11      ILE  47  10.817  14.535   2.750
 1103   1HG2  ILE  47          HG21      ILE  47   8.500  13.415   6.141
 1104   2HG2  ILE  47          HG23      ILE  47   8.438  12.449   4.669
 1105   3HG2  ILE  47          HG22      ILE  47   9.898  12.456   5.657
 1106   1HD1  ILE  47          HD11      ILE  47  10.701  11.827   4.107
 1107   2HD1  ILE  47          HD13      ILE  47  11.617  12.166   2.640
 1108   3HD1  ILE  47          HD12      ILE  47  12.045  12.970   4.149
 1109    H    LYS  48           HN       LYS  48   6.108  14.790   5.057
 1110    HA   LYS  48           HA       LYS  48   6.422  16.769   7.254
 1111   1HB   LYS  48           HB2      LYS  48   4.332  16.290   5.511
 1112   2HB   LYS  48           HB1      LYS  48   3.816  15.444   6.971
 1113   1HG   LYS  48           HG2      LYS  48   4.965  17.982   7.697
 1114   2HG   LYS  48           HG1      LYS  48   3.723  18.234   6.470
 1115   1HD   LYS  48           HD2      LYS  48   2.175  16.799   7.834
 1116   2HD   LYS  48           HD1      LYS  48   3.404  16.755   9.098
 1117   1HE   LYS  48           HE2      LYS  48   2.799  19.464   8.112
 1118   2HE   LYS  48           HE1      LYS  48   1.439  18.666   8.902
 1119   1HZ   LYS  48           HZ3      LYS  48   3.285  18.055  10.633
 1120   2HZ   LYS  48           HZ2      LYS  48   4.042  19.438  10.002
 1121   3HZ   LYS  48           HZ1      LYS  48   2.496  19.555  10.695
 1122    H    GLU  49           HN       GLU  49   6.012  13.349   6.632
 1123    HA   GLU  49           HA       GLU  49   5.688  12.820   9.539
 1124   1HB   GLU  49           HB2      GLU  49   5.133  11.306   7.037
 1125   2HB   GLU  49           HB1      GLU  49   5.641  10.363   8.436
 1126   1HG   GLU  49           HG2      GLU  49   3.443  12.430   8.601
 1127   2HG   GLU  49           HG1      GLU  49   3.122  10.743   8.198
 1128    H    GLN  50           HN       GLN  50   8.043  13.693   9.621
 1129    HA   GLN  50           HA       GLN  50  10.224  12.249   8.544
 1130   1HB   GLN  50           HB2      GLN  50  10.499  14.417   9.673
 1131   2HB   GLN  50           HB1      GLN  50  10.039  13.683  11.209
 1132   1HG   GLN  50           HG2      GLN  50  11.979  12.098  10.952
 1133   2HG   GLN  50           HG1      GLN  50  12.484  13.036   9.545
 1134   1HE2  GLN  50          HE22      GLN  50  12.928  16.017  11.777
 1135   2HE2  GLN  50          HE21      GLN  50  11.924  15.666  10.454
 1136    H    GLU  51           HN       GLU  51   8.040  11.442  11.127
 1137    HA   GLU  51           HA       GLU  51   9.789   9.416  12.303
 1138   1HB   GLU  51           HB2      GLU  51   7.334  10.694  12.998
 1139   2HB   GLU  51           HB1      GLU  51   7.047   8.953  12.963
 1140   1HG   GLU  51           HG2      GLU  51   9.050   8.622  14.403
 1141   2HG   GLU  51           HG1      GLU  51   9.246  10.374  14.493
 1142    H    VAL  52           HN       VAL  52   7.212   9.502   9.896
 1143    HA   VAL  52           HA       VAL  52   6.846   6.637   9.781
 1144    HB   VAL  52           HB       VAL  52   6.268   8.765   7.694
 1145   1HG1  VAL  52          HG11      VAL  52   6.366   6.447   6.796
 1146   2HG1  VAL  52          HG13      VAL  52   5.182   5.948   8.005
 1147   3HG1  VAL  52          HG12      VAL  52   4.731   7.105   6.752
 1148   1HG2  VAL  52          HG23      VAL  52   5.184   8.723  10.129
 1149   2HG2  VAL  52          HG22      VAL  52   4.211   9.083   8.704
 1150   3HG2  VAL  52          HG21      VAL  52   4.187   7.464   9.403
 1151    H    VAL  53           HN       VAL  53   8.700   8.940   7.765
 1152    HA   VAL  53           HA       VAL  53   9.860   6.786   6.183
 1153    HB   VAL  53           HB       VAL  53  10.545   9.728   6.445
 1154   1HG1  VAL  53          HG11      VAL  53  11.732   7.545   4.724
 1155   2HG1  VAL  53          HG13      VAL  53  11.852   9.252   4.297
 1156   3HG1  VAL  53          HG12      VAL  53  12.577   8.664   5.792
 1157   1HG2  VAL  53          HG21      VAL  53   8.565   8.239   4.992
 1158   2HG2  VAL  53          HG23      VAL  53   8.852   9.980   4.981
 1159   3HG2  VAL  53          HG22      VAL  53   9.704   8.938   3.842
 1160    H    ASP  54           HN       ASP  54  10.755   8.599   9.050
 1161    HA   ASP  54           HA       ASP  54  13.485   7.554   9.090
 1162   1HB   ASP  54           HB2      ASP  54  12.919   9.736  10.136
 1163   2HB   ASP  54           HB1      ASP  54  11.876   8.897  11.285
 1164    H    LYS  55           HN       LYS  55  10.363   6.468  10.020
 1165    HA   LYS  55           HA       LYS  55  11.297   4.627  12.092
 1166   1HB   LYS  55           HB2      LYS  55   9.027   5.411  12.281
 1167   2HB   LYS  55           HB1      LYS  55   8.662   4.918  10.627
 1168   1HG   LYS  55           HG2      LYS  55   9.696   2.643  12.010
 1169   2HG   LYS  55           HG1      LYS  55   8.438   3.364  13.014
 1170   1HD   LYS  55           HD2      LYS  55   7.034   3.472  10.853
 1171   2HD   LYS  55           HD1      LYS  55   8.217   2.352  10.181
 1172   1HE   LYS  55           HE2      LYS  55   6.535   0.941  11.064
 1173   2HE   LYS  55           HE1      LYS  55   7.793   0.932  12.298
 1174   1HZ   LYS  55           HZ2      LYS  55   6.536   2.831  13.340
 1175   2HZ   LYS  55           HZ1      LYS  55   5.254   2.451  12.293
 1176   3HZ   LYS  55           HZ3      LYS  55   5.789   1.308  13.426
 1177    H    VAL  56           HN       VAL  56  10.106   4.299   8.730
 1178    HA   VAL  56           HA       VAL  56  10.771   1.467   8.639
 1179    HB   VAL  56           HB       VAL  56  10.492   1.918   6.097
 1180   1HG1  VAL  56          HG11      VAL  56   8.381   2.211   8.213
 1181   2HG1  VAL  56          HG13      VAL  56   7.942   2.331   6.510
 1182   3HG1  VAL  56          HG12      VAL  56   8.680   0.854   7.129
 1183   1HG2  VAL  56          HG21      VAL  56  10.636   4.558   6.966
 1184   2HG2  VAL  56          HG23      VAL  56  10.076   4.022   5.383
 1185   3HG2  VAL  56          HG22      VAL  56   8.916   4.306   6.679
 1186    H    MET  57           HN       MET  57  12.316   4.482   7.724
 1187    HA   MET  57           HA       MET  57  14.556   3.266   6.341
 1188   1HB   MET  57           HB2      MET  57  13.765   5.680   6.115
 1189   2HB   MET  57           HB1      MET  57  14.467   5.969   7.706
 1190   1HG   MET  57           HG2      MET  57  16.502   6.203   6.786
 1191   2HG   MET  57           HG1      MET  57  16.392   4.580   6.106
 1192   1HE   MET  57           HE1      MET  57  14.229   4.381   4.687
 1193   2HE   MET  57           HE3      MET  57  13.530   5.691   3.726
 1194   3HE   MET  57           HE2      MET  57  14.759   4.640   3.028
 1195    H    GLU  58           HN       GLU  58  13.702   3.851   9.647
 1196    HA   GLU  58           HA       GLU  58  16.414   3.719  10.694
 1197   1HB   GLU  58           HB2      GLU  58  13.674   3.879  11.798
 1198   2HB   GLU  58           HB1      GLU  58  14.824   2.998  12.801
 1199   1HG   GLU  58           HG2      GLU  58  16.306   4.871  12.914
 1200   2HG   GLU  58           HG1      GLU  58  15.432   5.726  11.643
 1201    H    THR  59           HN       THR  59  13.658   1.396  10.754
 1202    HA   THR  59           HA       THR  59  15.218  -0.781  11.764
 1203    HB   THR  59           HB       THR  59  12.941  -1.178   9.826
 1204    HG1  THR  59           HG1      THR  59  11.608  -0.266  11.151
 1205   1HG2  THR  59          HG22      THR  59  14.437  -2.795  11.640
 1206   2HG2  THR  59          HG21      THR  59  12.785  -2.689  12.245
 1207   3HG2  THR  59          HG23      THR  59  13.089  -3.277  10.611
 1208    H    LEU  60           HN       LEU  60  14.588   0.450   8.540
 1209    HA   LEU  60           HA       LEU  60  15.745  -1.590   6.968
 1210   1HB   LEU  60           HB2      LEU  60  15.367   1.371   6.684
 1211   2HB   LEU  60           HB1      LEU  60  16.390   0.547   5.513
 1212    HG   LEU  60           HG       LEU  60  13.569  -0.315   6.205
 1213   1HD1  LEU  60          HD11      LEU  60  14.495   1.859   4.576
 1214   2HD1  LEU  60          HD13      LEU  60  13.805   0.620   3.529
 1215   3HD1  LEU  60          HD12      LEU  60  12.840   1.309   4.831
 1216   1HD2  LEU  60          HD22      LEU  60  15.715  -1.608   4.873
 1217   2HD2  LEU  60          HD21      LEU  60  14.039  -2.145   4.980
 1218   3HD2  LEU  60          HD23      LEU  60  14.558  -1.134   3.630
 1219    H    ASP  61           HN       ASP  61  17.296   1.400   8.161
 1220    HA   ASP  61           HA       ASP  61  19.966   0.383   7.549
 1221   1HB   ASP  61           HB2      ASP  61  19.089   2.862   7.576
 1222   2HB   ASP  61           HB1      ASP  61  19.437   2.767   9.301
 1223    H    GLU  62           HN       GLU  62  17.820  -0.291   9.982
 1224    HA   GLU  62           HA       GLU  62  19.548  -0.171  12.292
 1225   1HB   GLU  62           HB2      GLU  62  17.079  -0.278  12.473
 1226   2HB   GLU  62           HB1      GLU  62  17.111  -1.908  11.800
 1227   1HG   GLU  62           HG2      GLU  62  18.995  -1.827  13.936
 1228   2HG   GLU  62           HG1      GLU  62  17.494  -1.111  14.522
 1229    H    ASP  63           HN       ASP  63  18.948  -2.563   9.787
 1230    HA   ASP  63           HA       ASP  63  21.160  -4.185  10.956
 1231   1HB   ASP  63           HB2      ASP  63  18.446  -4.971  10.766
 1232   2HB   ASP  63           HB1      ASP  63  19.315  -5.862   9.517
 1233    H    GLY  64           HN       GLY  64  19.115  -4.029   8.032
 1234   1HA   GLY  64           HA2      GLY  64  19.786  -3.745   5.784
 1235   2HA   GLY  64           HA1      GLY  64  21.435  -3.492   6.349
 1236    H    ASP  65           HN       ASP  65  20.602  -6.242   7.871
 1237    HA   ASP  65           HA       ASP  65  21.269  -7.998   5.554
 1238   1HB   ASP  65           HB2      ASP  65  23.214  -7.375   7.185
 1239   2HB   ASP  65           HB1      ASP  65  22.416  -8.495   8.289
 1240    H    GLY  66           HN       GLY  66  18.684  -7.540   6.740
 1241   1HA   GLY  66           HA2      GLY  66  18.226 -10.195   8.022
 1242   2HA   GLY  66           HA1      GLY  66  17.292  -8.764   8.450
 1243    H    GLU  67           HN       GLU  67  15.561 -10.484   7.781
 1244    HA   GLU  67           HA       GLU  67  15.085 -10.240   4.838
 1245   1HB   GLU  67           HB2      GLU  67  13.802 -12.322   6.605
 1246   2HB   GLU  67           HB1      GLU  67  14.011 -12.344   4.855
 1247   1HG   GLU  67           HG2      GLU  67  16.393 -12.662   5.070
 1248   2HG   GLU  67           HG1      GLU  67  16.319 -12.405   6.813
 1249    H    CYS  68           HN       CYS  68  12.806  -9.963   4.219
 1250    HA   CYS  68           HA       CYS  68  11.138  -8.778   6.399
 1251   1HB   CYS  68           HB2      CYS  68  11.700  -7.714   3.625
 1252   2HB   CYS  68           HB1      CYS  68  10.296  -7.198   4.557
 1253    HG   CYS  68           HG       CYS  68  11.851  -5.604   5.640
 1254    H    ASP  69           HN       ASP  69   8.771  -8.469   5.342
 1255    HA   ASP  69           HA       ASP  69   8.155 -11.066   3.982
 1256   1HB   ASP  69           HB2      ASP  69   6.575  -9.512   6.045
 1257   2HB   ASP  69           HB1      ASP  69   5.896 -10.845   5.113
 1258    H    PHE  70           HN       PHE  70   5.876 -10.864   2.872
 1259    HA   PHE  70           HA       PHE  70   6.100  -8.718   0.925
 1260   1HB   PHE  70           HB2      PHE  70   4.115  -9.713  -0.093
 1261   2HB   PHE  70           HB1      PHE  70   5.240 -10.993   0.359
 1262    HD1  PHE  70           HD1      PHE  70   4.843 -12.334   2.443
 1263    HD2  PHE  70           HD2      PHE  70   1.961  -9.527   0.938
 1264    HE1  PHE  70           HE1      PHE  70   3.093 -13.374   3.856
 1265    HE2  PHE  70           HE2      PHE  70   0.211 -10.571   2.350
 1266    HZ   PHE  70           HZ       PHE  70   0.777 -12.495   3.809
 1267    H    GLN  71           HN       GLN  71   4.195  -9.313   3.810
 1268    HA   GLN  71           HA       GLN  71   2.368  -7.080   3.312
 1269   1HB   GLN  71           HB2      GLN  71   2.898  -8.925   5.640
 1270   2HB   GLN  71           HB1      GLN  71   1.876  -7.502   5.833
 1271   1HG   GLN  71           HG2      GLN  71   1.127  -8.869   3.422
 1272   2HG   GLN  71           HG1      GLN  71   1.145 -10.024   4.756
 1273   1HE2  GLN  71          HE22      GLN  71  -1.200  -6.728   5.468
 1274   2HE2  GLN  71          HE21      GLN  71   0.380  -6.518   4.889
 1275    H    GLU  72           HN       GLU  72   5.492  -7.557   4.735
 1276    HA   GLU  72           HA       GLU  72   5.456  -5.100   6.307
 1277   1HB   GLU  72           HB2      GLU  72   7.386  -7.270   5.694
 1278   2HB   GLU  72           HB1      GLU  72   8.096  -5.694   6.044
 1279   1HG   GLU  72           HG2      GLU  72   5.992  -6.159   7.922
 1280   2HG   GLU  72           HG1      GLU  72   7.023  -7.588   7.890
 1281    H    PHE  73           HN       PHE  73   7.049  -6.129   3.272
 1282    HA   PHE  73           HA       PHE  73   8.089  -3.512   2.687
 1283   1HB   PHE  73           HB2      PHE  73   9.169  -4.749   1.136
 1284   2HB   PHE  73           HB1      PHE  73   8.133  -6.124   1.493
 1285    HD1  PHE  73           HD2      PHE  73   5.848  -6.244   0.330
 1286    HD2  PHE  73           HD1      PHE  73   8.987  -3.590  -0.918
 1287    HE1  PHE  73           HE2      PHE  73   4.759  -5.999  -1.882
 1288    HE2  PHE  73           HE1      PHE  73   7.897  -3.343  -3.131
 1289    HZ   PHE  73           HZ       PHE  73   5.783  -4.547  -3.613
 1290    H    MET  74           HN       MET  74   4.979  -5.002   2.324
 1291    HA   MET  74           HA       MET  74   3.968  -3.141   0.331
 1292   1HB   MET  74           HB2      MET  74   2.993  -5.455   1.791
 1293   2HB   MET  74           HB1      MET  74   1.791  -4.168   1.787
 1294   1HG   MET  74           HG2      MET  74   3.114  -4.539  -0.808
 1295   2HG   MET  74           HG1      MET  74   2.200  -5.950  -0.275
 1296   1HE   MET  74           HE1      MET  74   2.581  -2.774  -1.539
 1297   2HE   MET  74           HE3      MET  74   1.252  -2.952  -2.692
 1298   3HE   MET  74           HE2      MET  74   1.124  -1.802  -1.364
 1299    H    ALA  75           HN       ALA  75   3.449  -3.496   3.860
 1300    HA   ALA  75           HA       ALA  75   2.008  -0.992   4.049
 1301   1HB   ALA  75           HB2      ALA  75   3.413  -2.634   6.182
 1302   2HB   ALA  75           HB1      ALA  75   2.324  -1.283   6.500
 1303   3HB   ALA  75           HB3      ALA  75   1.710  -2.751   5.737
 1304    H    PHE  76           HN       PHE  76   5.310  -1.829   3.773
 1305    HA   PHE  76           HA       PHE  76   6.361   0.546   5.120
 1306   1HB   PHE  76           HB2      PHE  76   7.447  -1.835   3.769
 1307   2HB   PHE  76           HB1      PHE  76   8.390  -0.368   3.503
 1308    HD1  PHE  76           HD2      PHE  76   6.343  -1.277   6.484
 1309    HD2  PHE  76           HD1      PHE  76  10.285  -0.689   4.888
 1310    HE1  PHE  76           HE2      PHE  76   7.296  -1.476   8.765
 1311    HE2  PHE  76           HE1      PHE  76  11.239  -0.888   7.167
 1312    HZ   PHE  76           HZ       PHE  76   9.744  -1.281   9.106
 1313    H    VAL  77           HN       VAL  77   5.851  -0.505   1.749
 1314    HA   VAL  77           HA       VAL  77   6.956   1.877   0.567
 1315    HB   VAL  77           HB       VAL  77   4.919  -0.094  -0.513
 1316   1HG1  VAL  77          HG11      VAL  77   5.021   2.216  -1.608
 1317   2HG1  VAL  77          HG13      VAL  77   6.673   1.813  -2.075
 1318   3HG1  VAL  77          HG12      VAL  77   5.325   0.843  -2.672
 1319   1HG2  VAL  77          HG21      VAL  77   7.302  -0.856   0.160
 1320   2HG2  VAL  77          HG23      VAL  77   6.753  -1.242  -1.471
 1321   3HG2  VAL  77          HG22      VAL  77   7.848   0.116  -1.208
 1322    H    SER  78           HN       SER  78   3.796   1.072   1.866
 1323    HA   SER  78           HA       SER  78   2.457   3.358   0.662
 1324   1HB   SER  78           HB2      SER  78   1.565   1.836   3.115
 1325   2HB   SER  78           HB1      SER  78   0.564   2.721   1.969
 1326    HG   SER  78           HG       SER  78   1.693   1.100   0.435
 1327    H    MET  79           HN       MET  79   3.956   2.672   3.806
 1328    HA   MET  79           HA       MET  79   3.144   5.042   5.140
 1329   1HB   MET  79           HB2      MET  79   5.652   3.375   5.426
 1330   2HB   MET  79           HB1      MET  79   5.161   4.627   6.557
 1331   1HG   MET  79           HG2      MET  79   2.938   2.868   6.049
 1332   2HG   MET  79           HG1      MET  79   4.342   1.924   6.546
 1333   1HE   MET  79           HE2      MET  79   5.206   1.617   8.306
 1334   2HE   MET  79           HE1      MET  79   5.260   2.549   9.799
 1335   3HE   MET  79           HE3      MET  79   3.942   1.403   9.514
 1336    H    VAL  80           HN       VAL  80   6.163   4.376   3.336
 1337    HA   VAL  80           HA       VAL  80   7.143   7.066   3.606
 1338    HB   VAL  80           HB       VAL  80   8.610   6.311   1.604
 1339   1HG1  VAL  80          HG13      VAL  80   8.520   5.051   4.338
 1340   2HG1  VAL  80          HG12      VAL  80   9.794   4.633   3.194
 1341   3HG1  VAL  80          HG11      VAL  80   9.610   6.301   3.736
 1342   1HG2  VAL  80          HG22      VAL  80   6.683   4.278   1.548
 1343   2HG2  VAL  80          HG21      VAL  80   8.208   4.296   0.669
 1344   3HG2  VAL  80          HG23      VAL  80   8.111   3.520   2.249
 1345    H    THR  81           HN       THR  81   5.288   5.406   1.053
 1346    HA   THR  81           HA       THR  81   5.395   7.604  -0.806
 1347    HB   THR  81           HB       THR  81   3.198   5.528  -0.569
 1348    HG1  THR  81           HG1      THR  81   5.841   5.341  -1.302
 1349   1HG2  THR  81          HG22      THR  81   3.068   7.625  -2.124
 1350   2HG2  THR  81          HG21      THR  81   4.269   6.769  -3.090
 1351   3HG2  THR  81          HG23      THR  81   2.690   6.039  -2.797
 1352    H    THR  82           HN       THR  82   3.751   7.180   2.151
 1353    HA   THR  82           HA       THR  82   1.730   9.248   1.425
 1354    HB   THR  82           HB       THR  82   0.871   8.604   3.804
 1355    HG1  THR  82           HG1      THR  82   2.476   7.358   4.557
 1356   1HG2  THR  82          HG22      THR  82   0.190   7.826   1.288
 1357   2HG2  THR  82          HG21      THR  82   0.547   6.265   2.028
 1358   3HG2  THR  82          HG23      THR  82  -0.675   7.318   2.737
 1359    H    ALA  83           HN       ALA  83   4.714   8.828   3.008
 1360    HA   ALA  83           HA       ALA  83   4.334  11.025   4.919
 1361   1HB   ALA  83           HB2      ALA  83   6.501   9.098   4.245
 1362   2HB   ALA  83           HB1      ALA  83   6.996  10.642   4.938
 1363   3HB   ALA  83           HB3      ALA  83   5.888   9.592   5.822
 1364    H    CYS  84           HN       CYS  84   3.773  11.879   2.301
 1365    HA   CYS  84           HA       CYS  84   6.128  13.183   1.169
 1366   1HB   CYS  84           HB2      CYS  84   3.219  13.760   0.560
 1367   2HB   CYS  84           HB1      CYS  84   4.613  14.095  -0.465
 1368    HG   CYS  84           HG       CYS  84   3.180  11.425  -0.270
 1369    H    HIS  85           HN       HIS  85   5.447  15.732   0.611
 1370    HA   HIS  85           HA       HIS  85   5.591  17.001   3.253
 1371   1HB   HIS  85           HB2      HIS  85   7.056  17.821   1.483
 1372   2HB   HIS  85           HB1      HIS  85   5.669  18.161   0.451
 1373    HD1  HIS  85           HD1      HIS  85   6.138  18.965   4.145
 1374    HD2  HIS  85           HD2      HIS  85   5.530  20.931   0.520
 1375    HE1  HIS  85           HE1      HIS  85   5.838  21.418   4.700
 1376    H    GLU  86           HN       GLU  86   3.888  18.631   0.666
 1377    HA   GLU  86           HA       GLU  86   1.669  19.224   2.426
 1378   1HB   GLU  86           HB2      GLU  86   2.619  20.089  -0.164
 1379   2HB   GLU  86           HB1      GLU  86   0.887  19.764  -0.228
 1380   1HG   GLU  86           HG2      GLU  86   0.878  21.962   0.524
 1381   2HG   GLU  86           HG1      GLU  86   0.875  21.092   2.058
 1382    H    PHE  87           HN       PHE  87   1.138  18.018  -0.857
 1383    HA   PHE  87           HA       PHE  87   0.007  15.491   0.021
 1384   1HB   PHE  87           HB2      PHE  87  -1.675  17.504   0.549
 1385   2HB   PHE  87           HB1      PHE  87  -2.078  17.272  -1.152
 1386    HD1  PHE  87           HD1      PHE  87  -1.661  15.416   2.068
 1387    HD2  PHE  87           HD2      PHE  87  -3.486  15.506  -1.817
 1388    HE1  PHE  87           HE1      PHE  87  -3.019  13.428   2.658
 1389    HE2  PHE  87           HE2      PHE  87  -4.843  13.517  -1.225
 1390    HZ   PHE  87           HZ       PHE  87  -4.610  12.478   1.012
 1391    H    PHE  88           HN       PHE  88   1.459  14.855  -1.716
 1392    HA   PHE  88           HA       PHE  88   1.855  14.155  -3.913
 1393   1HB   PHE  88           HB2      PHE  88  -0.940  15.140  -4.457
 1394   2HB   PHE  88           HB1      PHE  88  -0.062  13.885  -5.328
 1395    HD1  PHE  88           HD1      PHE  88   1.180  12.682  -2.728
 1396    HD2  PHE  88           HD2      PHE  88  -2.829  13.706  -3.877
 1397    HE1  PHE  88           HE1      PHE  88   0.293  10.989  -1.147
 1398    HE2  PHE  88           HE2      PHE  88  -3.715  12.012  -2.297
 1399    HZ   PHE  88           HZ       PHE  88  -2.154  10.652  -0.933
 1400    H    GLU  89           HN       GLU  89   2.490  16.891  -3.085
 1401    HA   GLU  89           HA       GLU  89   3.276  18.858  -4.076
 1402   1HB   GLU  89           HB2      GLU  89   3.865  16.918  -5.792
 1403   2HB   GLU  89           HB1      GLU  89   2.712  17.791  -6.801
 1404   1HG   GLU  89           HG2      GLU  89   3.992  19.806  -6.691
 1405   2HG   GLU  89           HG1      GLU  89   4.997  19.178  -5.385
 1406    H    HIS  90           HN       HIS  90   0.170  17.966  -4.068
 1407    HA   HIS  90           HA       HIS  90  -1.858  18.903  -4.851
 1408   1HB   HIS  90           HB2      HIS  90  -0.497  20.554  -3.146
 1409   2HB   HIS  90           HB1      HIS  90  -0.766  21.624  -4.522
 1410    HD1  HIS  90           HD1      HIS  90  -2.687  19.419  -2.103
 1411    HD2  HIS  90           HD2      HIS  90  -3.404  22.505  -4.813
 1412    HE1  HIS  90           HE1      HIS  90  -5.104  20.104  -1.786
 1413    H    GLU  91           HN       GLU  91   0.184  18.509  -6.995
 1414    HA   GLU  91           HA       GLU  91  -1.164  19.911  -9.097
 1415   1HB   GLU  91           HB2      GLU  91   0.633  21.550  -7.772
 1416   2HB   GLU  91           HB1      GLU  91   1.578  20.955  -9.135
 1417   1HG   GLU  91           HG2      GLU  91   0.427  22.236 -10.588
 1418   2HG   GLU  91           HG1      GLU  91  -1.116  21.658  -9.962
   
  No H/Q in entry =        1418
  Start of MODEL    9
    1   1H    MET   0           HT2      MET   0   9.340   5.174 -14.727
    2   2H    MET   0           HT1      MET   0   8.585   5.561 -16.201
    3   3H    MET   0           HT3      MET   0   7.794   4.563 -15.078
    4    HA   MET   0           HA       MET   0   8.647   3.192 -16.825
    5   1HB   MET   0           HB2      MET   0  11.130   3.143 -17.191
    6   2HB   MET   0           HB1      MET   0  10.386   4.673 -17.660
    7   1HG   MET   0           HG2      MET   0  11.336   5.832 -15.913
    8   2HG   MET   0           HG1      MET   0  11.345   4.425 -14.847
    9   1HE   MET   0           HE3      MET   0  12.867   6.799 -16.607
   10   2HE   MET   0           HE2      MET   0  14.352   6.511 -15.704
   11   3HE   MET   0           HE1      MET   0  14.329   6.262 -17.448
   12    H    SER   1           HN       SER   1   7.970   2.969 -14.055
   13    HA   SER   1           HA       SER   1   9.736   0.690 -13.339
   14   1HB   SER   1           HB2      SER   1  10.724   2.212 -11.887
   15   2HB   SER   1           HB1      SER   1   9.250   3.158 -11.710
   16    HG   SER   1           HG       SER   1   9.964   0.699 -10.522
   17    H    GLU   2           HN       GLU   2   8.658  -0.873 -11.978
   18    HA   GLU   2           HA       GLU   2   5.794  -1.017 -12.433
   19   1HB   GLU   2           HB2      GLU   2   7.463  -2.727 -10.568
   20   2HB   GLU   2           HB1      GLU   2   5.908  -3.143 -11.286
   21   1HG   GLU   2           HG2      GLU   2   8.394  -2.557 -12.909
   22   2HG   GLU   2           HG1      GLU   2   7.905  -4.183 -12.429
   23    H    LEU   3           HN       LEU   3   7.850  -0.456  -9.585
   24    HA   LEU   3           HA       LEU   3   5.709  -0.299  -7.687
   25   1HB   LEU   3           HB2      LEU   3   8.361  -0.385  -7.422
   26   2HB   LEU   3           HB1      LEU   3   8.160   1.363  -7.319
   27    HG   LEU   3           HG       LEU   3   6.233   0.763  -5.637
   28   1HD1  LEU   3          HD11      LEU   3   7.931  -1.738  -5.706
   29   2HD1  LEU   3          HD13      LEU   3   6.921  -1.313  -4.325
   30   3HD1  LEU   3          HD12      LEU   3   6.184  -1.612  -5.899
   31   1HD2  LEU   3          HD23      LEU   3   9.150   1.068  -5.331
   32   2HD2  LEU   3          HD22      LEU   3   7.840   1.908  -4.502
   33   3HD2  LEU   3          HD21      LEU   3   8.364   0.321  -3.939
   34    H    GLU   4           HN       GLU   4   7.299   2.153  -9.698
   35    HA   GLU   4           HA       GLU   4   5.971   4.381  -8.485
   36   1HB   GLU   4           HB2      GLU   4   7.904   4.836  -9.820
   37   2HB   GLU   4           HB1      GLU   4   7.221   4.000 -11.214
   38   1HG   GLU   4           HG2      GLU   4   5.388   6.045 -10.357
   39   2HG   GLU   4           HG1      GLU   4   6.989   6.754 -10.568
   40    H    LYS   5           HN       LYS   5   5.231   2.745 -11.596
   41    HA   LYS   5           HA       LYS   5   2.802   4.185 -12.000
   42   1HB   LYS   5           HB2      LYS   5   2.232   2.419 -13.613
   43   2HB   LYS   5           HB1      LYS   5   3.922   2.889 -13.791
   44   1HG   LYS   5           HG2      LYS   5   4.455   0.954 -12.181
   45   2HG   LYS   5           HG1      LYS   5   2.804   0.408 -12.479
   46   1HD   LYS   5           HD2      LYS   5   4.184   1.095 -14.955
   47   2HD   LYS   5           HD1      LYS   5   5.028  -0.168 -14.060
   48   1HE   LYS   5           HE2      LYS   5   2.801  -1.357 -13.836
   49   2HE   LYS   5           HE1      LYS   5   2.141  -0.178 -14.972
   50   1HZ   LYS   5           HZ3      LYS   5   4.587  -1.257 -15.928
   51   2HZ   LYS   5           HZ2      LYS   5   3.482  -2.502 -15.589
   52   3HZ   LYS   5           HZ1      LYS   5   3.059  -1.254 -16.662
   53    H    ALA   6           HN       ALA   6   3.547   1.358 -10.057
   54    HA   ALA   6           HA       ALA   6   0.735   0.684  -9.651
   55   1HB   ALA   6           HB3      ALA   6   2.953  -0.808  -9.458
   56   2HB   ALA   6           HB2      ALA   6   2.825  -0.311  -7.775
   57   3HB   ALA   6           HB1      ALA   6   1.500  -1.182  -8.535
   58    H    MET   7           HN       MET   7   3.177   1.377  -7.186
   59    HA   MET   7           HA       MET   7   1.465   2.144  -5.134
   60   1HB   MET   7           HB2      MET   7   3.696   1.902  -4.494
   61   2HB   MET   7           HB1      MET   7   4.294   2.843  -5.864
   62   1HG   MET   7           HG2      MET   7   4.457   4.018  -3.626
   63   2HG   MET   7           HG1      MET   7   3.555   4.909  -4.852
   64   1HE   MET   7           HE2      MET   7   3.544   2.534  -1.962
   65   2HE   MET   7           HE1      MET   7   1.898   2.491  -1.335
   66   3HE   MET   7           HE3      MET   7   2.291   1.677  -2.856
   67    H    VAL   8           HN       VAL   8   3.092   4.346  -7.433
   68    HA   VAL   8           HA       VAL   8   1.745   6.687  -6.517
   69    HB   VAL   8           HB       VAL   8   2.711   6.252  -9.347
   70   1HG1  VAL   8          HG13      VAL   8   2.428   8.639  -7.507
   71   2HG1  VAL   8          HG12      VAL   8   3.308   8.693  -9.035
   72   3HG1  VAL   8          HG11      VAL   8   1.578   8.354  -9.025
   73   1HG2  VAL   8          HG22      VAL   8   4.228   6.620  -6.776
   74   2HG2  VAL   8          HG21      VAL   8   4.600   5.574  -8.142
   75   3HG2  VAL   8          HG23      VAL   8   4.860   7.308  -8.272
   76    H    ALA   9           HN       ALA   9   0.735   4.176  -8.802
   77    HA   ALA   9           HA       ALA   9  -1.406   5.691  -9.993
   78   1HB   ALA   9           HB1      ALA   9  -0.781   2.771  -9.714
   79   2HB   ALA   9           HB3      ALA   9  -2.403   3.247 -10.215
   80   3HB   ALA   9           HB2      ALA   9  -1.007   3.733 -11.174
   81    H    LEU  10           HN       LEU  10  -1.176   3.724  -7.052
   82    HA   LEU  10           HA       LEU  10  -3.923   3.655  -6.362
   83   1HB   LEU  10           HB2      LEU  10  -1.376   3.259  -5.004
   84   2HB   LEU  10           HB1      LEU  10  -2.549   4.049  -3.950
   85    HG   LEU  10           HG       LEU  10  -3.588   1.793  -5.567
   86   1HD1  LEU  10          HD13      LEU  10  -1.153   1.341  -4.446
   87   2HD1  LEU  10          HD12      LEU  10  -2.204   0.961  -3.082
   88   3HD1  LEU  10          HD11      LEU  10  -2.393   0.099  -4.608
   89   1HD2  LEU  10          HD21      LEU  10  -4.665   3.272  -3.655
   90   2HD2  LEU  10          HD23      LEU  10  -5.026   1.549  -3.752
   91   3HD2  LEU  10          HD22      LEU  10  -3.832   2.134  -2.595
   92    H    ILE  11           HN       ILE  11  -1.443   6.101  -5.515
   93    HA   ILE  11           HA       ILE  11  -3.072   7.892  -4.101
   94    HB   ILE  11           HB       ILE  11  -0.866   8.471  -6.104
   95   1HG1  ILE  11          HG12      ILE  11  -0.239   7.172  -4.074
   96   2HG1  ILE  11          HG11      ILE  11   0.495   8.775  -4.084
   97   1HG2  ILE  11          HG21      ILE  11  -2.351  10.290  -4.192
   98   2HG2  ILE  11          HG23      ILE  11  -0.779  10.696  -4.879
   99   3HG2  ILE  11          HG22      ILE  11  -2.171  10.480  -5.937
  100   1HD1  ILE  11          HD12      ILE  11  -1.625   9.494  -2.746
  101   2HD1  ILE  11          HD11      ILE  11  -1.812   7.770  -2.431
  102   3HD1  ILE  11          HD13      ILE  11  -0.356   8.609  -1.899
  103    H    ASP  12           HN       ASP  12  -2.859   7.281  -7.558
  104    HA   ASP  12           HA       ASP  12  -4.381   9.469  -8.531
  105   1HB   ASP  12           HB2      ASP  12  -3.128   7.649  -9.854
  106   2HB   ASP  12           HB1      ASP  12  -4.566   6.659  -9.633
  107    H    VAL  13           HN       VAL  13  -5.485   6.180  -7.642
  108    HA   VAL  13           HA       VAL  13  -8.236   6.518  -7.997
  109    HB   VAL  13           HB       VAL  13  -6.879   5.073  -5.692
  110   1HG1  VAL  13          HG11      VAL  13  -9.513   5.650  -5.856
  111   2HG1  VAL  13          HG13      VAL  13  -9.475   4.194  -6.851
  112   3HG1  VAL  13          HG12      VAL  13  -8.913   4.134  -5.179
  113   1HG2  VAL  13          HG22      VAL  13  -6.617   4.580  -8.394
  114   2HG2  VAL  13          HG21      VAL  13  -6.417   3.374  -7.122
  115   3HG2  VAL  13          HG23      VAL  13  -7.966   3.536  -7.948
  116    H    PHE  14           HN       PHE  14  -6.171   7.802  -5.458
  117    HA   PHE  14           HA       PHE  14  -8.203   8.583  -3.616
  118   1HB   PHE  14           HB2      PHE  14  -5.460   8.780  -3.695
  119   2HB   PHE  14           HB1      PHE  14  -5.954  10.464  -3.884
  120    HD1  PHE  14           HD1      PHE  14  -7.445   7.591  -1.988
  121    HD2  PHE  14           HD2      PHE  14  -5.784  11.548  -1.819
  122    HE1  PHE  14           HE1      PHE  14  -7.976   7.709   0.431
  123    HE2  PHE  14           HE2      PHE  14  -6.314  11.665   0.602
  124    HZ   PHE  14           HZ       PHE  14  -7.410   9.745   1.727
  125    H    HIS  15           HN       HIS  15  -6.708  10.384  -6.320
  126    HA   HIS  15           HA       HIS  15  -8.301  12.746  -5.983
  127   1HB   HIS  15           HB2      HIS  15  -6.508  11.626  -8.055
  128   2HB   HIS  15           HB1      HIS  15  -7.743  12.733  -8.657
  129    HD1  HIS  15           HD1      HIS  15  -7.867  15.107  -7.290
  130    HD2  HIS  15           HD2      HIS  15  -4.342  12.914  -6.915
  131    HE1  HIS  15           HE1      HIS  15  -6.115  16.714  -6.422
  132    H    GLN  16           HN       GLN  16  -9.146   9.629  -6.998
  133    HA   GLN  16           HA       GLN  16 -11.374  10.565  -8.712
  134   1HB   GLN  16           HB2      GLN  16  -9.786   8.279  -8.732
  135   2HB   GLN  16           HB1      GLN  16 -11.320   7.712  -8.072
  136   1HG   GLN  16           HG2      GLN  16 -11.324   7.552 -10.527
  137   2HG   GLN  16           HG1      GLN  16 -12.511   8.738  -9.984
  138   1HE2  GLN  16          HE22      GLN  16  -9.119  10.059 -11.901
  139   2HE2  GLN  16          HE21      GLN  16  -9.115   8.527 -11.170
  140    H    TYR  17           HN       TYR  17 -11.253   8.092  -6.134
  141    HA   TYR  17           HA       TYR  17 -14.000   8.504  -5.398
  142   1HB   TYR  17           HB2      TYR  17 -11.699   7.130  -3.984
  143   2HB   TYR  17           HB1      TYR  17 -13.353   7.122  -3.371
  144    HD1  TYR  17           HD2      TYR  17 -11.273   6.234  -6.345
  145    HD2  TYR  17           HD1      TYR  17 -14.957   5.610  -4.224
  146    HE1  TYR  17           HE2      TYR  17 -11.828   4.354  -7.864
  147    HE2  TYR  17           HE1      TYR  17 -15.510   3.730  -5.743
  148    HH   TYR  17           HH       TYR  17 -13.258   2.281  -7.772
  149    H    SER  18           HN       SER  18 -10.954   9.400  -3.733
  150    HA   SER  18           HA       SER  18 -12.447  11.057  -1.821
  151   1HB   SER  18           HB2      SER  18 -10.544  10.009  -0.875
  152   2HB   SER  18           HB1      SER  18  -9.524  10.432  -2.246
  153    HG   SER  18           HG       SER  18  -9.098  11.833  -0.548
  154    H    GLY  19           HN       GLY  19 -11.448  11.500  -4.969
  155   1HA   GLY  19           HA2      GLY  19 -10.980  14.411  -4.558
  156   2HA   GLY  19           HA1      GLY  19 -10.455  13.514  -5.981
  157    H    ARG  20           HN       ARG  20 -13.631  13.343  -4.400
  158    HA   ARG  20           HA       ARG  20 -14.811  14.642  -6.819
  159   1HB   ARG  20           HB2      ARG  20 -16.689  12.924  -6.590
  160   2HB   ARG  20           HB1      ARG  20 -15.153  12.306  -7.197
  161   1HG   ARG  20           HG2      ARG  20 -14.868  10.967  -5.399
  162   2HG   ARG  20           HG1      ARG  20 -15.292  12.260  -4.278
  163   1HD   ARG  20           HD2      ARG  20 -17.188  11.078  -3.904
  164   2HD   ARG  20           HD1      ARG  20 -17.714  11.691  -5.473
  165    HE   ARG  20           HE       ARG  20 -16.225   9.421  -6.082
  166   1HH1  ARG  20          HH21      ARG  20 -19.323  10.336  -5.124
  167   2HH1  ARG  20          HH22      ARG  20 -19.883   8.728  -4.806
  168   1HH2  ARG  20          HH11      ARG  20 -16.764   7.271  -5.222
  169   2HH2  ARG  20          HH12      ARG  20 -18.435   6.992  -4.863
  170    H    GLU  21           HN       GLU  21 -14.476  14.765  -3.535
  171    HA   GLU  21           HA       GLU  21 -16.620  16.671  -3.224
  172   1HB   GLU  21           HB2      GLU  21 -17.358  13.980  -2.910
  173   2HB   GLU  21           HB1      GLU  21 -17.177  14.603  -1.268
  174   1HG   GLU  21           HG2      GLU  21 -18.690  16.414  -1.704
  175   2HG   GLU  21           HG1      GLU  21 -18.728  16.038  -3.427
  176    H    GLY  22           HN       GLY  22 -14.800  14.289  -1.272
  177   1HA   GLY  22           HA2      GLY  22 -14.462  15.898   1.023
  178   2HA   GLY  22           HA1      GLY  22 -13.347  14.618   0.543
  179    H    ASP  23           HN       ASP  23 -11.676  16.129   1.413
  180    HA   ASP  23           HA       ASP  23 -11.167  18.553  -0.183
  181   1HB   ASP  23           HB2      ASP  23 -10.372  17.534   2.411
  182   2HB   ASP  23           HB1      ASP  23  -8.960  18.049   1.487
  183    H    LYS  24           HN       LYS  24 -10.963  15.746  -1.337
  184    HA   LYS  24           HA       LYS  24  -9.560  14.651  -2.867
  185   1HB   LYS  24           HB2      LYS  24  -7.712  17.010  -2.882
  186   2HB   LYS  24           HB1      LYS  24  -8.262  16.016  -4.230
  187   1HG   LYS  24           HG2      LYS  24 -10.602  16.986  -3.768
  188   2HG   LYS  24           HG1      LYS  24  -9.780  18.181  -2.767
  189   1HD   LYS  24           HD2      LYS  24  -8.241  18.345  -4.971
  190   2HD   LYS  24           HD1      LYS  24  -9.758  17.854  -5.724
  191   1HE   LYS  24           HE2      LYS  24  -9.589  20.131  -3.740
  192   2HE   LYS  24           HE1      LYS  24  -9.412  20.371  -5.477
  193   1HZ   LYS  24           HZ3      LYS  24 -11.697  18.786  -4.674
  194   2HZ   LYS  24           HZ2      LYS  24 -11.752  20.413  -4.192
  195   3HZ   LYS  24           HZ1      LYS  24 -11.583  20.017  -5.835
  196    H    HIS  25           HN       HIS  25  -8.938  14.889   0.163
  197    HA   HIS  25           HA       HIS  25  -6.383  13.434  -0.012
  198   1HB   HIS  25           HB2      HIS  25  -6.697  16.068   1.435
  199   2HB   HIS  25           HB1      HIS  25  -5.440  14.906   1.861
  200    HD1  HIS  25           HD1      HIS  25  -5.970  17.739  -0.253
  201    HD2  HIS  25           HD2      HIS  25  -3.908  14.140  -0.691
  202    HE1  HIS  25           HE1      HIS  25  -4.325  18.083  -2.148
  203    H    LYS  26           HN       LYS  26  -9.330  13.224   0.920
  204    HA   LYS  26           HA       LYS  26  -8.685  11.709   3.375
  205   1HB   LYS  26           HB2      LYS  26 -10.749  13.935   3.307
  206   2HB   LYS  26           HB1      LYS  26 -10.549  12.784   4.632
  207   1HG   LYS  26           HG2      LYS  26  -8.170  13.540   4.855
  208   2HG   LYS  26           HG1      LYS  26  -8.492  14.778   3.641
  209   1HD   LYS  26           HD2      LYS  26 -10.336  15.650   5.101
  210   2HD   LYS  26           HD1      LYS  26  -9.842  14.493   6.341
  211   1HE   LYS  26           HE2      LYS  26  -7.555  15.494   6.308
  212   2HE   LYS  26           HE1      LYS  26  -8.136  16.707   5.164
  213   1HZ   LYS  26           HZ1      LYS  26  -9.443  16.260   7.782
  214   2HZ   LYS  26           HZ3      LYS  26  -8.144  17.334   7.600
  215   3HZ   LYS  26           HZ2      LYS  26  -9.588  17.600   6.745
  216    H    LEU  27           HN       LEU  27  -9.807   9.820   3.336
  217    HA   LEU  27           HA       LEU  27 -12.054   9.607   1.388
  218   1HB   LEU  27           HB2      LEU  27  -9.800   7.965   1.932
  219   2HB   LEU  27           HB1      LEU  27 -11.225   7.068   2.457
  220    HG   LEU  27           HG       LEU  27 -11.300   8.477  -0.187
  221   1HD1  LEU  27          HD13      LEU  27  -9.559   6.195   0.544
  222   2HD1  LEU  27          HD12      LEU  27 -10.536   5.964  -0.905
  223   3HD1  LEU  27          HD11      LEU  27  -9.425   7.329  -0.801
  224   1HD2  LEU  27          HD22      LEU  27 -12.507   5.968   1.008
  225   2HD2  LEU  27          HD21      LEU  27 -13.344   7.460   0.572
  226   3HD2  LEU  27          HD23      LEU  27 -12.689   6.416  -0.690
  227    H    LYS  28           HN       LYS  28 -13.088   7.181   2.548
  228    HA   LYS  28           HA       LYS  28 -13.953   7.966   5.271
  229   1HB   LYS  28           HB2      LYS  28 -15.618   8.080   2.839
  230   2HB   LYS  28           HB1      LYS  28 -16.342   7.175   4.170
  231   1HG   LYS  28           HG2      LYS  28 -15.407   9.315   5.534
  232   2HG   LYS  28           HG1      LYS  28 -15.717  10.072   3.972
  233   1HD   LYS  28           HD2      LYS  28 -17.841   8.259   4.980
  234   2HD   LYS  28           HD1      LYS  28 -17.628   9.770   5.866
  235   1HE   LYS  28           HE2      LYS  28 -17.513  10.245   3.009
  236   2HE   LYS  28           HE1      LYS  28 -19.012   9.424   3.442
  237   1HZ   LYS  28           HZ3      LYS  28 -18.664  11.300   5.397
  238   2HZ   LYS  28           HZ2      LYS  28 -18.194  12.106   3.975
  239   3HZ   LYS  28           HZ1      LYS  28 -19.738  11.406   4.087
  240    H    LYS  29           HN       LYS  29 -15.375   6.107   6.185
  241    HA   LYS  29           HA       LYS  29 -13.961   3.601   5.666
  242   1HB   LYS  29           HB2      LYS  29 -16.391   4.039   7.421
  243   2HB   LYS  29           HB1      LYS  29 -15.215   2.728   7.529
  244   1HG   LYS  29           HG2      LYS  29 -13.466   4.268   8.184
  245   2HG   LYS  29           HG1      LYS  29 -14.521   5.653   7.903
  246   1HD   LYS  29           HD2      LYS  29 -15.140   5.502  10.063
  247   2HD   LYS  29           HD1      LYS  29 -15.964   4.001   9.642
  248   1HE   LYS  29           HE2      LYS  29 -13.080   4.257  10.545
  249   2HE   LYS  29           HE1      LYS  29 -14.410   3.614  11.506
  250   1HZ   LYS  29           HZ1      LYS  29 -14.711   1.983   9.601
  251   2HZ   LYS  29           HZ3      LYS  29 -13.168   2.464   9.083
  252   3HZ   LYS  29           HZ2      LYS  29 -13.365   1.751  10.613
  253    H    SER  30           HN       SER  30 -17.027   5.048   4.809
  254    HA   SER  30           HA       SER  30 -18.197   2.539   3.863
  255   1HB   SER  30           HB2      SER  30 -19.452   4.663   4.666
  256   2HB   SER  30           HB1      SER  30 -19.112   5.303   3.060
  257    HG   SER  30           HG       SER  30 -20.024   3.159   2.361
  258    H    GLU  31           HN       GLU  31 -16.449   5.270   2.437
  259    HA   GLU  31           HA       GLU  31 -16.777   4.170  -0.277
  260   1HB   GLU  31           HB2      GLU  31 -16.505   6.721   0.579
  261   2HB   GLU  31           HB1      GLU  31 -14.812   6.338   0.283
  262   1HG   GLU  31           HG2      GLU  31 -15.110   6.505  -1.941
  263   2HG   GLU  31           HG1      GLU  31 -16.431   5.338  -1.884
  264    H    LEU  32           HN       LEU  32 -14.624   4.029   2.403
  265    HA   LEU  32           HA       LEU  32 -12.306   3.124   0.862
  266   1HB   LEU  32           HB2      LEU  32 -11.805   4.168   2.966
  267   2HB   LEU  32           HB1      LEU  32 -12.974   3.160   3.820
  268    HG   LEU  32           HG       LEU  32 -11.592   1.150   3.179
  269   1HD1  LEU  32          HD12      LEU  32 -10.464   2.366   1.257
  270   2HD1  LEU  32          HD11      LEU  32  -9.506   3.223   2.463
  271   3HD1  LEU  32          HD13      LEU  32  -9.370   1.472   2.312
  272   1HD2  LEU  32          HD23      LEU  32 -11.243   3.003   5.236
  273   2HD2  LEU  32          HD22      LEU  32 -10.573   1.372   5.187
  274   3HD2  LEU  32          HD21      LEU  32  -9.612   2.738   4.620
  275    H    LYS  33           HN       LYS  33 -15.008   1.748   2.644
  276    HA   LYS  33           HA       LYS  33 -14.171  -0.988   2.633
  277   1HB   LYS  33           HB2      LYS  33 -16.200   0.186   3.815
  278   2HB   LYS  33           HB1      LYS  33 -17.053  -0.178   2.319
  279   1HG   LYS  33           HG2      LYS  33 -16.916  -2.475   2.635
  280   2HG   LYS  33           HG1      LYS  33 -15.469  -2.356   3.636
  281   1HD   LYS  33           HD2      LYS  33 -16.976  -2.743   5.323
  282   2HD   LYS  33           HD1      LYS  33 -17.196  -0.996   5.204
  283   1HE   LYS  33           HE2      LYS  33 -19.396  -1.628   4.996
  284   2HE   LYS  33           HE1      LYS  33 -18.929  -1.746   3.300
  285   1HZ   LYS  33           HZ2      LYS  33 -18.485  -4.073   5.019
  286   2HZ   LYS  33           HZ1      LYS  33 -20.079  -3.732   4.541
  287   3HZ   LYS  33           HZ3      LYS  33 -18.883  -4.003   3.368
  288    H    GLU  34           HN       GLU  34 -16.076   0.944   0.334
  289    HA   GLU  34           HA       GLU  34 -16.469  -1.216  -1.538
  290   1HB   GLU  34           HB2      GLU  34 -17.489   0.392  -2.909
  291   2HB   GLU  34           HB1      GLU  34 -17.690   1.105  -1.311
  292   1HG   GLU  34           HG2      GLU  34 -15.925   2.643  -1.645
  293   2HG   GLU  34           HG1      GLU  34 -15.318   1.775  -3.051
  294    H    LEU  35           HN       LEU  35 -14.108   1.355  -1.160
  295    HA   LEU  35           HA       LEU  35 -12.590   1.105  -3.504
  296   1HB   LEU  35           HB2      LEU  35 -12.317   2.411  -1.067
  297   2HB   LEU  35           HB1      LEU  35 -10.945   1.296  -1.078
  298    HG   LEU  35           HG       LEU  35 -10.280   3.394  -2.132
  299   1HD1  LEU  35          HD12      LEU  35 -10.389   0.840  -3.559
  300   2HD1  LEU  35          HD11      LEU  35 -10.237   2.217  -4.649
  301   3HD1  LEU  35          HD13      LEU  35  -9.043   1.963  -3.376
  302   1HD2  LEU  35          HD23      LEU  35 -12.943   3.302  -3.134
  303   2HD2  LEU  35          HD22      LEU  35 -11.758   4.591  -3.339
  304   3HD2  LEU  35          HD21      LEU  35 -11.861   3.292  -4.527
  305    H    ILE  36           HN       ILE  36 -12.198  -0.738  -0.461
  306    HA   ILE  36           HA       ILE  36 -10.157  -2.490  -1.453
  307    HB   ILE  36           HB       ILE  36 -12.158  -3.372   0.608
  308   1HG1  ILE  36          HG12      ILE  36 -10.377  -0.981   0.700
  309   2HG1  ILE  36          HG11      ILE  36 -11.896  -1.282   1.533
  310   1HG2  ILE  36          HG22      ILE  36  -9.187  -3.652   0.155
  311   2HG2  ILE  36          HG21      ILE  36  -9.981  -4.194   1.635
  312   3HG2  ILE  36          HG23      ILE  36 -10.406  -4.919   0.086
  313   1HD1  ILE  36          HD12      ILE  36 -10.560  -3.019   2.920
  314   2HD1  ILE  36          HD11      ILE  36  -9.129  -2.192   2.303
  315   3HD1  ILE  36          HD13      ILE  36 -10.310  -1.309   3.272
  316    H    ASN  37           HN       ASN  37 -13.626  -3.092  -0.924
  317    HA   ASN  37           HA       ASN  37 -13.680  -5.599  -2.284
  318   1HB   ASN  37           HB2      ASN  37 -15.440  -4.753  -0.715
  319   2HB   ASN  37           HB1      ASN  37 -15.949  -3.624  -1.974
  320   1HD2  ASN  37          HD22      ASN  37 -17.519  -6.128  -3.963
  321   2HD2  ASN  37          HD21      ASN  37 -16.904  -4.547  -3.956
  322    H    ASN  38           HN       ASN  38 -12.948  -2.675  -3.648
  323    HA   ASN  38           HA       ASN  38 -14.524  -3.011  -6.109
  324   1HB   ASN  38           HB2      ASN  38 -13.867  -0.750  -5.103
  325   2HB   ASN  38           HB1      ASN  38 -12.228  -1.095  -5.658
  326   1HD2  ASN  38          HD22      ASN  38 -12.997  -0.593  -9.102
  327   2HD2  ASN  38          HD21      ASN  38 -11.872  -1.249  -8.012
  328    H    GLU  39           HN       GLU  39 -11.069  -3.018  -5.196
  329    HA   GLU  39           HA       GLU  39 -10.521  -4.593  -7.673
  330   1HB   GLU  39           HB2      GLU  39  -8.807  -3.124  -7.895
  331   2HB   GLU  39           HB1      GLU  39  -9.106  -2.454  -6.295
  332   1HG   GLU  39           HG2      GLU  39  -7.837  -4.353  -5.298
  333   2HG   GLU  39           HG1      GLU  39  -7.484  -4.946  -6.917
  334    H    LEU  40           HN       LEU  40  -9.672  -4.418  -4.220
  335    HA   LEU  40           HA       LEU  40  -8.299  -6.879  -4.043
  336   1HB   LEU  40           HB2      LEU  40  -9.700  -5.074  -2.136
  337   2HB   LEU  40           HB1      LEU  40  -9.344  -6.708  -1.580
  338    HG   LEU  40           HG       LEU  40  -6.994  -6.413  -2.166
  339   1HD1  LEU  40          HD12      LEU  40  -8.048  -3.936  -3.417
  340   2HD1  LEU  40          HD11      LEU  40  -6.478  -3.810  -2.624
  341   3HD1  LEU  40          HD13      LEU  40  -6.717  -4.975  -3.927
  342   1HD2  LEU  40          HD21      LEU  40  -8.278  -5.295  -0.041
  343   2HD2  LEU  40          HD23      LEU  40  -6.528  -5.322  -0.227
  344   3HD2  LEU  40          HD22      LEU  40  -7.443  -3.893  -0.705
  345    H    SER  41           HN       SER  41 -11.758  -6.171  -3.587
  346    HA   SER  41           HA       SER  41 -12.761  -8.600  -2.740
  347   1HB   SER  41           HB2      SER  41 -14.429  -7.029  -3.182
  348   2HB   SER  41           HB1      SER  41 -13.770  -6.630  -4.767
  349    HG   SER  41           HG       SER  41 -15.472  -8.670  -3.984
  350    H    HIS  42           HN       HIS  42 -11.284  -7.925  -5.845
  351    HA   HIS  42           HA       HIS  42 -12.191 -10.174  -7.318
  352   1HB   HIS  42           HB2      HIS  42 -10.626  -8.124  -7.967
  353   2HB   HIS  42           HB1      HIS  42  -9.348  -9.279  -7.590
  354    HD1  HIS  42           HD1      HIS  42 -11.262 -11.743  -8.600
  355    HD2  HIS  42           HD2      HIS  42 -10.047  -8.404 -10.782
  356    HE1  HIS  42           HE1      HIS  42 -11.432 -12.382 -11.045
  357    H    PHE  43           HN       PHE  43  -9.186  -9.853  -5.388
  358    HA   PHE  43           HA       PHE  43  -8.616 -12.699  -5.587
  359   1HB   PHE  43           HB2      PHE  43  -7.432 -10.962  -3.447
  360   2HB   PHE  43           HB1      PHE  43  -6.668 -12.233  -4.402
  361    HD1  PHE  43           HD1      PHE  43  -7.605 -11.406  -7.138
  362    HD2  PHE  43           HD2      PHE  43  -5.998  -9.109  -3.885
  363    HE1  PHE  43           HE1      PHE  43  -6.783  -9.709  -8.747
  364    HE2  PHE  43           HE2      PHE  43  -5.175  -7.410  -5.495
  365    HZ   PHE  43           HZ       PHE  43  -5.569  -7.711  -7.925
  366    H    LEU  44           HN       LEU  44 -10.978 -11.109  -3.925
  367    HA   LEU  44           HA       LEU  44 -10.766 -12.423  -1.341
  368   1HB   LEU  44           HB2      LEU  44 -12.101 -10.264  -2.037
  369   2HB   LEU  44           HB1      LEU  44 -13.367 -11.417  -2.459
  370    HG   LEU  44           HG       LEU  44 -12.047 -11.794   0.182
  371   1HD1  LEU  44          HD12      LEU  44 -12.377  -9.332   0.047
  372   2HD1  LEU  44          HD11      LEU  44 -14.078  -9.598  -0.333
  373   3HD1  LEU  44          HD13      LEU  44 -13.442 -10.077   1.241
  374   1HD2  LEU  44          HD22      LEU  44 -14.481 -12.521  -1.220
  375   2HD2  LEU  44          HD21      LEU  44 -13.802 -13.210   0.255
  376   3HD2  LEU  44          HD23      LEU  44 -14.856 -11.798   0.344
  377    H    GLU  45           HN       GLU  45 -10.825 -14.633  -1.360
  378    HA   GLU  45           HA       GLU  45 -13.272 -15.923  -2.370
  379   1HB   GLU  45           HB2      GLU  45 -11.568 -17.738  -3.361
  380   2HB   GLU  45           HB1      GLU  45 -12.158 -16.390  -4.334
  381   1HG   GLU  45           HG2      GLU  45 -10.144 -15.290  -4.282
  382   2HG   GLU  45           HG1      GLU  45  -9.748 -15.876  -2.666
  383    H    GLU  46           HN       GLU  46 -10.079 -16.391  -0.890
  384    HA   GLU  46           HA       GLU  46 -11.369 -18.309   1.012
  385   1HB   GLU  46           HB2      GLU  46  -8.622 -18.384  -0.257
  386   2HB   GLU  46           HB1      GLU  46  -9.019 -19.316   1.188
  387   1HG   GLU  46           HG2      GLU  46 -11.024 -20.214  -0.149
  388   2HG   GLU  46           HG1      GLU  46 -10.219 -19.553  -1.574
  389    H    ILE  47           HN       ILE  47  -8.836 -15.865   0.539
  390    HA   ILE  47           HA       ILE  47  -7.866 -14.372   2.062
  391    HB   ILE  47           HB       ILE  47 -10.295 -15.061   3.743
  392   1HG1  ILE  47          HG12      ILE  47  -9.917 -12.767   1.794
  393   2HG1  ILE  47          HG11      ILE  47 -10.771 -14.256   1.387
  394   1HG2  ILE  47          HG23      ILE  47  -8.034 -13.560   4.373
  395   2HG2  ILE  47          HG22      ILE  47  -9.218 -12.352   3.872
  396   3HG2  ILE  47          HG21      ILE  47  -9.598 -13.469   5.183
  397   1HD1  ILE  47          HD11      ILE  47 -11.496 -12.434   3.702
  398   2HD1  ILE  47          HD13      ILE  47 -12.316 -12.446   2.140
  399   3HD1  ILE  47          HD12      ILE  47 -12.382 -13.867   3.182
  400    H    LYS  48           HN       LYS  48  -6.089 -15.862   2.460
  401    HA   LYS  48           HA       LYS  48  -6.160 -17.932   4.430
  402   1HB   LYS  48           HB2      LYS  48  -4.328 -17.303   2.640
  403   2HB   LYS  48           HB1      LYS  48  -3.672 -16.321   3.950
  404   1HG   LYS  48           HG2      LYS  48  -4.277 -18.755   5.174
  405   2HG   LYS  48           HG1      LYS  48  -3.605 -19.215   3.608
  406   1HD   LYS  48           HD2      LYS  48  -1.578 -18.042   4.012
  407   2HD   LYS  48           HD1      LYS  48  -2.271 -17.161   5.375
  408   1HE   LYS  48           HE2      LYS  48  -1.655 -20.127   5.255
  409   2HE   LYS  48           HE1      LYS  48  -0.852 -18.920   6.258
  410   1HZ   LYS  48           HZ2      LYS  48  -3.144 -18.486   7.213
  411   2HZ   LYS  48           HZ1      LYS  48  -3.616 -19.944   6.482
  412   3HZ   LYS  48           HZ3      LYS  48  -2.394 -19.945   7.657
  413    H    GLU  49           HN       GLU  49  -5.331 -14.480   4.646
  414    HA   GLU  49           HA       GLU  49  -4.948 -14.711   7.568
  415   1HB   GLU  49           HB2      GLU  49  -4.414 -12.660   5.479
  416   2HB   GLU  49           HB1      GLU  49  -4.817 -12.049   7.085
  417   1HG   GLU  49           HG2      GLU  49  -2.742 -14.207   6.669
  418   2HG   GLU  49           HG1      GLU  49  -2.332 -12.492   6.620
  419    H    GLN  50           HN       GLN  50  -7.250 -15.404   7.856
  420    HA   GLN  50           HA       GLN  50  -9.450 -13.707   7.194
  421   1HB   GLN  50           HB2      GLN  50  -9.435 -16.168   8.051
  422   2HB   GLN  50           HB1      GLN  50  -9.414 -15.442   9.659
  423   1HG   GLN  50           HG2      GLN  50 -11.383 -13.972   8.526
  424   2HG   GLN  50           HG1      GLN  50 -11.581 -15.477   7.629
  425   1HE2  GLN  50          HE22      GLN  50 -13.653 -16.018  10.599
  426   2HE2  GLN  50          HE21      GLN  50 -13.717 -15.181   9.122
  427    H    GLU  51           HN       GLU  51  -7.111 -13.601   9.794
  428    HA   GLU  51           HA       GLU  51  -8.672 -11.798  11.465
  429   1HB   GLU  51           HB2      GLU  51  -6.570 -13.370  12.005
  430   2HB   GLU  51           HB1      GLU  51  -5.698 -11.874  11.666
  431   1HG   GLU  51           HG2      GLU  51  -6.670 -10.744  13.452
  432   2HG   GLU  51           HG1      GLU  51  -8.093 -11.785  13.471
  433    H    VAL  52           HN       VAL  52  -6.377 -11.438   8.831
  434    HA   VAL  52           HA       VAL  52  -5.858  -8.626   9.296
  435    HB   VAL  52           HB       VAL  52  -5.542 -10.342   6.814
  436   1HG1  VAL  52          HG11      VAL  52  -4.694  -7.500   7.427
  437   2HG1  VAL  52          HG13      VAL  52  -3.995  -8.453   6.119
  438   3HG1  VAL  52          HG12      VAL  52  -5.713  -8.052   6.098
  439   1HG2  VAL  52          HG21      VAL  52  -4.164 -10.524   9.145
  440   2HG2  VAL  52          HG23      VAL  52  -3.432 -10.831   7.569
  441   3HG2  VAL  52          HG22      VAL  52  -3.235  -9.258   8.341
  442    H    VAL  53           HN       VAL  53  -7.936 -10.356   6.945
  443    HA   VAL  53           HA       VAL  53  -9.142  -7.894   5.994
  444    HB   VAL  53           HB       VAL  53  -9.989 -10.794   5.741
  445   1HG1  VAL  53          HG12      VAL  53 -11.293  -8.251   4.946
  446   2HG1  VAL  53          HG11      VAL  53 -11.227  -9.497   3.700
  447   3HG1  VAL  53          HG13      VAL  53 -12.006  -9.836   5.247
  448   1HG2  VAL  53          HG23      VAL  53  -8.480  -8.844   3.993
  449   2HG2  VAL  53          HG22      VAL  53  -7.982 -10.453   4.516
  450   3HG2  VAL  53          HG21      VAL  53  -9.264 -10.272   3.318
  451    H    ASP  54           HN       ASP  54  -9.819 -10.154   8.579
  452    HA   ASP  54           HA       ASP  54 -12.518  -9.157   9.051
  453   1HB   ASP  54           HB2      ASP  54 -10.627 -10.884  10.667
  454   2HB   ASP  54           HB1      ASP  54 -12.213 -10.399  11.267
  455    H    LYS  55           HN       LYS  55  -9.307  -8.180   9.860
  456    HA   LYS  55           HA       LYS  55 -10.070  -6.621  12.209
  457   1HB   LYS  55           HB2      LYS  55  -7.790  -7.443  12.052
  458   2HB   LYS  55           HB1      LYS  55  -7.569  -6.647  10.493
  459   1HG   LYS  55           HG2      LYS  55  -8.488  -4.693  12.373
  460   2HG   LYS  55           HG1      LYS  55  -7.127  -5.560  13.090
  461   1HD   LYS  55           HD2      LYS  55  -6.028  -5.237  10.732
  462   2HD   LYS  55           HD1      LYS  55  -7.218  -3.945  10.557
  463   1HE   LYS  55           HE2      LYS  55  -5.940  -2.590  11.818
  464   2HE   LYS  55           HE1      LYS  55  -6.057  -3.728  13.161
  465   1HZ   LYS  55           HZ1      LYS  55  -4.277  -4.779  11.281
  466   2HZ   LYS  55           HZ3      LYS  55  -3.834  -3.165  11.553
  467   3HZ   LYS  55           HZ2      LYS  55  -3.944  -4.246  12.859
  468    H    VAL  56           HN       VAL  56  -9.032  -5.780   8.868
  469    HA   VAL  56           HA       VAL  56  -9.704  -2.995   9.158
  470    HB   VAL  56           HB       VAL  56  -9.659  -3.048   6.616
  471   1HG1  VAL  56          HG12      VAL  56  -7.635  -2.864   8.304
  472   2HG1  VAL  56          HG11      VAL  56  -7.214  -4.442   7.638
  473   3HG1  VAL  56          HG13      VAL  56  -7.343  -3.041   6.574
  474   1HG2  VAL  56          HG23      VAL  56  -9.746  -5.906   7.198
  475   2HG2  VAL  56          HG22      VAL  56 -10.036  -5.065   5.677
  476   3HG2  VAL  56          HG21      VAL  56  -8.391  -5.482   6.156
  477    H    MET  57           HN       MET  57 -11.428  -5.811   7.890
  478    HA   MET  57           HA       MET  57 -13.761  -4.379   7.006
  479   1HB   MET  57           HB2      MET  57 -13.228  -6.685   6.265
  480   2HB   MET  57           HB1      MET  57 -13.465  -7.264   7.917
  481   1HG   MET  57           HG2      MET  57 -15.699  -7.331   7.655
  482   2HG   MET  57           HG1      MET  57 -15.733  -5.683   7.025
  483   1HE   MET  57           HE1      MET  57 -14.387  -5.218   4.966
  484   2HE   MET  57           HE3      MET  57 -13.518  -6.561   4.211
  485   3HE   MET  57           HE2      MET  57 -14.939  -5.874   3.427
  486    H    GLU  58           HN       GLU  58 -12.621  -5.490  10.101
  487    HA   GLU  58           HA       GLU  58 -15.192  -5.411  11.445
  488   1HB   GLU  58           HB2      GLU  58 -12.379  -5.822  12.192
  489   2HB   GLU  58           HB1      GLU  58 -13.309  -4.954  13.413
  490   1HG   GLU  58           HG2      GLU  58 -15.025  -6.989  12.585
  491   2HG   GLU  58           HG1      GLU  58 -13.443  -7.764  12.649
  492    H    THR  59           HN       THR  59 -12.381  -3.163  11.495
  493    HA   THR  59           HA       THR  59 -13.759  -1.101  12.925
  494    HB   THR  59           HB       THR  59 -11.748  -0.291  10.885
  495    HG1  THR  59           HG1      THR  59 -10.281  -1.632  11.530
  496   1HG2  THR  59          HG23      THR  59 -12.694   0.485  13.529
  497   2HG2  THR  59          HG22      THR  59 -10.935   0.395  13.463
  498   3HG2  THR  59          HG21      THR  59 -11.807   1.434  12.335
  499    H    LEU  60           HN       LEU  60 -13.745  -2.097   9.597
  500    HA   LEU  60           HA       LEU  60 -14.848   0.271   8.416
  501   1HB   LEU  60           HB2      LEU  60 -14.530  -2.594   7.678
  502   2HB   LEU  60           HB1      LEU  60 -15.771  -1.695   6.809
  503    HG   LEU  60           HG       LEU  60 -12.909  -0.763   7.126
  504   1HD1  LEU  60          HD13      LEU  60 -13.993  -2.789   5.428
  505   2HD1  LEU  60          HD12      LEU  60 -13.607  -1.391   4.423
  506   3HD1  LEU  60          HD11      LEU  60 -12.358  -2.129   5.426
  507   1HD2  LEU  60          HD22      LEU  60 -15.389   0.325   5.887
  508   2HD2  LEU  60          HD21      LEU  60 -14.026   1.180   6.608
  509   3HD2  LEU  60          HD23      LEU  60 -13.897   0.535   4.971
  510    H    ASP  61           HN       ASP  61 -16.408  -2.770   9.466
  511    HA   ASP  61           HA       ASP  61 -19.085  -1.727   9.083
  512   1HB   ASP  61           HB2      ASP  61 -17.874  -4.246   9.696
  513   2HB   ASP  61           HB1      ASP  61 -19.087  -3.906  10.933
  514    H    GLU  62           HN       GLU  62 -16.749  -1.380  11.567
  515    HA   GLU  62           HA       GLU  62 -18.495  -1.156  13.835
  516   1HB   GLU  62           HB2      GLU  62 -15.780  -1.105  13.480
  517   2HB   GLU  62           HB1      GLU  62 -16.123   0.589  13.832
  518   1HG   GLU  62           HG2      GLU  62 -17.362  -0.089  15.864
  519   2HG   GLU  62           HG1      GLU  62 -16.988  -1.779  15.520
  520    H    ASP  63           HN       ASP  63 -16.875   1.479  12.052
  521    HA   ASP  63           HA       ASP  63 -18.836   3.405  13.071
  522   1HB   ASP  63           HB2      ASP  63 -16.262   3.501  11.656
  523   2HB   ASP  63           HB1      ASP  63 -17.411   4.728  11.123
  524    H    GLY  64           HN       GLY  64 -17.745   2.786   9.732
  525   1HA   GLY  64           HA2      GLY  64 -19.142   2.250   7.858
  526   2HA   GLY  64           HA1      GLY  64 -20.560   2.556   8.862
  527    H    ASP  65           HN       ASP  65 -19.804   5.114   9.852
  528    HA   ASP  65           HA       ASP  65 -19.772   6.730   7.332
  529   1HB   ASP  65           HB2      ASP  65 -22.012   6.532   8.639
  530   2HB   ASP  65           HB1      ASP  65 -21.240   7.583   9.826
  531    H    GLY  66           HN       GLY  66 -17.386   6.221   8.578
  532   1HA   GLY  66           HA2      GLY  66 -16.857   8.647  10.218
  533   2HA   GLY  66           HA1      GLY  66 -15.866   7.193  10.255
  534    H    GLU  67           HN       GLU  67 -14.189   9.008   9.843
  535    HA   GLU  67           HA       GLU  67 -13.908   9.360   6.882
  536   1HB   GLU  67           HB2      GLU  67 -13.312  11.279   9.136
  537   2HB   GLU  67           HB1      GLU  67 -12.563  11.454   7.548
  538   1HG   GLU  67           HG2      GLU  67 -14.473  12.235   6.615
  539   2HG   GLU  67           HG1      GLU  67 -15.457  11.003   7.407
  540    H    CYS  68           HN       CYS  68 -11.868   8.908   6.035
  541    HA   CYS  68           HA       CYS  68  -9.879   7.808   7.982
  542   1HB   CYS  68           HB2      CYS  68 -10.183   7.128   5.042
  543   2HB   CYS  68           HB1      CYS  68  -9.118   6.337   6.205
  544    HG   CYS  68           HG       CYS  68 -11.194   4.845   6.215
  545    H    ASP  69           HN       ASP  69  -7.580   8.090   7.291
  546    HA   ASP  69           HA       ASP  69  -7.212  10.816   6.197
  547   1HB   ASP  69           HB2      ASP  69  -5.291   8.889   7.534
  548   2HB   ASP  69           HB1      ASP  69  -4.851  10.500   6.971
  549    H    PHE  70           HN       PHE  70  -5.160  11.034   4.747
  550    HA   PHE  70           HA       PHE  70  -5.595   9.434   2.381
  551   1HB   PHE  70           HB2      PHE  70  -3.523  10.632   1.553
  552   2HB   PHE  70           HB1      PHE  70  -4.818  11.699   2.100
  553    HD1  PHE  70           HD1      PHE  70  -1.585  10.145   3.085
  554    HD2  PHE  70           HD2      PHE  70  -4.531  13.140   3.979
  555    HE1  PHE  70           HE1      PHE  70  -0.054  11.152   4.755
  556    HE2  PHE  70           HE2      PHE  70  -3.000  14.149   5.647
  557    HZ   PHE  70           HZ       PHE  70  -0.762  13.155   6.036
  558    H    GLN  71           HN       GLN  71  -3.129   9.454   4.935
  559    HA   GLN  71           HA       GLN  71  -1.583   7.338   3.652
  560   1HB   GLN  71           HB2      GLN  71  -0.123   7.485   5.513
  561   2HB   GLN  71           HB1      GLN  71  -0.702   9.134   5.281
  562   1HG   GLN  71           HG2      GLN  71  -1.092   8.947   7.543
  563   2HG   GLN  71           HG1      GLN  71  -2.615   8.280   6.955
  564   1HE2  GLN  71          HE22      GLN  71   0.180   5.445   7.998
  565   2HE2  GLN  71          HE21      GLN  71   0.657   6.768   7.047
  566    H    GLU  72           HN       GLU  72  -4.182   7.534   6.014
  567    HA   GLU  72           HA       GLU  72  -3.909   4.849   7.035
  568   1HB   GLU  72           HB2      GLU  72  -5.955   7.002   7.112
  569   2HB   GLU  72           HB1      GLU  72  -6.566   5.360   7.318
  570   1HG   GLU  72           HG2      GLU  72  -4.146   5.740   8.864
  571   2HG   GLU  72           HG1      GLU  72  -5.346   6.964   9.281
  572    H    PHE  73           HN       PHE  73  -6.263   6.205   4.693
  573    HA   PHE  73           HA       PHE  73  -7.363   3.773   3.822
  574   1HB   PHE  73           HB2      PHE  73  -8.529   5.406   2.747
  575   2HB   PHE  73           HB1      PHE  73  -7.174   6.525   2.809
  576    HD1  PHE  73           HD2      PHE  73  -8.680   3.719   0.896
  577    HD2  PHE  73           HD1      PHE  73  -5.705   6.813   0.935
  578    HE1  PHE  73           HE2      PHE  73  -8.264   3.350  -1.520
  579    HE2  PHE  73           HE1      PHE  73  -5.289   6.445  -1.482
  580    HZ   PHE  73           HZ       PHE  73  -6.568   4.713  -2.709
  581    H    MET  74           HN       MET  74  -4.209   5.085   3.301
  582    HA   MET  74           HA       MET  74  -3.539   3.506   0.963
  583   1HB   MET  74           HB2      MET  74  -2.351   5.591   2.418
  584   2HB   MET  74           HB1      MET  74  -1.270   4.218   2.632
  585   1HG   MET  74           HG2      MET  74  -0.643   5.500   0.629
  586   2HG   MET  74           HG1      MET  74  -1.203   3.888   0.183
  587   1HE   MET  74           HE1      MET  74  -2.542   3.290  -1.112
  588   2HE   MET  74           HE3      MET  74  -4.235   3.721  -0.832
  589   3HE   MET  74           HE2      MET  74  -3.429   4.224  -2.315
  590    H    ALA  75           HN       ALA  75  -2.275   3.306   4.291
  591    HA   ALA  75           HA       ALA  75  -1.151   0.727   3.982
  592   1HB   ALA  75           HB3      ALA  75  -0.860   2.456   5.906
  593   2HB   ALA  75           HB2      ALA  75  -2.276   1.678   6.612
  594   3HB   ALA  75           HB1      ALA  75  -0.812   0.741   6.315
  595    H    PHE  76           HN       PHE  76  -4.422   1.681   4.209
  596    HA   PHE  76           HA       PHE  76  -5.418  -0.819   5.351
  597   1HB   PHE  76           HB2      PHE  76  -6.484   1.763   4.689
  598   2HB   PHE  76           HB1      PHE  76  -7.453   0.533   3.882
  599    HD1  PHE  76           HD2      PHE  76  -5.785   1.074   7.206
  600    HD2  PHE  76           HD1      PHE  76  -9.222  -0.375   5.081
  601    HE1  PHE  76           HE2      PHE  76  -6.887   0.526   9.361
  602    HE2  PHE  76           HE1      PHE  76 -10.324  -0.922   7.235
  603    HZ   PHE  76           HZ       PHE  76  -9.156  -0.471   9.375
  604    H    VAL  77           HN       VAL  77  -5.337   0.665   2.100
  605    HA   VAL  77           HA       VAL  77  -6.579  -1.526   0.730
  606    HB   VAL  77           HB       VAL  77  -4.639   0.601  -0.216
  607   1HG1  VAL  77          HG11      VAL  77  -5.481  -1.797  -1.524
  608   2HG1  VAL  77          HG13      VAL  77  -6.285  -0.438  -2.310
  609   3HG1  VAL  77          HG12      VAL  77  -4.527  -0.472  -2.190
  610   1HG2  VAL  77          HG22      VAL  77  -7.479   0.516   0.381
  611   2HG2  VAL  77          HG21      VAL  77  -6.477   1.902  -0.051
  612   3HG2  VAL  77          HG23      VAL  77  -7.210   0.920  -1.316
  613    H    SER  78           HN       SER  78  -3.272  -0.999   1.808
  614    HA   SER  78           HA       SER  78  -2.179  -3.115   0.113
  615   1HB   SER  78           HB2      SER  78  -0.940  -1.824   2.552
  616   2HB   SER  78           HB1      SER  78  -0.100  -2.715   1.287
  617    HG   SER  78           HG       SER  78  -1.639  -0.366   0.863
  618    H    MET  79           HN       MET  79  -2.931  -2.856   3.601
  619    HA   MET  79           HA       MET  79  -1.987  -5.394   4.371
  620   1HB   MET  79           HB2      MET  79  -3.801  -5.224   6.182
  621   2HB   MET  79           HB1      MET  79  -2.592  -3.944   6.125
  622   1HG   MET  79           HG2      MET  79  -4.200  -2.584   4.749
  623   2HG   MET  79           HG1      MET  79  -5.402  -3.835   5.008
  624   1HE   MET  79           HE3      MET  79  -5.372  -4.949   7.447
  625   2HE   MET  79           HE2      MET  79  -3.848  -4.437   8.164
  626   3HE   MET  79           HE1      MET  79  -5.368  -4.003   8.941
  627    H    VAL  80           HN       VAL  80  -5.132  -4.541   2.971
  628    HA   VAL  80           HA       VAL  80  -6.157  -7.251   3.311
  629    HB   VAL  80           HB       VAL  80  -7.832  -6.244   1.458
  630   1HG1  VAL  80          HG12      VAL  80  -8.432  -6.980   3.733
  631   2HG1  VAL  80          HG11      VAL  80  -7.798  -5.471   4.387
  632   3HG1  VAL  80          HG13      VAL  80  -9.213  -5.449   3.336
  633   1HG2  VAL  80          HG23      VAL  80  -6.206  -4.159   1.507
  634   2HG2  VAL  80          HG22      VAL  80  -7.947  -3.927   1.415
  635   3HG2  VAL  80          HG21      VAL  80  -7.123  -3.756   2.958
  636    H    THR  81           HN       THR  81  -4.556  -5.501   0.664
  637    HA   THR  81           HA       THR  81  -5.148  -7.433  -1.380
  638    HB   THR  81           HB       THR  81  -2.559  -5.908  -1.367
  639    HG1  THR  81           HG1      THR  81  -3.557  -4.061  -1.499
  640   1HG2  THR  81          HG22      THR  81  -4.158  -7.332  -3.267
  641   2HG2  THR  81          HG21      THR  81  -4.127  -5.632  -3.736
  642   3HG2  THR  81          HG23      THR  81  -2.616  -6.519  -3.533
  643    H    THR  82           HN       THR  82  -3.144  -7.616   1.372
  644    HA   THR  82           HA       THR  82  -1.541  -9.824   0.163
  645    HB   THR  82           HB       THR  82  -0.325  -9.573   2.477
  646    HG1  THR  82           HG1      THR  82  -1.916  -8.148   3.313
  647   1HG2  THR  82          HG21      THR  82   0.012  -8.437  -0.088
  648   2HG2  THR  82          HG23      THR  82   0.346  -7.148   1.067
  649   3HG2  THR  82          HG22      THR  82   1.245  -8.663   1.152
  650    H    ALA  83           HN       ALA  83  -4.193  -9.196   2.227
  651    HA   ALA  83           HA       ALA  83  -3.926 -11.848   3.562
  652   1HB   ALA  83           HB2      ALA  83  -5.791  -9.508   4.064
  653   2HB   ALA  83           HB1      ALA  83  -5.867 -11.038   4.939
  654   3HB   ALA  83           HB3      ALA  83  -4.437 -10.016   5.073
  655    H    CYS  84           HN       CYS  84  -5.084 -10.750   0.721
  656    HA   CYS  84           HA       CYS  84  -7.659 -12.214   0.809
  657   1HB   CYS  84           HB2      CYS  84  -6.321 -10.431  -1.228
  658   2HB   CYS  84           HB1      CYS  84  -7.721 -11.414  -1.650
  659    HG   CYS  84           HG       CYS  84  -8.153  -9.699   0.856
  660    H    HIS  85           HN       HIS  85  -4.377 -12.608  -0.255
  661    HA   HIS  85           HA       HIS  85  -3.311 -14.532  -1.090
  662   1HB   HIS  85           HB2      HIS  85  -5.532 -15.555   0.197
  663   2HB   HIS  85           HB1      HIS  85  -5.727 -16.162  -1.448
  664    HD1  HIS  85           HD1      HIS  85  -4.766 -18.460  -1.523
  665    HD2  HIS  85           HD2      HIS  85  -2.396 -15.887   0.741
  666    HE1  HIS  85           HE1      HIS  85  -2.729 -19.794  -0.822
  667    H    GLU  86           HN       GLU  86  -4.566 -16.382  -2.990
  668    HA   GLU  86           HA       GLU  86  -5.296 -16.474  -5.243
  669   1HB   GLU  86           HB2      GLU  86  -6.630 -14.303  -4.485
  670   2HB   GLU  86           HB1      GLU  86  -5.403 -13.487  -5.456
  671   1HG   GLU  86           HG2      GLU  86  -7.261 -15.695  -6.384
  672   2HG   GLU  86           HG1      GLU  86  -7.309 -14.003  -6.880
  673    H    PHE  87           HN       PHE  87  -3.508 -13.385  -4.965
  674    HA   PHE  87           HA       PHE  87  -1.857 -13.888  -7.235
  675   1HB   PHE  87           HB2      PHE  87  -1.591 -11.679  -6.786
  676   2HB   PHE  87           HB1      PHE  87  -2.075 -11.889  -5.108
  677    HD1  PHE  87           HD2      PHE  87   0.834 -12.917  -7.266
  678    HD2  PHE  87           HD1      PHE  87  -0.494 -11.216  -3.550
  679    HE1  PHE  87           HE2      PHE  87   3.192 -12.632  -6.552
  680    HE2  PHE  87           HE1      PHE  87   1.863 -10.930  -2.837
  681    HZ   PHE  87           HZ       PHE  87   3.706 -11.640  -4.340
  682    H    PHE  88           HN       PHE  88  -1.449 -14.612  -3.791
  683    HA   PHE  88           HA       PHE  88   1.277 -15.546  -4.037
  684   1HB   PHE  88           HB2      PHE  88  -0.853 -16.072  -1.944
  685   2HB   PHE  88           HB1      PHE  88   0.831 -16.576  -1.791
  686    HD1  PHE  88           HD1      PHE  88  -1.419 -13.635  -2.104
  687    HD2  PHE  88           HD2      PHE  88   2.558 -15.010  -1.244
  688    HE1  PHE  88           HE1      PHE  88  -0.816 -11.370  -1.287
  689    HE2  PHE  88           HE2      PHE  88   3.162 -12.746  -0.427
  690    HZ   PHE  88           HZ       PHE  88   1.475 -10.928  -0.447
  691    H    GLU  89           HN       GLU  89  -1.759 -16.901  -4.876
  692    HA   GLU  89           HA       GLU  89  -0.934 -19.691  -4.606
  693   1HB   GLU  89           HB2      GLU  89  -3.365 -18.275  -5.161
  694   2HB   GLU  89           HB1      GLU  89  -3.086 -19.439  -6.457
  695   1HG   GLU  89           HG2      GLU  89  -2.787 -20.221  -3.556
  696   2HG   GLU  89           HG1      GLU  89  -4.351 -20.282  -4.367
  697    H    HIS  90           HN       HIS  90  -0.118 -17.249  -6.739
  698    HA   HIS  90           HA       HIS  90   1.239 -17.379  -8.664
  699   1HB   HIS  90           HB2      HIS  90   1.739 -19.763  -7.600
  700   2HB   HIS  90           HB1      HIS  90   0.760 -20.316  -8.959
  701    HD1  HIS  90           HD1      HIS  90   2.458 -21.126 -10.628
  702    HD2  HIS  90           HD2      HIS  90   3.471 -17.405  -9.051
  703    HE1  HIS  90           HE1      HIS  90   4.482 -20.326 -11.925
  704    H    GLU  91           HN       GLU  91  -1.989 -18.210  -8.383
  705    HA   GLU  91           HA       GLU  91  -2.336 -18.544 -11.321
  706   1HB   GLU  91           HB2      GLU  91  -3.553 -20.129  -9.860
  707   2HB   GLU  91           HB1      GLU  91  -4.372 -18.774  -9.081
  708   1HG   GLU  91           HG2      GLU  91  -5.544 -18.196 -11.064
  709   2HG   GLU  91           HG1      GLU  91  -4.490 -19.190 -12.071
  710   1H    MET   0           HT2      MET   0  -9.874  -3.306 -14.816
  711   2H    MET   0           HT1      MET   0  -9.187  -3.501 -16.357
  712   3H    MET   0           HT3      MET   0  -8.346  -2.647 -15.157
  713    HA   MET   0           HA       MET   0  -9.277  -1.074 -16.682
  714   1HB   MET   0           HB2      MET   0 -11.774  -0.994 -16.925
  715   2HB   MET   0           HB1      MET   0 -11.052  -2.449 -17.613
  716   1HG   MET   0           HG2      MET   0 -11.921  -3.823 -15.980
  717   2HG   MET   0           HG1      MET   0 -11.883  -2.559 -14.750
  718   1HE   MET   0           HE3      MET   0 -13.483  -4.705 -16.718
  719   2HE   MET   0           HE2      MET   0 -14.925  -4.541 -15.719
  720   3HE   MET   0           HE1      MET   0 -14.981  -4.076 -17.418
  721    H    SER   1           HN       SER   1  -8.476  -1.193 -13.939
  722    HA   SER   1           HA       SER   1 -10.208   0.969 -12.866
  723   1HB   SER   1           HB2      SER   1 -11.130  -0.729 -11.569
  724   2HB   SER   1           HB1      SER   1  -9.649  -1.682 -11.580
  725    HG   SER   1           HG       SER   1 -10.309   0.605 -10.064
  726    H    GLU   2           HN       GLU   2  -9.071   2.356 -11.373
  727    HA   GLU   2           HA       GLU   2  -6.230   2.574 -11.938
  728   1HB   GLU   2           HB2      GLU   2  -7.812   4.027  -9.799
  729   2HB   GLU   2           HB1      GLU   2  -6.293   4.539 -10.531
  730   1HG   GLU   2           HG2      GLU   2  -8.849   4.145 -12.101
  731   2HG   GLU   2           HG1      GLU   2  -8.340   5.701 -11.445
  732    H    LEU   3           HN       LEU   3  -8.155   1.648  -9.091
  733    HA   LEU   3           HA       LEU   3  -5.930   1.268  -7.325
  734   1HB   LEU   3           HB2      LEU   3  -8.567   1.305  -6.932
  735   2HB   LEU   3           HB1      LEU   3  -8.360  -0.441  -7.055
  736    HG   LEU   3           HG       LEU   3  -6.359  -0.041  -5.402
  737   1HD1  LEU   3          HD11      LEU   3  -8.061   2.437  -5.084
  738   2HD1  LEU   3          HD13      LEU   3  -6.988   1.850  -3.813
  739   3HD1  LEU   3          HD12      LEU   3  -6.324   2.346  -5.370
  740   1HD2  LEU   3          HD23      LEU   3  -9.258  -0.401  -5.003
  741   2HD2  LEU   3          HD22      LEU   3  -7.913  -1.331  -4.344
  742   3HD2  LEU   3          HD21      LEU   3  -8.412   0.172  -3.567
  743    H    GLU   4           HN       GLU   4  -7.609  -0.922  -9.550
  744    HA   GLU   4           HA       GLU   4  -6.226  -3.277  -8.682
  745   1HB   GLU   4           HB2      GLU   4  -8.217  -3.574  -9.975
  746   2HB   GLU   4           HB1      GLU   4  -7.598  -2.566 -11.285
  747   1HG   GLU   4           HG2      GLU   4  -5.728  -4.691 -10.771
  748   2HG   GLU   4           HG1      GLU   4  -7.337  -5.378 -10.996
  749    H    LYS   5           HN       LYS   5  -5.628  -1.261 -11.599
  750    HA   LYS   5           HA       LYS   5  -3.219  -2.625 -12.288
  751   1HB   LYS   5           HB2      LYS   5  -2.724  -0.668 -13.695
  752   2HB   LYS   5           HB1      LYS   5  -4.420  -1.122 -13.853
  753   1HG   LYS   5           HG2      LYS   5  -4.880   0.594 -11.993
  754   2HG   LYS   5           HG1      LYS   5  -3.244   1.183 -12.295
  755   1HD   LYS   5           HD2      LYS   5  -4.735   0.801 -14.773
  756   2HD   LYS   5           HD1      LYS   5  -5.538   1.939 -13.690
  757   1HE   LYS   5           HE2      LYS   5  -3.304   3.103 -13.423
  758   2HE   LYS   5           HE1      LYS   5  -2.696   2.079 -14.725
  759   1HZ   LYS   5           HZ3      LYS   5  -5.183   3.254 -15.427
  760   2HZ   LYS   5           HZ2      LYS   5  -4.065   4.453 -14.987
  761   3HZ   LYS   5           HZ1      LYS   5  -3.689   3.352 -16.225
  762    H    ALA   6           HN       ALA   6  -3.877  -0.067  -9.979
  763    HA   ALA   6           HA       ALA   6  -1.050   0.568  -9.622
  764   1HB   ALA   6           HB3      ALA   6  -3.258   2.013  -9.145
  765   2HB   ALA   6           HB2      ALA   6  -3.053   1.310  -7.543
  766   3HB   ALA   6           HB1      ALA   6  -1.764   2.277  -8.250
  767    H    MET   7           HN       MET   7  -3.378  -0.441  -7.153
  768    HA   MET   7           HA       MET   7  -1.574  -1.447  -5.291
  769   1HB   MET   7           HB2      MET   7  -3.773  -1.301  -4.526
  770   2HB   MET   7           HB1      MET   7  -4.433  -2.067  -5.971
  771   1HG   MET   7           HG2      MET   7  -4.494  -3.514  -3.891
  772   2HG   MET   7           HG1      MET   7  -3.647  -4.240  -5.258
  773   1HE   MET   7           HE2      MET   7  -3.506  -2.242  -2.101
  774   2HE   MET   7           HE1      MET   7  -1.834  -2.268  -1.549
  775   3HE   MET   7           HE3      MET   7  -2.296  -1.274  -2.938
  776    H    VAL   8           HN       VAL   8  -3.301  -3.356  -7.769
  777    HA   VAL   8           HA       VAL   8  -1.915  -5.784  -7.211
  778    HB   VAL   8           HB       VAL   8  -3.007  -5.006  -9.918
  779   1HG1  VAL   8          HG13      VAL   8  -2.642  -7.602  -8.401
  780   2HG1  VAL   8          HG12      VAL   8  -3.590  -7.472  -9.883
  781   3HG1  VAL   8          HG11      VAL   8  -1.861  -7.125  -9.910
  782   1HG2  VAL   8          HG22      VAL   8  -4.406  -5.701  -7.345
  783   2HG2  VAL   8          HG21      VAL   8  -4.840  -4.495  -8.552
  784   3HG2  VAL   8          HG23      VAL   8  -5.106  -6.200  -8.885
  785    H    ALA   9           HN       ALA   9  -1.010  -3.001  -9.212
  786    HA   ALA   9           HA       ALA   9   1.075  -4.343 -10.676
  787   1HB   ALA   9           HB1      ALA   9   0.463  -1.485 -10.011
  788   2HB   ALA   9           HB3      ALA   9   2.060  -1.886 -10.642
  789   3HB   ALA   9           HB2      ALA   9   0.622  -2.256 -11.587
  790    H    LEU  10           HN       LEU  10   0.978  -2.761  -7.509
  791    HA   LEU  10           HA       LEU  10   3.754  -2.762  -6.940
  792   1HB   LEU  10           HB2      LEU  10   1.271  -2.552  -5.431
  793   2HB   LEU  10           HB1      LEU  10   2.490  -3.462  -4.537
  794    HG   LEU  10           HG       LEU  10   3.453  -1.016  -5.909
  795   1HD1  LEU  10          HD13      LEU  10   1.073  -0.722  -4.630
  796   2HD1  LEU  10          HD12      LEU  10   2.184  -0.508  -3.278
  797   3HD1  LEU  10          HD11      LEU  10   2.304   0.539  -4.693
  798   1HD2  LEU  10          HD21      LEU  10   4.618  -2.715  -4.244
  799   2HD2  LEU  10          HD23      LEU  10   4.973  -0.990  -4.145
  800   3HD2  LEU  10          HD22      LEU  10   3.832  -1.722  -3.016
  801    H    ILE  11           HN       ILE  11   1.316  -5.308  -6.291
  802    HA   ILE  11           HA       ILE  11   3.007  -7.253  -5.185
  803    HB   ILE  11           HB       ILE  11   0.714  -7.591  -7.142
  804   1HG1  ILE  11          HG12      ILE  11   0.179  -6.558  -4.941
  805   2HG1  ILE  11          HG11      ILE  11  -0.555  -8.152  -5.114
  806   1HG2  ILE  11          HG21      ILE  11   2.284  -9.627  -5.539
  807   2HG2  ILE  11          HG23      ILE  11   0.682  -9.953  -6.198
  808   3HG2  ILE  11          HG22      ILE  11   2.025  -9.598  -7.283
  809   1HD1  ILE  11          HD12      ILE  11   1.623  -9.022  -3.974
  810   2HD1  ILE  11          HD11      ILE  11   1.824  -7.348  -3.457
  811   3HD1  ILE  11          HD13      ILE  11   0.394  -8.256  -2.967
  812    H    ASP  12           HN       ASP  12   2.637  -6.216  -8.527
  813    HA   ASP  12           HA       ASP  12   4.115  -8.257  -9.831
  814   1HB   ASP  12           HB2      ASP  12   2.802  -6.293 -10.861
  815   2HB   ASP  12           HB1      ASP  12   4.249  -5.331 -10.583
  816    H    VAL  13           HN       VAL  13   5.257  -5.098  -8.594
  817    HA   VAL  13           HA       VAL  13   7.989  -5.373  -9.113
  818    HB   VAL  13           HB       VAL  13   6.738  -4.235  -6.587
  819   1HG1  VAL  13          HG11      VAL  13   9.362  -4.770  -6.942
  820   2HG1  VAL  13          HG13      VAL  13   9.277  -3.202  -7.745
  821   3HG1  VAL  13          HG12      VAL  13   8.792  -3.356  -6.056
  822   1HG2  VAL  13          HG22      VAL  13   6.352  -3.410  -9.194
  823   2HG2  VAL  13          HG21      VAL  13   6.210  -2.373  -7.773
  824   3HG2  VAL  13          HG23      VAL  13   7.720  -2.422  -8.683
  825    H    PHE  14           HN       PHE  14   6.042  -6.975  -6.660
  826    HA   PHE  14           HA       PHE  14   8.156  -7.968  -5.024
  827   1HB   PHE  14           HB2      PHE  14   5.412  -8.171  -5.001
  828   2HB   PHE  14           HB1      PHE  14   5.897  -9.815  -5.420
  829    HD1  PHE  14           HD1      PHE  14   7.472  -7.192  -3.254
  830    HD2  PHE  14           HD2      PHE  14   5.821 -11.148  -3.499
  831    HE1  PHE  14           HE1      PHE  14   8.112  -7.607  -0.894
  832    HE2  PHE  14           HE2      PHE  14   6.460 -11.563  -1.137
  833    HZ   PHE  14           HZ       PHE  14   7.606  -9.792   0.165
  834    H    HIS  15           HN       HIS  15   6.540  -9.427  -7.859
  835    HA   HIS  15           HA       HIS  15   8.146 -11.803  -7.890
  836   1HB   HIS  15           HB2      HIS  15   6.263 -10.444  -9.723
  837   2HB   HIS  15           HB1      HIS  15   7.469 -11.460 -10.514
  838    HD1  HIS  15           HD1      HIS  15   7.655 -13.985  -9.458
  839    HD2  HIS  15           HD2      HIS  15   4.150 -11.877  -8.653
  840    HE1  HIS  15           HE1      HIS  15   5.944 -15.699  -8.716
  841    H    GLN  16           HN       GLN  16   8.945  -8.578  -8.549
  842    HA   GLN  16           HA       GLN  16  11.093  -9.280 -10.466
  843   1HB   GLN  16           HB2      GLN  16   9.504  -7.019 -10.131
  844   2HB   GLN  16           HB1      GLN  16  11.066  -6.529  -9.477
  845   1HG   GLN  16           HG2      GLN  16  10.960  -6.065 -11.891
  846   2HG   GLN  16           HG1      GLN  16  12.170  -7.302 -11.552
  847   1HE2  GLN  16          HE22      GLN  16   8.695  -8.394 -13.461
  848   2HE2  GLN  16          HE21      GLN  16   8.725  -6.964 -12.546
  849    H    TYR  17           HN       TYR  17  11.087  -7.148  -7.599
  850    HA   TYR  17           HA       TYR  17  13.866  -7.632  -7.045
  851   1HB   TYR  17           HB2      TYR  17  11.630  -6.460  -5.369
  852   2HB   TYR  17           HB1      TYR  17  13.310  -6.519  -4.837
  853    HD1  TYR  17           HD2      TYR  17  11.098  -5.278  -7.579
  854    HD2  TYR  17           HD1      TYR  17  14.873  -4.902  -5.568
  855    HE1  TYR  17           HE2      TYR  17  11.582  -3.221  -8.878
  856    HE2  TYR  17           HE1      TYR  17  15.357  -2.844  -6.867
  857    HH   TYR  17           HH       TYR  17  13.015  -1.167  -8.596
  858    H    SER  18           HN       SER  18  10.898  -8.747  -5.367
  859    HA   SER  18           HA       SER  18  12.476 -10.621  -3.744
  860   1HB   SER  18           HB2      SER  18  10.618  -9.711  -2.591
  861   2HB   SER  18           HB1      SER  18   9.538  -9.966  -3.956
  862    HG   SER  18           HG       SER  18   9.190 -11.571  -2.426
  863    H    GLY  19           HN       GLY  19  11.337 -10.675  -6.874
  864   1HA   GLY  19           HA2      GLY  19  10.889 -13.617  -6.806
  865   2HA   GLY  19           HA1      GLY  19  10.300 -12.552  -8.081
  866    H    ARG  20           HN       ARG  20  13.544 -12.560  -6.638
  867    HA   ARG  20           HA       ARG  20  14.612 -13.541  -9.250
  868   1HB   ARG  20           HB2      ARG  20  16.499 -11.854  -8.897
  869   2HB   ARG  20           HB1      ARG  20  14.936 -11.174  -9.353
  870   1HG   ARG  20           HG2      ARG  20  14.733 -10.071  -7.392
  871   2HG   ARG  20           HG1      ARG  20  15.209 -11.491  -6.458
  872   1HD   ARG  20           HD2      ARG  20  17.119 -10.353  -6.029
  873   2HD   ARG  20           HD1      ARG  20  17.573 -10.763  -7.684
  874    HE   ARG  20           HE       ARG  20  16.057  -8.444  -7.938
  875   1HH1  ARG  20          HH21      ARG  20  19.195  -9.453  -7.243
  876   2HH1  ARG  20          HH22      ARG  20  19.769  -7.894  -6.756
  877   1HH2  ARG  20          HH11      ARG  20  16.633  -6.415  -6.845
  878   2HH2  ARG  20          HH12      ARG  20  18.319  -6.173  -6.531
  879    H    GLU  21           HN       GLU  21  14.428 -14.074  -5.994
  880    HA   GLU  21           HA       GLU  21  16.583 -15.991  -6.020
  881   1HB   GLU  21           HB2      GLU  21  17.334 -13.357  -5.409
  882   2HB   GLU  21           HB1      GLU  21  17.227 -14.181  -3.851
  883   1HG   GLU  21           HG2      GLU  21  18.720 -15.914  -4.577
  884   2HG   GLU  21           HG1      GLU  21  18.680 -15.325  -6.239
  885    H    GLY  22           HN       GLY  22  14.854 -13.883  -3.708
  886   1HA   GLY  22           HA2      GLY  22  14.621 -15.767  -1.617
  887   2HA   GLY  22           HA1      GLY  22  13.485 -14.443  -1.883
  888    H    ASP  23           HN       ASP  23  11.856 -16.061  -1.131
  889    HA   ASP  23           HA       ASP  23  11.275 -18.272  -2.990
  890   1HB   ASP  23           HB2      ASP  23  10.599 -17.589  -0.255
  891   2HB   ASP  23           HB1      ASP  23   9.146 -17.993  -1.171
  892    H    LYS  24           HN       LYS  24  11.018 -15.343  -3.777
  893    HA   LYS  24           HA       LYS  24   9.548 -14.075  -5.094
  894   1HB   LYS  24           HB2      LYS  24   7.701 -16.425  -5.316
  895   2HB   LYS  24           HB1      LYS  24   8.190 -15.267  -6.556
  896   1HG   LYS  24           HG2      LYS  24  10.548 -16.272  -6.324
  897   2HG   LYS  24           HG1      LYS  24   9.773 -17.588  -5.441
  898   1HD   LYS  24           HD2      LYS  24   8.134 -17.484  -7.575
  899   2HD   LYS  24           HD1      LYS  24   9.616 -16.896  -8.331
  900   1HE   LYS  24           HE2      LYS  24   9.539 -19.403  -6.638
  901   2HE   LYS  24           HE1      LYS  24   9.283 -19.425  -8.383
  902   1HZ   LYS  24           HZ3      LYS  24  11.601 -17.938  -7.493
  903   2HZ   LYS  24           HZ2      LYS  24  11.680 -19.614  -7.219
  904   3HZ   LYS  24           HZ1      LYS  24  11.436 -19.016  -8.792
  905    H    HIS  25           HN       HIS  25   9.063 -14.692  -2.091
  906    HA   HIS  25           HA       HIS  25   6.503 -13.242  -1.969
  907   1HB   HIS  25           HB2      HIS  25   6.883 -16.034  -0.874
  908   2HB   HIS  25           HB1      HIS  25   5.645 -14.941  -0.251
  909    HD1  HIS  25           HD1      HIS  25   6.079 -17.486  -2.720
  910    HD2  HIS  25           HD2      HIS  25   3.999 -13.873  -2.616
  911    HE1  HIS  25           HE1      HIS  25   4.351 -17.600  -4.567
  912    H    LYS  26           HN       LYS  26   9.490 -13.132  -1.153
  913    HA   LYS  26           HA       LYS  26   8.955 -11.939   1.496
  914   1HB   LYS  26           HB2      LYS  26  11.014 -14.126   1.061
  915   2HB   LYS  26           HB1      LYS  26  10.874 -13.152   2.525
  916   1HG   LYS  26           HG2      LYS  26   8.508 -13.943   2.761
  917   2HG   LYS  26           HG1      LYS  26   8.776 -15.018   1.390
  918   1HD   LYS  26           HD2      LYS  26  10.683 -16.055   2.646
  919   2HD   LYS  26           HD1      LYS  26  10.247 -15.065   4.040
  920   1HE   LYS  26           HE2      LYS  26   7.961 -16.068   3.986
  921   2HE   LYS  26           HE1      LYS  26   8.489 -17.125   2.678
  922   1HZ   LYS  26           HZ1      LYS  26   9.914 -16.999   5.268
  923   2HZ   LYS  26           HZ3      LYS  26   8.608 -18.050   5.013
  924   3HZ   LYS  26           HZ2      LYS  26  10.011 -18.198   4.068
  925    H    LEU  27           HN       LEU  27  10.073 -10.053   1.640
  926    HA   LEU  27           HA       LEU  27  12.230  -9.586  -0.366
  927   1HB   LEU  27           HB2      LEU  27  10.002  -8.036   0.479
  928   2HB   LEU  27           HB1      LEU  27  11.448  -7.204   1.044
  929    HG   LEU  27           HG       LEU  27  11.405  -8.272  -1.754
  930   1HD1  LEU  27          HD13      LEU  27   9.698  -6.109  -0.668
  931   2HD1  LEU  27          HD12      LEU  27  10.608  -5.694  -2.120
  932   3HD1  LEU  27          HD11      LEU  27   9.503  -7.067  -2.135
  933   1HD2  LEU  27          HD22      LEU  27  12.664  -5.924  -0.315
  934   2HD2  LEU  27          HD21      LEU  27  13.481  -7.345  -0.969
  935   3HD2  LEU  27          HD23      LEU  27  12.768  -6.156  -2.061
  936    H    LYS  28           HN       LYS  28  13.314  -7.317   1.036
  937    HA   LYS  28           HA       LYS  28  14.302  -8.429   3.599
  938   1HB   LYS  28           HB2      LYS  28  15.855  -8.231   1.098
  939   2HB   LYS  28           HB1      LYS  28  16.638  -7.494   2.495
  940   1HG   LYS  28           HG2      LYS  28  15.766  -9.792   3.627
  941   2HG   LYS  28           HG1      LYS  28  16.006 -10.347   1.969
  942   1HD   LYS  28           HD2      LYS  28  18.173  -8.661   3.096
  943   2HD   LYS  28           HD1      LYS  28  18.001 -10.270   3.797
  944   1HE   LYS  28           HE2      LYS  28  17.756 -10.387   0.911
  945   2HE   LYS  28           HE1      LYS  28  19.273  -9.619   1.374
  946   1HZ   LYS  28           HZ3      LYS  28  19.016 -11.725   3.095
  947   2HZ   LYS  28           HZ2      LYS  28  18.481 -12.350   1.609
  948   3HZ   LYS  28           HZ1      LYS  28  20.028 -11.661   1.735
  949    H    LYS  29           HN       LYS  29  15.763  -6.692   4.668
  950    HA   LYS  29           HA       LYS  29  14.327  -4.147   4.528
  951   1HB   LYS  29           HB2      LYS  29  16.833  -4.786   6.104
  952   2HB   LYS  29           HB1      LYS  29  15.663  -3.506   6.427
  953   1HG   LYS  29           HG2      LYS  29  13.946  -5.126   6.966
  954   2HG   LYS  29           HG1      LYS  29  14.988  -6.460   6.467
  955   1HD   LYS  29           HD2      LYS  29  15.705  -6.575   8.598
  956   2HD   LYS  29           HD1      LYS  29  16.507  -5.027   8.329
  957   1HE   LYS  29           HE2      LYS  29  13.667  -5.412   9.324
  958   2HE   LYS  29           HE1      LYS  29  15.040  -4.886  10.296
  959   1HZ   LYS  29           HZ1      LYS  29  15.252  -3.029   8.596
  960   2HZ   LYS  29           HZ3      LYS  29  13.689  -3.451   8.092
  961   3HZ   LYS  29           HZ2      LYS  29  13.955  -2.933   9.688
  962    H    SER  30           HN       SER  30  17.351  -5.458   3.361
  963    HA   SER  30           HA       SER  30  18.476  -2.844   2.679
  964   1HB   SER  30           HB2      SER  30  19.767  -5.044   3.155
  965   2HB   SER  30           HB1      SER  30  19.353  -5.481   1.500
  966    HG   SER  30           HG       SER  30  20.233  -3.261   1.029
  967    H    GLU  31           HN       GLU  31  16.666  -5.386   1.008
  968    HA   GLU  31           HA       GLU  31  16.871  -3.955  -1.561
  969   1HB   GLU  31           HB2      GLU  31  16.638  -6.595  -1.014
  970   2HB   GLU  31           HB1      GLU  31  14.933  -6.186  -1.185
  971   1HG   GLU  31           HG2      GLU  31  15.131  -6.073  -3.423
  972   2HG   GLU  31           HG1      GLU  31  16.453  -4.916  -3.282
  973    H    LEU  32           HN       LEU  32  14.840  -4.161   1.211
  974    HA   LEU  32           HA       LEU  32  12.454  -3.086  -0.098
  975   1HB   LEU  32           HB2      LEU  32  12.050  -4.387   1.880
  976   2HB   LEU  32           HB1      LEU  32  13.256  -3.486   2.799
  977    HG   LEU  32           HG       LEU  32  11.847  -1.421   2.475
  978   1HD1  LEU  32          HD12      LEU  32  10.634  -2.394   0.471
  979   2HD1  LEU  32          HD11      LEU  32   9.730  -3.400   1.604
  980   3HD1  LEU  32          HD13      LEU  32   9.587  -1.644   1.677
  981   1HD2  LEU  32          HD23      LEU  32  11.592  -3.517   4.300
  982   2HD2  LEU  32          HD22      LEU  32  10.920  -1.896   4.484
  983   3HD2  LEU  32          HD21      LEU  32   9.934  -3.187   3.799
  984    H    LYS  33           HN       LYS  33  15.236  -1.926   1.715
  985    HA   LYS  33           HA       LYS  33  14.397   0.785   2.081
  986   1HB   LYS  33           HB2      LYS  33  16.478  -0.515   3.014
  987   2HB   LYS  33           HB1      LYS  33  17.262   0.037   1.537
  988   1HG   LYS  33           HG2      LYS  33  17.140   2.276   2.141
  989   2HG   LYS  33           HG1      LYS  33  15.739   2.025   3.184
  990   1HD   LYS  33           HD2      LYS  33  17.320   2.208   4.835
  991   2HD   LYS  33           HD1      LYS  33  17.534   0.490   4.491
  992   1HE   LYS  33           HE2      LYS  33  19.724   1.156   4.264
  993   2HE   LYS  33           HE1      LYS  33  19.179   1.483   2.617
  994   1HZ   LYS  33           HZ2      LYS  33  18.814   3.575   4.629
  995   2HZ   LYS  33           HZ1      LYS  33  20.384   3.305   4.040
  996   3HZ   LYS  33           HZ3      LYS  33  19.138   3.713   2.966
  997    H    GLU  34           HN       GLU  34  16.197  -0.833  -0.524
  998    HA   GLU  34           HA       GLU  34  16.504   1.545  -2.131
  999   1HB   GLU  34           HB2      GLU  34  17.460   0.126  -3.735
 1000   2HB   GLU  34           HB1      GLU  34  17.734  -0.778  -2.249
 1001   1HG   GLU  34           HG2      GLU  34  15.956  -2.273  -2.689
 1002   2HG   GLU  34           HG1      GLU  34  15.286  -1.240  -3.947
 1003    H    LEU  35           HN       LEU  35  14.163  -1.067  -1.966
 1004    HA   LEU  35           HA       LEU  35  12.540  -0.536  -4.191
 1005   1HB   LEU  35           HB2      LEU  35  12.379  -2.138  -1.923
 1006   2HB   LEU  35           HB1      LEU  35  11.008  -1.037  -1.733
 1007    HG   LEU  35           HG       LEU  35  10.295  -2.992  -3.007
 1008   1HD1  LEU  35          HD12      LEU  35  10.338  -0.279  -4.110
 1009   2HD1  LEU  35          HD11      LEU  35  10.138  -1.510  -5.354
 1010   3HD1  LEU  35          HD13      LEU  35   9.003  -1.425  -4.006
 1011   1HD2  LEU  35          HD23      LEU  35  12.910  -2.760  -4.110
 1012   2HD2  LEU  35          HD22      LEU  35  11.718  -4.020  -4.419
 1013   3HD2  LEU  35          HD21      LEU  35  11.766  -2.583  -5.441
 1014    H    ILE  36           HN       ILE  36  12.286   0.911  -0.927
 1015    HA   ILE  36           HA       ILE  36  10.201   2.761  -1.601
 1016    HB   ILE  36           HB       ILE  36  12.295   3.392   0.460
 1017   1HG1  ILE  36          HG12      ILE  36  10.519   0.996   0.337
 1018   2HG1  ILE  36          HG11      ILE  36  12.074   1.200   1.129
 1019   1HG2  ILE  36          HG22      ILE  36   9.306   3.708   0.181
 1020   2HG2  ILE  36          HG21      ILE  36  10.164   4.066   1.679
 1021   3HG2  ILE  36          HG23      ILE  36  10.520   4.982   0.215
 1022   1HD1  ILE  36          HD12      ILE  36  10.802   2.743   2.781
 1023   2HD1  ILE  36          HD11      ILE  36   9.346   1.991   2.133
 1024   3HD1  ILE  36          HD13      ILE  36  10.569   1.001   2.930
 1025    H    ASN  37           HN       ASN  37  13.690   3.314  -1.161
 1026    HA   ASN  37           HA       ASN  37  13.680   5.971  -2.202
 1027   1HB   ASN  37           HB2      ASN  37  15.511   4.946  -0.830
 1028   2HB   ASN  37           HB1      ASN  37  15.964   3.987  -2.241
 1029   1HD2  ASN  37          HD22      ASN  37  17.442   6.729  -3.975
 1030   2HD2  ASN  37          HD21      ASN  37  16.827   5.155  -4.136
 1031    H    ASN  38           HN       ASN  38  12.891   3.235  -3.882
 1032    HA   ASN  38           HA       ASN  38  14.353   3.885  -6.352
 1033   1HB   ASN  38           HB2      ASN  38  13.742   1.512  -5.603
 1034   2HB   ASN  38           HB1      ASN  38  12.080   1.914  -6.036
 1035   1HD2  ASN  38          HD22      ASN  38  12.692   1.851  -9.546
 1036   2HD2  ASN  38          HD21      ASN  38  11.618   2.358  -8.333
 1037    H    GLU  39           HN       GLU  39  10.943   3.758  -5.288
 1038    HA   GLU  39           HA       GLU  39  10.283   5.626  -7.524
 1039   1HB   GLU  39           HB2      GLU  39   8.560   4.185  -7.847
 1040   2HB   GLU  39           HB1      GLU  39   8.932   3.323  -6.355
 1041   1HG   GLU  39           HG2      GLU  39   7.710   5.076  -5.076
 1042   2HG   GLU  39           HG1      GLU  39   7.282   5.863  -6.590
 1043    H    LEU  40           HN       LEU  40   9.591   5.016  -4.083
 1044    HA   LEU  40           HA       LEU  40   8.226   7.428  -3.540
 1045   1HB   LEU  40           HB2      LEU  40   9.714   5.407  -1.938
 1046   2HB   LEU  40           HB1      LEU  40   9.381   6.957  -1.167
 1047    HG   LEU  40           HG       LEU  40   7.009   6.724  -1.679
 1048   1HD1  LEU  40          HD12      LEU  40   8.006   4.428  -3.271
 1049   2HD1  LEU  40          HD11      LEU  40   6.474   4.194  -2.430
 1050   3HD1  LEU  40          HD13      LEU  40   6.653   5.514  -3.587
 1051   1HD2  LEU  40          HD21      LEU  40   8.387   5.357   0.231
 1052   2HD2  LEU  40          HD23      LEU  40   6.631   5.396   0.131
 1053   3HD2  LEU  40          HD22      LEU  40   7.523   4.043  -0.562
 1054    H    SER  41           HN       SER  41  11.701   6.688  -3.334
 1055    HA   SER  41           HA       SER  41  12.742   9.000  -2.240
 1056   1HB   SER  41           HB2      SER  41  14.389   7.506  -2.949
 1057   2HB   SER  41           HB1      SER  41  13.659   7.305  -4.539
 1058    HG   SER  41           HG       SER  41  15.394   9.241  -3.588
 1059    H    HIS  42           HN       HIS  42  11.126   8.709  -5.334
 1060    HA   HIS  42           HA       HIS  42  11.965  11.129  -6.557
 1061   1HB   HIS  42           HB2      HIS  42  10.374   9.167  -7.383
 1062   2HB   HIS  42           HB1      HIS  42   9.112  10.257  -6.807
 1063    HD1  HIS  42           HD1      HIS  42  10.979  12.840  -7.592
 1064    HD2  HIS  42           HD2      HIS  42   9.667   9.791 -10.112
 1065    HE1  HIS  42           HE1      HIS  42  11.037  13.781  -9.944
 1066    H    PHE  43           HN       PHE  43   9.051  10.552  -4.547
 1067    HA   PHE  43           HA       PHE  43   8.472  13.397  -4.366
 1068   1HB   PHE  43           HB2      PHE  43   7.386  11.400  -2.406
 1069   2HB   PHE  43           HB1      PHE  43   6.580  12.775  -3.161
 1070    HD1  PHE  43           HD1      PHE  43   7.392  12.301  -6.017
 1071    HD2  PHE  43           HD2      PHE  43   5.933   9.606  -3.004
 1072    HE1  PHE  43           HE1      PHE  43   6.497  10.813  -7.784
 1073    HE2  PHE  43           HE2      PHE  43   5.040   8.118  -4.772
 1074    HZ   PHE  43           HZ       PHE  43   5.322   8.721  -7.161
 1075    H    LEU  44           HN       LEU  44  10.907  11.627  -3.024
 1076    HA   LEU  44           HA       LEU  44  10.811  12.607  -0.290
 1077   1HB   LEU  44           HB2      LEU  44  12.114  10.559  -1.308
 1078   2HB   LEU  44           HB1      LEU  44  13.358  11.764  -1.641
 1079    HG   LEU  44           HG       LEU  44  12.161  11.801   1.083
 1080   1HD1  LEU  44          HD12      LEU  44  12.485   9.377   0.631
 1081   2HD1  LEU  44          HD11      LEU  44  14.166   9.698   0.209
 1082   3HD1  LEU  44          HD13      LEU  44  13.602   9.973   1.857
 1083   1HD2  LEU  44          HD22      LEU  44  14.527  12.711  -0.328
 1084   2HD2  LEU  44          HD21      LEU  44  13.917  13.207   1.251
 1085   3HD2  LEU  44          HD23      LEU  44  14.974  11.802   1.116
 1086    H    GLU  45           HN       GLU  45  10.868  14.802  -0.038
 1087    HA   GLU  45           HA       GLU  45  13.268  16.223  -0.991
 1088   1HB   GLU  45           HB2      GLU  45  11.518  18.137  -1.671
 1089   2HB   GLU  45           HB1      GLU  45  12.064  16.926  -2.830
 1090   1HG   GLU  45           HG2      GLU  45  10.056  15.815  -2.822
 1091   2HG   GLU  45           HG1      GLU  45   9.732  16.193  -1.129
 1092    H    GLU  46           HN       GLU  46  10.144  16.484   0.680
 1093    HA   GLU  46           HA       GLU  46  11.519  18.158   2.743
 1094   1HB   GLU  46           HB2      GLU  46   8.717  18.374   1.619
 1095   2HB   GLU  46           HB1      GLU  46   9.179  19.121   3.149
 1096   1HG   GLU  46           HG2      GLU  46  11.120  20.191   1.843
 1097   2HG   GLU  46           HG1      GLU  46  10.253  19.707   0.386
 1098    H    ILE  47           HN       ILE  47   8.967  15.777   2.089
 1099    HA   ILE  47           HA       ILE  47   8.067  14.100   3.457
 1100    HB   ILE  47           HB       ILE  47  10.570  14.588   5.097
 1101   1HG1  ILE  47          HG12      ILE  47  10.105  12.552   2.899
 1102   2HG1  ILE  47          HG11      ILE  47  10.939  14.085   2.641
 1103   1HG2  ILE  47          HG23      ILE  47   8.341  13.006   5.640
 1104   2HG2  ILE  47          HG22      ILE  47   9.501  11.877   4.939
 1105   3HG2  ILE  47          HG21      ILE  47   9.940  12.824   6.360
 1106   1HD1  ILE  47          HD11      ILE  47  11.769  11.994   4.677
 1107   2HD1  ILE  47          HD13      ILE  47  12.517  12.204   3.093
 1108   3HD1  ILE  47          HD12      ILE  47  12.630  13.486   4.299
 1109    H    LYS  48           HN       LYS  48   6.311  15.517   4.118
 1110    HA   LYS  48           HA       LYS  48   6.470  17.325   6.323
 1111   1HB   LYS  48           HB2      LYS  48   4.558  16.913   4.555
 1112   2HB   LYS  48           HB1      LYS  48   3.963  15.772   5.761
 1113   1HG   LYS  48           HG2      LYS  48   4.623  18.038   7.247
 1114   2HG   LYS  48           HG1      LYS  48   3.880  18.686   5.784
 1115   1HD   LYS  48           HD2      LYS  48   1.874  17.460   6.131
 1116   2HD   LYS  48           HD1      LYS  48   2.628  16.419   7.341
 1117   1HE   LYS  48           HE2      LYS  48   2.007  19.373   7.617
 1118   2HE   LYS  48           HE1      LYS  48   1.251  18.046   8.498
 1119   1HZ   LYS  48           HZ2      LYS  48   3.583  17.510   9.287
 1120   2HZ   LYS  48           HZ1      LYS  48   4.020  19.051   8.720
 1121   3HZ   LYS  48           HZ3      LYS  48   2.854  18.898   9.942
 1122    H    GLU  49           HN       GLU  49   5.653  13.869   6.147
 1123    HA   GLU  49           HA       GLU  49   5.403  13.731   9.089
 1124   1HB   GLU  49           HB2      GLU  49   4.776  11.953   6.790
 1125   2HB   GLU  49           HB1      GLU  49   5.251  11.150   8.287
 1126   1HG   GLU  49           HG2      GLU  49   3.158  13.330   8.238
 1127   2HG   GLU  49           HG1      GLU  49   2.747  11.631   7.996
 1128    H    GLN  50           HN       GLN  50   7.716  14.397   9.355
 1129    HA   GLN  50           HA       GLN  50   9.884  12.808   8.390
 1130   1HB   GLN  50           HB2      GLN  50   9.907  15.144   9.543
 1131   2HB   GLN  50           HB1      GLN  50   9.958  14.223  11.048
 1132   1HG   GLN  50           HG2      GLN  50  11.874  12.917   9.654
 1133   2HG   GLN  50           HG1      GLN  50  12.031  14.524   8.943
 1134   1HE2  GLN  50          HE22      GLN  50  14.235  14.701  11.857
 1135   2HE2  GLN  50          HE21      GLN  50  14.232  14.056  10.288
 1136    H    GLU  51           HN       GLU  51   7.666  12.364  11.059
 1137    HA   GLU  51           HA       GLU  51   9.301  10.376  12.422
 1138   1HB   GLU  51           HB2      GLU  51   7.224  11.857  13.248
 1139   2HB   GLU  51           HB1      GLU  51   6.339  10.410  12.767
 1140   1HG   GLU  51           HG2      GLU  51   7.391   9.070  14.354
 1141   2HG   GLU  51           HG1      GLU  51   8.813  10.111  14.436
 1142    H    VAL  52           HN       VAL  52   6.889  10.335   9.871
 1143    HA   VAL  52           HA       VAL  52   6.392   7.484  10.009
 1144    HB   VAL  52           HB       VAL  52   5.963   9.493   7.776
 1145   1HG1  VAL  52          HG11      VAL  52   5.145   6.593   8.071
 1146   2HG1  VAL  52          HG13      VAL  52   4.388   7.698   6.923
 1147   3HG1  VAL  52          HG12      VAL  52   6.102   7.311   6.775
 1148   1HG2  VAL  52          HG21      VAL  52   4.693   9.375  10.171
 1149   2HG2  VAL  52          HG23      VAL  52   3.889   9.872   8.681
 1150   3HG2  VAL  52          HG22      VAL  52   3.729   8.213   9.260
 1151    H    VAL  53           HN       VAL  53   8.360   9.506   7.796
 1152    HA   VAL  53           HA       VAL  53   9.523   7.188   6.495
 1153    HB   VAL  53           HB       VAL  53  10.357  10.104   6.565
 1154   1HG1  VAL  53          HG12      VAL  53  11.625   7.686   5.402
 1155   2HG1  VAL  53          HG11      VAL  53  11.502   9.077   4.324
 1156   3HG1  VAL  53          HG13      VAL  53  12.349   9.225   5.864
 1157   1HG2  VAL  53          HG23      VAL  53   8.771   8.376   4.659
 1158   2HG2  VAL  53          HG22      VAL  53   8.297   9.904   5.399
 1159   3HG2  VAL  53          HG21      VAL  53   9.523   9.882   4.131
 1160    H    ASP  54           HN       ASP  54  10.315   9.113   9.307
 1161    HA   ASP  54           HA       ASP  54  13.034   8.081   9.527
 1162   1HB   ASP  54           HB2      ASP  54  11.218   9.582  11.429
 1163   2HB   ASP  54           HB1      ASP  54  12.829   9.035  11.891
 1164    H    LYS  55           HN       LYS  55   9.862   6.990  10.355
 1165    HA   LYS  55           HA       LYS  55  10.732   5.155  12.455
 1166   1HB   LYS  55           HB2      LYS  55   8.448   5.977  12.507
 1167   2HB   LYS  55           HB1      LYS  55   8.157   5.380  10.873
 1168   1HG   LYS  55           HG2      LYS  55   9.160   3.214  12.452
 1169   2HG   LYS  55           HG1      LYS  55   7.833   3.975  13.332
 1170   1HD   LYS  55           HD2      LYS  55   6.628   3.942  11.006
 1171   2HD   LYS  55           HD1      LYS  55   7.809   2.689  10.617
 1172   1HE   LYS  55           HE2      LYS  55   6.590   1.180  11.759
 1173   2HE   LYS  55           HE1      LYS  55   6.768   2.142  13.225
 1174   1HZ   LYS  55           HZ1      LYS  55   4.904   3.408  11.574
 1175   2HZ   LYS  55           HZ3      LYS  55   4.475   1.770  11.663
 1176   3HZ   LYS  55           HZ2      LYS  55   4.643   2.681  13.087
 1177    H    VAL  56           HN       VAL  56   9.544   4.732   9.087
 1178    HA   VAL  56           HA       VAL  56  10.230   1.936   9.000
 1179    HB   VAL  56           HB       VAL  56  10.069   2.305   6.490
 1180   1HG1  VAL  56          HG12      VAL  56   8.125   1.900   8.232
 1181   2HG1  VAL  56          HG11      VAL  56   7.674   3.547   7.786
 1182   3HG1  VAL  56          HG13      VAL  56   7.754   2.289   6.552
 1183   1HG2  VAL  56          HG23      VAL  56  10.182   5.069   7.415
 1184   2HG2  VAL  56          HG22      VAL  56  10.404   4.426   5.791
 1185   3HG2  VAL  56          HG21      VAL  56   8.781   4.770   6.391
 1186    H    MET  57           HN       MET  57  11.893   4.899   8.013
 1187    HA   MET  57           HA       MET  57  14.185   3.603   6.853
 1188   1HB   MET  57           HB2      MET  57  13.617   5.980   6.428
 1189   2HB   MET  57           HB1      MET  57  13.930   6.349   8.125
 1190   1HG   MET  57           HG2      MET  57  16.148   6.461   7.772
 1191   2HG   MET  57           HG1      MET  57  16.154   4.906   6.942
 1192   1HE   MET  57           HE1      MET  57  14.717   4.693   4.906
 1193   2HE   MET  57           HE3      MET  57  13.814   6.115   4.362
 1194   3HE   MET  57           HE2      MET  57  15.198   5.539   3.437
 1195    H    GLU  58           HN       GLU  58  13.186   4.312  10.110
 1196    HA   GLU  58           HA       GLU  58  15.816   4.080  11.315
 1197   1HB   GLU  58           HB2      GLU  58  13.038   4.379  12.235
 1198   2HB   GLU  58           HB1      GLU  58  14.022   3.371  13.296
 1199   1HG   GLU  58           HG2      GLU  58  15.699   5.503  12.647
 1200   2HG   GLU  58           HG1      GLU  58  14.121   6.255  12.879
 1201    H    THR  59           HN       THR  59  13.009   1.827  11.216
 1202    HA   THR  59           HA       THR  59  14.453  -0.389  12.315
 1203    HB   THR  59           HB       THR  59  12.350  -0.949  10.284
 1204    HG1  THR  59           HG1      THR  59  10.914   0.291  11.156
 1205   1HG2  THR  59          HG23      THR  59  13.415  -2.045  12.767
 1206   2HG2  THR  59          HG22      THR  59  11.655  -1.957  12.792
 1207   3HG2  THR  59          HG21      THR  59  12.476  -2.842  11.505
 1208    H    LEU  60           HN       LEU  60  14.286   1.014   9.141
 1209    HA   LEU  60           HA       LEU  60  15.336  -1.181   7.626
 1210   1HB   LEU  60           HB2      LEU  60  14.985   1.751   7.263
 1211   2HB   LEU  60           HB1      LEU  60  16.185   0.976   6.233
 1212    HG   LEU  60           HG       LEU  60  13.340  -0.006   6.564
 1213   1HD1  LEU  60          HD13      LEU  60  14.345   2.222   5.081
 1214   2HD1  LEU  60          HD12      LEU  60  13.914   0.957   3.931
 1215   3HD1  LEU  60          HD11      LEU  60  12.711   1.559   5.073
 1216   1HD2  LEU  60          HD22      LEU  60  15.763  -0.917   5.088
 1217   2HD2  LEU  60          HD21      LEU  60  14.434  -1.863   5.759
 1218   3HD2  LEU  60          HD23      LEU  60  14.230  -1.019   4.222
 1219    H    ASP  61           HN       ASP  61  16.941   1.715   8.972
 1220    HA   ASP  61           HA       ASP  61  19.597   0.744   8.340
 1221   1HB   ASP  61           HB2      ASP  61  18.415   3.159   9.316
 1222   2HB   ASP  61           HB1      ASP  61  19.682   2.676  10.443
 1223    H    GLU  62           HN       GLU  62  17.378   0.075  10.866
 1224    HA   GLU  62           HA       GLU  62  19.224  -0.418  13.007
 1225   1HB   GLU  62           HB2      GLU  62  16.496  -0.442  12.773
 1226   2HB   GLU  62           HB1      GLU  62  16.856  -2.165  12.897
 1227   1HG   GLU  62           HG2      GLU  62  18.184  -1.738  14.938
 1228   2HG   GLU  62           HG1      GLU  62  17.796  -0.020  14.824
 1229    H    ASP  63           HN       ASP  63  17.525  -2.822  10.988
 1230    HA   ASP  63           HA       ASP  63  19.531  -4.847  11.671
 1231   1HB   ASP  63           HB2      ASP  63  16.896  -4.781  10.374
 1232   2HB   ASP  63           HB1      ASP  63  18.020  -5.927   9.641
 1233    H    GLY  64           HN       GLY  64  18.290  -3.824   8.488
 1234   1HA   GLY  64           HA2      GLY  64  19.600  -3.049   6.632
 1235   2HA   GLY  64           HA1      GLY  64  21.063  -3.470   7.525
 1236    H    ASP  65           HN       ASP  65  20.353  -6.136   8.225
 1237    HA   ASP  65           HA       ASP  65  20.207  -7.425   5.528
 1238   1HB   ASP  65           HB2      ASP  65  22.504  -7.378   6.745
 1239   2HB   ASP  65           HB1      ASP  65  21.787  -8.575   7.827
 1240    H    GLY  66           HN       GLY  66  17.881  -7.090   6.935
 1241   1HA   GLY  66           HA2      GLY  66  17.427  -9.705   8.284
 1242   2HA   GLY  66           HA1      GLY  66  16.438  -8.272   8.547
 1243    H    GLU  67           HN       GLU  67  14.746 -10.032   7.990
 1244    HA   GLU  67           HA       GLU  67  14.331 -10.014   5.026
 1245   1HB   GLU  67           HB2      GLU  67  13.838 -12.203   7.050
 1246   2HB   GLU  67           HB1      GLU  67  13.018 -12.184   5.488
 1247   1HG   GLU  67           HG2      GLU  67  14.883 -12.830   4.379
 1248   2HG   GLU  67           HG1      GLU  67  15.902 -11.701   5.271
 1249    H    CYS  68           HN       CYS  68  12.254  -9.472   4.334
 1250    HA   CYS  68           HA       CYS  68  10.355  -8.636   6.490
 1251   1HB   CYS  68           HB2      CYS  68  10.525  -7.592   3.647
 1252   2HB   CYS  68           HB1      CYS  68   9.513  -6.958   4.945
 1253    HG   CYS  68           HG       CYS  68  11.588  -5.467   5.046
 1254    H    ASP  69           HN       ASP  69   8.027  -8.842   5.875
 1255    HA   ASP  69           HA       ASP  69   7.612 -11.414   4.471
 1256   1HB   ASP  69           HB2      ASP  69   5.752  -9.679   6.124
 1257   2HB   ASP  69           HB1      ASP  69   5.287 -11.212   5.386
 1258    H    PHE  70           HN       PHE  70   5.495 -11.461   3.102
 1259    HA   PHE  70           HA       PHE  70   5.822  -9.577   0.933
 1260   1HB   PHE  70           HB2      PHE  70   3.715 -10.675   0.060
 1261   2HB   PHE  70           HB1      PHE  70   5.033 -11.794   0.411
 1262    HD1  PHE  70           HD1      PHE  70   1.849 -10.393   1.728
 1263    HD2  PHE  70           HD2      PHE  70   4.833 -13.460   2.108
 1264    HE1  PHE  70           HE1      PHE  70   0.394 -11.610   3.327
 1265    HE2  PHE  70           HE2      PHE  70   3.380 -14.677   3.708
 1266    HZ   PHE  70           HZ       PHE  70   1.161 -13.753   4.317
 1267    H    GLN  71           HN       GLN  71   3.475  -9.929   3.576
 1268    HA   GLN  71           HA       GLN  71   1.870  -7.679   2.636
 1269   1HB   GLN  71           HB2      GLN  71   0.498  -8.066   4.530
 1270   2HB   GLN  71           HB1      GLN  71   1.066  -9.670   4.070
 1271   1HG   GLN  71           HG2      GLN  71   1.558  -9.764   6.317
 1272   2HG   GLN  71           HG1      GLN  71   3.052  -9.019   5.747
 1273   1HE2  GLN  71          HE22      GLN  71   0.306  -6.354   7.258
 1274   2HE2  GLN  71          HE21      GLN  71  -0.213  -7.550   6.174
 1275    H    GLU  72           HN       GLU  72   4.574  -8.152   4.834
 1276    HA   GLU  72           HA       GLU  72   4.347  -5.617   6.191
 1277   1HB   GLU  72           HB2      GLU  72   6.396  -7.751   5.907
 1278   2HB   GLU  72           HB1      GLU  72   7.013  -6.144   6.287
 1279   1HG   GLU  72           HG2      GLU  72   4.667  -6.728   7.883
 1280   2HG   GLU  72           HG1      GLU  72   5.885  -7.987   8.090
 1281    H    PHE  73           HN       PHE  73   6.593  -6.657   3.595
 1282    HA   PHE  73           HA       PHE  73   7.652  -4.129   2.981
 1283   1HB   PHE  73           HB2      PHE  73   8.769  -5.607   1.661
 1284   2HB   PHE  73           HB1      PHE  73   7.419  -6.733   1.645
 1285    HD1  PHE  73           HD2      PHE  73   8.835  -3.702   0.026
 1286    HD2  PHE  73           HD1      PHE  73   5.865  -6.794  -0.180
 1287    HE1  PHE  73           HE2      PHE  73   8.309  -3.036  -2.303
 1288    HE2  PHE  73           HE1      PHE  73   5.340  -6.130  -2.512
 1289    HZ   PHE  73           HZ       PHE  73   6.562  -4.251  -3.572
 1290    H    MET  74           HN       MET  74   4.478  -5.385   2.447
 1291    HA   MET  74           HA       MET  74   3.703  -3.530   0.355
 1292   1HB   MET  74           HB2      MET  74   2.582  -5.787   1.593
 1293   2HB   MET  74           HB1      MET  74   1.511  -4.458   2.026
 1294   1HG   MET  74           HG2      MET  74   0.794  -5.483  -0.090
 1295   2HG   MET  74           HG1      MET  74   1.333  -3.827  -0.358
 1296   1HE   MET  74           HE1      MET  74   2.612  -3.064  -1.629
 1297   2HE   MET  74           HE3      MET  74   4.316  -3.515  -1.482
 1298   3HE   MET  74           HE2      MET  74   3.443  -3.835  -2.978
 1299    H    ALA  75           HN       ALA  75   2.590  -3.754   3.737
 1300    HA   ALA  75           HA       ALA  75   1.453  -1.162   3.800
 1301   1HB   ALA  75           HB3      ALA  75   1.248  -3.121   5.507
 1302   2HB   ALA  75           HB2      ALA  75   2.696  -2.428   6.238
 1303   3HB   ALA  75           HB1      ALA  75   1.219  -1.469   6.127
 1304    H    PHE  76           HN       PHE  76   4.730  -2.118   3.757
 1305    HA   PHE  76           HA       PHE  76   5.777   0.226   5.153
 1306   1HB   PHE  76           HB2      PHE  76   6.812  -2.247   4.129
 1307   2HB   PHE  76           HB1      PHE  76   7.743  -0.919   3.437
 1308    HD1  PHE  76           HD2      PHE  76   6.228  -1.881   6.742
 1309    HD2  PHE  76           HD1      PHE  76   9.564  -0.158   4.656
 1310    HE1  PHE  76           HE2      PHE  76   7.426  -1.600   8.895
 1311    HE2  PHE  76           HE1      PHE  76  10.763   0.123   6.809
 1312    HZ   PHE  76           HZ       PHE  76   9.694  -0.598   8.929
 1313    H    VAL  77           HN       VAL  77   5.550  -0.841   1.751
 1314    HA   VAL  77           HA       VAL  77   6.727   1.511   0.607
 1315    HB   VAL  77           HB       VAL  77   4.747  -0.494  -0.505
 1316   1HG1  VAL  77          HG11      VAL  77   5.527   2.054  -1.542
 1317   2HG1  VAL  77          HG13      VAL  77   6.296   0.809  -2.526
 1318   3HG1  VAL  77          HG12      VAL  77   4.544   0.816  -2.325
 1319   1HG2  VAL  77          HG22      VAL  77   7.610  -0.467  -0.033
 1320   2HG2  VAL  77          HG21      VAL  77   6.590  -1.794  -0.585
 1321   3HG2  VAL  77          HG23      VAL  77   7.266  -0.657  -1.752
 1322    H    SER  78           HN       SER  78   3.472   0.833   1.762
 1323    HA   SER  78           HA       SER  78   2.302   3.138   0.394
 1324   1HB   SER  78           HB2      SER  78   1.176   1.545   2.708
 1325   2HB   SER  78           HB1      SER  78   0.279   2.584   1.602
 1326    HG   SER  78           HG       SER  78   1.799   0.313   0.821
 1327    H    MET  79           HN       MET  79   3.212   2.450   3.784
 1328    HA   MET  79           HA       MET  79   2.303   4.868   4.904
 1329   1HB   MET  79           HB2      MET  79   4.198   4.483   6.596
 1330   2HB   MET  79           HB1      MET  79   2.988   3.213   6.436
 1331   1HG   MET  79           HG2      MET  79   4.532   2.044   4.830
 1332   2HG   MET  79           HG1      MET  79   5.744   3.262   5.186
 1333   1HE   MET  79           HE3      MET  79   5.825   4.062   7.743
 1334   2HE   MET  79           HE2      MET  79   4.334   3.456   8.461
 1335   3HE   MET  79           HE1      MET  79   5.888   2.938   9.108
 1336    H    VAL  80           HN       VAL  80   5.381   4.215   3.267
 1337    HA   VAL  80           HA       VAL  80   6.419   6.866   3.893
 1338    HB   VAL  80           HB       VAL  80   8.009   6.110   1.855
 1339   1HG1  VAL  80          HG12      VAL  80   8.712   6.559   4.173
 1340   2HG1  VAL  80          HG11      VAL  80   8.108   4.976   4.664
 1341   3HG1  VAL  80          HG13      VAL  80   9.475   5.094   3.555
 1342   1HG2  VAL  80          HG23      VAL  80   6.389   4.024   1.720
 1343   2HG2  VAL  80          HG22      VAL  80   8.124   3.817   1.521
 1344   3HG2  VAL  80          HG21      VAL  80   7.370   3.449   3.066
 1345    H    THR  81           HN       THR  81   4.701   5.451   1.125
 1346    HA   THR  81           HA       THR  81   5.200   7.627  -0.688
 1347    HB   THR  81           HB       THR  81   2.615   6.096  -0.746
 1348    HG1  THR  81           HG1      THR  81   3.606   4.286  -1.150
 1349   1HG2  THR  81          HG22      THR  81   4.124   7.756  -2.526
 1350   2HG2  THR  81          HG21      THR  81   4.074   6.128  -3.199
 1351   3HG2  THR  81          HG23      THR  81   2.573   6.972  -2.819
 1352    H    THR  82           HN       THR  82   3.322   7.454   2.154
 1353    HA   THR  82           HA       THR  82   1.665   9.785   1.301
 1354    HB   THR  82           HB       THR  82   0.555   9.241   3.620
 1355    HG1  THR  82           HG1      THR  82   2.184   7.731   4.200
 1356   1HG2  THR  82          HG21      THR  82   0.103   8.431   0.952
 1357   2HG2  THR  82          HG23      THR  82  -0.178   7.005   1.953
 1358   3HG2  THR  82          HG22      THR  82  -1.073   8.493   2.265
 1359    H    ALA  83           HN       ALA  83   4.407   8.921   3.149
 1360    HA   ALA  83           HA       ALA  83   4.201  11.382   4.811
 1361   1HB   ALA  83           HB2      ALA  83   6.088   9.011   4.935
 1362   2HB   ALA  83           HB1      ALA  83   6.202  10.421   5.987
 1363   3HB   ALA  83           HB3      ALA  83   4.781   9.381   6.059
 1364    H    CYS  84           HN       CYS  84   5.230  10.655   1.807
 1365    HA   CYS  84           HA       CYS  84   7.805  12.112   1.957
 1366   1HB   CYS  84           HB2      CYS  84   6.378  10.589  -0.220
 1367   2HB   CYS  84           HB1      CYS  84   7.757  11.626  -0.582
 1368    HG   CYS  84           HG       CYS  84   8.302   9.614   1.671
 1369    H    HIS  85           HN       HIS  85   4.480  12.617   1.103
 1370    HA   HIS  85           HA       HIS  85   3.374  14.623   0.561
 1371   1HB   HIS  85           HB2      HIS  85   5.652  15.492   1.861
 1372   2HB   HIS  85           HB1      HIS  85   5.771  16.299   0.296
 1373    HD1  HIS  85           HD1      HIS  85   4.806  18.584   0.550
 1374    HD2  HIS  85           HD2      HIS  85   2.544  15.734   2.586
 1375    HE1  HIS  85           HE1      HIS  85   2.804  19.807   1.504
 1376    H    GLU  86           HN       GLU  86   4.542  16.704  -1.152
 1377    HA   GLU  86           HA       GLU  86   5.169  17.081  -3.405
 1378   1HB   GLU  86           HB2      GLU  86   6.537  14.840  -2.986
 1379   2HB   GLU  86           HB1      GLU  86   5.268  14.145  -3.992
 1380   1HG   GLU  86           HG2      GLU  86   7.080  16.461  -4.723
 1381   2HG   GLU  86           HG1      GLU  86   7.106  14.845  -5.427
 1382    H    PHE  87           HN       PHE  87   3.395  13.969  -3.431
 1383    HA   PHE  87           HA       PHE  87   1.645  14.742  -5.544
 1384   1HB   PHE  87           HB2      PHE  87   1.400  12.493  -5.359
 1385   2HB   PHE  87           HB1      PHE  87   1.959  12.494  -3.691
 1386    HD1  PHE  87           HD2      PHE  87  -1.046  13.766  -5.572
 1387    HD2  PHE  87           HD1      PHE  87   0.450  11.623  -2.159
 1388    HE1  PHE  87           HE2      PHE  87  -3.368  13.380  -4.791
 1389    HE2  PHE  87           HE1      PHE  87  -1.873  11.236  -1.380
 1390    HZ   PHE  87           HZ       PHE  87  -3.782  12.116  -2.698
 1391    H    PHE  88           HN       PHE  88   1.392  15.029  -2.021
 1392    HA   PHE  88           HA       PHE  88  -1.342  15.969  -2.025
 1393   1HB   PHE  88           HB2      PHE  88   0.880  16.244   0.017
 1394   2HB   PHE  88           HB1      PHE  88  -0.795  16.714   0.308
 1395    HD1  PHE  88           HD1      PHE  88   1.439  13.847  -0.469
 1396    HD2  PHE  88           HD2      PHE  88  -2.495  15.081   0.735
 1397    HE1  PHE  88           HE1      PHE  88   0.874  11.496   0.089
 1398    HE2  PHE  88           HE2      PHE  88  -3.061  12.730   1.293
 1399    HZ   PHE  88           HZ       PHE  88  -1.376  10.939   0.971
 1400    H    GLU  89           HN       GLU  89   1.651  17.436  -2.828
 1401    HA   GLU  89           HA       GLU  89   0.840  20.167  -2.178
 1402   1HB   GLU  89           HB2      GLU  89   3.243  18.846  -3.014
 1403   2HB   GLU  89           HB1      GLU  89   2.904  20.160  -4.143
 1404   1HG   GLU  89           HG2      GLU  89   2.737  20.572  -1.157
 1405   2HG   GLU  89           HG1      GLU  89   4.263  20.743  -2.025
 1406    H    HIS  90           HN       HIS  90  -0.073  18.005  -4.557
 1407    HA   HIS  90           HA       HIS  90  -1.514  18.365  -6.387
 1408   1HB   HIS  90           HB2      HIS  90  -1.967  20.596  -5.015
 1409   2HB   HIS  90           HB1      HIS  90  -1.051  21.319  -6.339
 1410    HD1  HIS  90           HD1      HIS  90  -2.823  22.321  -7.814
 1411    HD2  HIS  90           HD2      HIS  90  -3.762  18.426  -6.666
 1412    HE1  HIS  90           HE1      HIS  90  -4.903  21.677  -9.107
 1413    H    GLU  91           HN       GLU  91   1.724  19.174  -6.153
 1414    HA   GLU  91           HA       GLU  91   1.936  19.875  -9.040
 1415   1HB   GLU  91           HB2      GLU  91   3.217  21.272  -7.452
 1416   2HB   GLU  91           HB1      GLU  91   4.072  19.835  -6.883
 1417   1HG   GLU  91           HG2      GLU  91   5.153  19.517  -8.975
 1418   2HG   GLU  91           HG1      GLU  91   4.054  20.621  -9.802
   
  No H/Q in entry =        1418
  Start of MODEL   10
    1   1H    MET   0           HT3      MET   0   9.742   5.781 -13.410
    2   2H    MET   0           HT2      MET   0   9.034   7.046 -14.295
    3   3H    MET   0           HT1      MET   0   8.151   6.262 -13.074
    4    HA   MET   0           HA       MET   0   7.279   5.257 -14.920
    5   1HB   MET   0           HB2      MET   0   9.122   6.482 -16.323
    6   2HB   MET   0           HB1      MET   0   9.976   4.943 -16.212
    7   1HG   MET   0           HG2      MET   0   8.342   3.795 -17.420
    8   2HG   MET   0           HG1      MET   0   7.087   4.972 -17.032
    9   1HE   MET   0           HE3      MET   0  10.352   4.237 -18.776
   10   2HE   MET   0           HE2      MET   0  10.591   5.535 -19.944
   11   3HE   MET   0           HE1      MET   0  10.778   5.863 -18.222
   12    H    SER   1           HN       SER   1   8.366   4.184 -12.459
   13    HA   SER   1           HA       SER   1   9.430   1.547 -13.368
   14   1HB   SER   1           HB2      SER   1  10.277   1.241 -11.159
   15   2HB   SER   1           HB1      SER   1  10.646   2.911 -11.574
   16    HG   SER   1           HG       SER   1   9.514   3.424  -9.890
   17    H    GLU   2           HN       GLU   2   8.618  -0.137 -11.414
   18    HA   GLU   2           HA       GLU   2   5.756  -0.392 -11.960
   19   1HB   GLU   2           HB2      GLU   2   7.426  -2.093 -10.095
   20   2HB   GLU   2           HB1      GLU   2   5.926  -2.539 -10.909
   21   1HG   GLU   2           HG2      GLU   2   8.580  -1.950 -12.250
   22   2HG   GLU   2           HG1      GLU   2   7.821  -3.534 -12.093
   23    H    LEU   3           HN       LEU   3   7.788   0.167  -9.087
   24    HA   LEU   3           HA       LEU   3   5.571   0.309  -7.241
   25   1HB   LEU   3           HB2      LEU   3   8.256   0.132  -6.936
   26   2HB   LEU   3           HB1      LEU   3   8.031   1.854  -6.640
   27    HG   LEU   3           HG       LEU   3   6.114   1.151  -5.064
   28   1HD1  LEU   3          HD12      LEU   3   6.480  -1.308  -6.084
   29   2HD1  LEU   3          HD11      LEU   3   7.590  -1.412  -4.719
   30   3HD1  LEU   3          HD13      LEU   3   5.887  -1.048  -4.443
   31   1HD2  LEU   3          HD21      LEU   3   9.033   1.079  -4.684
   32   2HD2  LEU   3          HD23      LEU   3   7.799   1.925  -3.750
   33   3HD2  LEU   3          HD22      LEU   3   8.129   0.222  -3.436
   34    H    GLU   4           HN       GLU   4   7.271   2.660  -9.228
   35    HA   GLU   4           HA       GLU   4   6.105   4.996  -7.998
   36   1HB   GLU   4           HB2      GLU   4   7.907   4.412 -10.158
   37   2HB   GLU   4           HB1      GLU   4   6.669   5.525 -10.737
   38   1HG   GLU   4           HG2      GLU   4   7.132   7.073  -8.931
   39   2HG   GLU   4           HG1      GLU   4   8.248   5.930  -8.183
   40    H    LYS   5           HN       LYS   5   5.418   3.581 -11.221
   41    HA   LYS   5           HA       LYS   5   3.049   5.078 -11.645
   42   1HB   LYS   5           HB2      LYS   5   3.436   4.132 -13.655
   43   2HB   LYS   5           HB1      LYS   5   4.476   2.912 -12.938
   44   1HG   LYS   5           HG2      LYS   5   1.510   2.572 -12.653
   45   2HG   LYS   5           HG1      LYS   5   2.244   2.245 -14.220
   46   1HD   LYS   5           HD2      LYS   5   3.886   0.737 -13.093
   47   2HD   LYS   5           HD1      LYS   5   3.016   0.978 -11.579
   48   1HE   LYS   5           HE2      LYS   5   1.044  -0.060 -12.435
   49   2HE   LYS   5           HE1      LYS   5   1.660  -0.022 -14.088
   50   1HZ   LYS   5           HZ2      LYS   5   3.421  -1.542 -13.425
   51   2HZ   LYS   5           HZ1      LYS   5   2.801  -1.594 -11.842
   52   3HZ   LYS   5           HZ3      LYS   5   1.891  -2.219 -13.132
   53    H    ALA   6           HN       ALA   6   3.552   2.027  -9.933
   54    HA   ALA   6           HA       ALA   6   0.682   1.548  -9.631
   55   1HB   ALA   6           HB3      ALA   6   3.133   0.270  -8.402
   56   2HB   ALA   6           HB2      ALA   6   1.490  -0.232  -8.007
   57   3HB   ALA   6           HB1      ALA   6   2.089  -0.395  -9.657
   58    H    MET   7           HN       MET   7   3.161   1.888  -7.089
   59    HA   MET   7           HA       MET   7   1.491   2.548  -4.967
   60   1HB   MET   7           HB2      MET   7   3.965   2.189  -4.817
   61   2HB   MET   7           HB1      MET   7   4.205   3.797  -5.505
   62   1HG   MET   7           HG2      MET   7   4.298   4.286  -3.236
   63   2HG   MET   7           HG1      MET   7   2.579   4.525  -3.548
   64   1HE   MET   7           HE2      MET   7   0.828   3.187  -3.127
   65   2HE   MET   7           HE1      MET   7   0.691   1.993  -1.841
   66   3HE   MET   7           HE3      MET   7   1.080   3.673  -1.452
   67    H    VAL   8           HN       VAL   8   3.138   4.882  -7.097
   68    HA   VAL   8           HA       VAL   8   1.849   7.190  -6.038
   69    HB   VAL   8           HB       VAL   8   2.711   6.887  -8.920
   70   1HG1  VAL   8          HG11      VAL   8   2.374   9.140  -6.950
   71   2HG1  VAL   8          HG13      VAL   8   3.463   9.311  -8.326
   72   3HG1  VAL   8          HG12      VAL   8   1.747   9.007  -8.592
   73   1HG2  VAL   8          HG23      VAL   8   4.294   6.279  -6.706
   74   2HG2  VAL   8          HG22      VAL   8   4.886   6.718  -8.308
   75   3HG2  VAL   8          HG21      VAL   8   4.701   7.955  -7.065
   76    H    ALA   9           HN       ALA   9   0.852   4.883  -8.526
   77    HA   ALA   9           HA       ALA   9  -1.356   6.355  -9.576
   78   1HB   ALA   9           HB1      ALA   9  -0.660   3.443  -9.369
   79   2HB   ALA   9           HB3      ALA   9  -2.290   3.895  -9.865
   80   3HB   ALA   9           HB2      ALA   9  -0.900   4.430 -10.810
   81    H    LEU  10           HN       LEU  10  -0.979   4.385  -6.674
   82    HA   LEU  10           HA       LEU  10  -3.705   4.168  -5.926
   83   1HB   LEU  10           HB2      LEU  10  -1.137   3.761  -4.684
   84   2HB   LEU  10           HB1      LEU  10  -2.200   4.615  -3.563
   85    HG   LEU  10           HG       LEU  10  -3.198   2.222  -5.094
   86   1HD1  LEU  10          HD12      LEU  10  -1.025   2.150  -3.299
   87   2HD1  LEU  10          HD11      LEU  10  -2.423   1.598  -2.375
   88   3HD1  LEU  10          HD13      LEU  10  -1.975   0.780  -3.872
   89   1HD2  LEU  10          HD22      LEU  10  -3.991   3.856  -2.714
   90   2HD2  LEU  10          HD21      LEU  10  -4.993   3.211  -4.012
   91   3HD2  LEU  10          HD23      LEU  10  -4.424   2.147  -2.726
   92    H    ILE  11           HN       ILE  11  -1.346   6.771  -5.385
   93    HA   ILE  11           HA       ILE  11  -2.984   8.430  -3.751
   94    HB   ILE  11           HB       ILE  11  -0.760   9.027  -5.711
   95   1HG1  ILE  11          HG12      ILE  11   0.509   9.474  -3.701
   96   2HG1  ILE  11          HG11      ILE  11  -0.941   9.373  -2.703
   97   1HG2  ILE  11          HG23      ILE  11  -2.268  10.996  -3.961
   98   2HG2  ILE  11          HG22      ILE  11  -0.785  11.352  -4.845
   99   3HG2  ILE  11          HG21      ILE  11  -2.265  10.970  -5.723
  100   1HD1  ILE  11          HD13      ILE  11   0.169   7.082  -4.349
  101   2HD1  ILE  11          HD12      ILE  11   0.437   7.291  -2.619
  102   3HD1  ILE  11          HD11      ILE  11  -1.193   7.008  -3.230
  103    H    ASP  12           HN       ASP  12  -2.841   7.969  -7.245
  104    HA   ASP  12           HA       ASP  12  -4.496  10.166  -8.010
  105   1HB   ASP  12           HB2      ASP  12  -3.092   8.559  -9.480
  106   2HB   ASP  12           HB1      ASP  12  -4.497   7.500  -9.424
  107    H    VAL  13           HN       VAL  13  -5.343   6.740  -7.435
  108    HA   VAL  13           HA       VAL  13  -8.074   6.789  -7.856
  109    HB   VAL  13           HB       VAL  13  -6.533   5.455  -5.617
  110   1HG1  VAL  13          HG11      VAL  13  -9.420   5.663  -6.103
  111   2HG1  VAL  13          HG13      VAL  13  -8.847   3.999  -6.012
  112   3HG1  VAL  13          HG12      VAL  13  -8.562   5.105  -4.668
  113   1HG2  VAL  13          HG23      VAL  13  -7.122   4.885  -8.439
  114   2HG2  VAL  13          HG22      VAL  13  -5.880   4.201  -7.393
  115   3HG2  VAL  13          HG21      VAL  13  -7.518   3.549  -7.360
  116    H    PHE  14           HN       PHE  14  -6.337   8.123  -5.071
  117    HA   PHE  14           HA       PHE  14  -8.628   8.727  -3.473
  118   1HB   PHE  14           HB2      PHE  14  -6.039   8.871  -2.954
  119   2HB   PHE  14           HB1      PHE  14  -6.238  10.539  -3.488
  120    HD1  PHE  14           HD2      PHE  14  -9.356  10.191  -2.453
  121    HD2  PHE  14           HD1      PHE  14  -5.436   9.969  -0.716
  122    HE1  PHE  14           HE2      PHE  14 -10.301  10.786  -0.241
  123    HE2  PHE  14           HE1      PHE  14  -6.383  10.563   1.497
  124    HZ   PHE  14           HZ       PHE  14  -8.816  10.970   1.735
  125    H    HIS  15           HN       HIS  15  -6.855  10.716  -5.858
  126    HA   HIS  15           HA       HIS  15  -8.687  12.949  -5.603
  127   1HB   HIS  15           HB2      HIS  15  -6.201  12.514  -6.815
  128   2HB   HIS  15           HB1      HIS  15  -7.299  12.819  -8.161
  129    HD1  HIS  15           HD1      HIS  15  -6.603  15.227  -8.655
  130    HD2  HIS  15           HD2      HIS  15  -7.672  14.644  -4.668
  131    HE1  HIS  15           HE1      HIS  15  -6.731  17.528  -7.602
  132    H    GLN  16           HN       GLN  16  -9.145   9.919  -6.879
  133    HA   GLN  16           HA       GLN  16 -10.805  10.808  -9.163
  134   1HB   GLN  16           HB2      GLN  16  -9.296   8.513  -8.651
  135   2HB   GLN  16           HB1      GLN  16 -10.969   7.977  -8.497
  136   1HG   GLN  16           HG2      GLN  16 -10.926   7.820 -10.760
  137   2HG   GLN  16           HG1      GLN  16 -11.082   9.576 -10.735
  138   1HE2  GLN  16          HE22      GLN  16  -7.338   7.979 -11.371
  139   2HE2  GLN  16          HE21      GLN  16  -8.467   7.094 -10.465
  140    H    TYR  17           HN       TYR  17 -11.181   9.088  -6.059
  141    HA   TYR  17           HA       TYR  17 -14.114   9.150  -6.339
  142   1HB   TYR  17           HB2      TYR  17 -12.290   8.133  -4.142
  143   2HB   TYR  17           HB1      TYR  17 -14.050   8.029  -4.087
  144    HD1  TYR  17           HD1      TYR  17 -10.994   6.812  -5.758
  145    HD2  TYR  17           HD2      TYR  17 -15.274   6.517  -5.558
  146    HE1  TYR  17           HE1      TYR  17 -10.914   4.738  -7.119
  147    HE2  TYR  17           HE2      TYR  17 -15.193   4.445  -6.919
  148    HH   TYR  17           HH       TYR  17 -12.095   3.156  -8.124
  149    H    SER  18           HN       SER  18 -11.773  10.327  -3.886
  150    HA   SER  18           HA       SER  18 -13.667  11.999  -2.540
  151   1HB   SER  18           HB2      SER  18 -11.314  11.209  -1.769
  152   2HB   SER  18           HB1      SER  18 -10.717  12.605  -2.660
  153    HG   SER  18           HG       SER  18 -11.213  13.646  -0.901
  154    H    GLY  19           HN       GLY  19 -11.758  12.464  -5.430
  155   1HA   GLY  19           HA2      GLY  19 -11.702  15.288  -5.561
  156   2HA   GLY  19           HA1      GLY  19 -11.752  14.233  -6.973
  157    H    ARG  20           HN       ARG  20 -14.348  13.052  -6.009
  158    HA   ARG  20           HA       ARG  20 -16.164  14.507  -7.533
  159   1HB   ARG  20           HB2      ARG  20 -16.609  12.820  -5.065
  160   2HB   ARG  20           HB1      ARG  20 -17.941  13.491  -6.006
  161   1HG   ARG  20           HG2      ARG  20 -17.231  12.310  -7.990
  162   2HG   ARG  20           HG1      ARG  20 -15.743  11.785  -7.202
  163   1HD   ARG  20           HD2      ARG  20 -17.232   9.917  -7.108
  164   2HD   ARG  20           HD1      ARG  20 -17.213  10.609  -5.486
  165    HE   ARG  20           HE       ARG  20 -19.381  11.361  -7.392
  166   1HH1  ARG  20          HH11      ARG  20 -19.190  12.239  -4.467
  167   2HH1  ARG  20          HH12      ARG  20 -20.327  11.164  -3.725
  168   1HH2  ARG  20          HH21      ARG  20 -20.449   9.001  -6.433
  169   2HH2  ARG  20          HH22      ARG  20 -21.040   9.329  -4.838
  170    H    GLU  21           HN       GLU  21 -16.577  14.553  -4.005
  171    HA   GLU  21           HA       GLU  21 -17.950  17.010  -3.934
  172   1HB   GLU  21           HB2      GLU  21 -16.150  15.987  -1.730
  173   2HB   GLU  21           HB1      GLU  21 -17.602  16.970  -1.568
  174   1HG   GLU  21           HG2      GLU  21 -18.266  14.611  -3.049
  175   2HG   GLU  21           HG1      GLU  21 -17.417  14.133  -1.579
  176    H    GLY  22           HN       GLY  22 -16.689  18.733  -2.207
  177   1HA   GLY  22           HA2      GLY  22 -14.634  19.896  -3.969
  178   2HA   GLY  22           HA1      GLY  22 -15.416  20.713  -2.617
  179    H    ASP  23           HN       ASP  23 -14.936  18.522  -0.742
  180    HA   ASP  23           HA       ASP  23 -12.547  19.328   0.448
  181   1HB   ASP  23           HB2      ASP  23 -12.583  16.799   1.312
  182   2HB   ASP  23           HB1      ASP  23 -13.748  17.988   1.887
  183    H    LYS  24           HN       LYS  24 -12.883  16.267  -1.398
  184    HA   LYS  24           HA       LYS  24 -11.282  15.076  -2.630
  185   1HB   LYS  24           HB2      LYS  24  -9.996  17.785  -3.041
  186   2HB   LYS  24           HB1      LYS  24  -9.891  16.377  -4.098
  187   1HG   LYS  24           HG2      LYS  24 -12.518  16.585  -4.147
  188   2HG   LYS  24           HG1      LYS  24 -12.194  18.250  -3.669
  189   1HD   LYS  24           HD2      LYS  24 -10.823  16.940  -6.027
  190   2HD   LYS  24           HD1      LYS  24 -12.335  17.834  -6.182
  191   1HE   LYS  24           HE2      LYS  24  -9.694  18.907  -5.154
  192   2HE   LYS  24           HE1      LYS  24 -10.498  19.347  -6.660
  193   1HZ   LYS  24           HZ2      LYS  24 -12.437  19.968  -5.095
  194   2HZ   LYS  24           HZ1      LYS  24 -11.239  20.026  -3.895
  195   3HZ   LYS  24           HZ3      LYS  24 -11.125  21.035  -5.251
  196    H    HIS  25           HN       HIS  25 -10.781  15.822   0.302
  197    HA   HIS  25           HA       HIS  25  -7.927  14.995   0.282
  198   1HB   HIS  25           HB2      HIS  25  -9.055  17.357   1.808
  199   2HB   HIS  25           HB1      HIS  25  -7.491  16.625   2.164
  200    HD1  HIS  25           HD1      HIS  25  -8.794  19.352   0.349
  201    HD2  HIS  25           HD2      HIS  25  -5.961  16.431  -0.556
  202    HE1  HIS  25           HE1      HIS  25  -7.409  20.265  -1.563
  203    H    LYS  26           HN       LYS  26 -10.888  14.155   1.120
  204    HA   LYS  26           HA       LYS  26  -9.957  12.610   3.459
  205   1HB   LYS  26           HB2      LYS  26 -11.993  13.261   4.772
  206   2HB   LYS  26           HB1      LYS  26 -10.864  14.595   4.532
  207   1HG   LYS  26           HG2      LYS  26 -12.465  15.790   3.502
  208   2HG   LYS  26           HG1      LYS  26 -12.662  14.513   2.301
  209   1HD   LYS  26           HD2      LYS  26 -14.553  13.740   3.280
  210   2HD   LYS  26           HD1      LYS  26 -13.856  13.846   4.897
  211   1HE   LYS  26           HE2      LYS  26 -14.240  16.305   4.872
  212   2HE   LYS  26           HE1      LYS  26 -15.015  16.145   3.295
  213   1HZ   LYS  26           HZ2      LYS  26 -16.636  14.650   4.292
  214   2HZ   LYS  26           HZ1      LYS  26 -15.897  14.836   5.809
  215   3HZ   LYS  26           HZ3      LYS  26 -16.648  16.161   5.066
  216    H    LEU  27           HN       LEU  27 -10.765  10.567   3.302
  217    HA   LEU  27           HA       LEU  27 -12.932  10.103   1.311
  218   1HB   LEU  27           HB2      LEU  27 -10.482   8.752   1.960
  219   2HB   LEU  27           HB1      LEU  27 -11.826   7.650   2.244
  220    HG   LEU  27           HG       LEU  27 -11.188   9.147  -0.308
  221   1HD1  LEU  27          HD13      LEU  27 -10.699   6.475   0.711
  222   2HD1  LEU  27          HD12      LEU  27 -11.666   6.419  -0.763
  223   3HD1  LEU  27          HD11      LEU  27 -10.100   7.228  -0.765
  224   1HD2  LEU  27          HD21      LEU  27 -13.739   8.412   0.737
  225   2HD2  LEU  27          HD23      LEU  27 -13.366   9.046  -0.866
  226   3HD2  LEU  27          HD22      LEU  27 -13.367   7.306  -0.586
  227    H    LYS  28           HN       LYS  28 -13.649   7.507   2.384
  228    HA   LYS  28           HA       LYS  28 -14.622   8.045   5.120
  229   1HB   LYS  28           HB2      LYS  28 -16.461   7.659   2.746
  230   2HB   LYS  28           HB1      LYS  28 -16.985   7.535   4.426
  231   1HG   LYS  28           HG2      LYS  28 -15.966   9.878   4.735
  232   2HG   LYS  28           HG1      LYS  28 -15.931   9.961   2.974
  233   1HD   LYS  28           HD2      LYS  28 -18.381   9.494   4.697
  234   2HD   LYS  28           HD1      LYS  28 -18.006  10.960   3.790
  235   1HE   LYS  28           HE2      LYS  28 -17.910   9.415   1.716
  236   2HE   LYS  28           HE1      LYS  28 -18.748   8.238   2.726
  237   1HZ   LYS  28           HZ3      LYS  28 -19.687  11.008   2.229
  238   2HZ   LYS  28           HZ2      LYS  28 -20.268   9.631   1.421
  239   3HZ   LYS  28           HZ1      LYS  28 -20.511   9.805   3.093
  240    H    LYS  29           HN       LYS  29 -15.881   6.037   5.915
  241    HA   LYS  29           HA       LYS  29 -14.308   3.682   5.205
  242   1HB   LYS  29           HB2      LYS  29 -15.747   2.552   6.921
  243   2HB   LYS  29           HB1      LYS  29 -14.940   3.998   7.528
  244   1HG   LYS  29           HG2      LYS  29 -17.363   4.901   6.417
  245   2HG   LYS  29           HG1      LYS  29 -17.773   3.448   7.327
  246   1HD   LYS  29           HD2      LYS  29 -16.262   5.859   8.376
  247   2HD   LYS  29           HD1      LYS  29 -17.902   5.378   8.812
  248   1HE   LYS  29           HE2      LYS  29 -17.129   3.397   9.907
  249   2HE   LYS  29           HE1      LYS  29 -15.509   3.580   9.240
  250   1HZ   LYS  29           HZ1      LYS  29 -15.967   5.937  10.523
  251   2HZ   LYS  29           HZ3      LYS  29 -16.667   4.792  11.560
  252   3HZ   LYS  29           HZ2      LYS  29 -15.035   4.646  11.115
  253    H    SER  30           HN       SER  30 -17.319   5.052   4.226
  254    HA   SER  30           HA       SER  30 -18.467   2.535   3.263
  255   1HB   SER  30           HB2      SER  30 -19.257   5.384   3.332
  256   2HB   SER  30           HB1      SER  30 -19.832   4.491   1.928
  257    HG   SER  30           HG       SER  30 -21.312   4.224   3.570
  258    H    GLU  31           HN       GLU  31 -16.853   5.364   1.801
  259    HA   GLU  31           HA       GLU  31 -16.905   4.149  -0.862
  260   1HB   GLU  31           HB2      GLU  31 -16.826   6.683  -0.289
  261   2HB   GLU  31           HB1      GLU  31 -15.105   6.423  -0.005
  262   1HG   GLU  31           HG2      GLU  31 -14.658   6.006  -2.230
  263   2HG   GLU  31           HG1      GLU  31 -16.263   5.344  -2.538
  264    H    LEU  32           HN       LEU  32 -14.973   3.933   1.958
  265    HA   LEU  32           HA       LEU  32 -12.525   3.098   0.576
  266   1HB   LEU  32           HB2      LEU  32 -12.225   4.094   2.751
  267   2HB   LEU  32           HB1      LEU  32 -13.414   3.012   3.475
  268    HG   LEU  32           HG       LEU  32 -11.938   1.078   2.902
  269   1HD1  LEU  32          HD11      LEU  32 -10.776   2.345   1.028
  270   2HD1  LEU  32          HD13      LEU  32  -9.862   3.189   2.277
  271   3HD1  LEU  32          HD12      LEU  32  -9.705   1.442   2.100
  272   1HD2  LEU  32          HD22      LEU  32 -11.331   3.238   4.808
  273   2HD2  LEU  32          HD21      LEU  32 -11.453   1.502   5.082
  274   3HD2  LEU  32          HD23      LEU  32  -9.955   2.191   4.457
  275    H    LYS  33           HN       LYS  33 -15.246   1.619   2.287
  276    HA   LYS  33           HA       LYS  33 -14.430  -1.096   2.199
  277   1HB   LYS  33           HB2      LYS  33 -16.508  -0.007   3.307
  278   2HB   LYS  33           HB1      LYS  33 -17.278  -0.199   1.735
  279   1HG   LYS  33           HG2      LYS  33 -16.032  -2.668   2.257
  280   2HG   LYS  33           HG1      LYS  33 -16.793  -2.195   3.777
  281   1HD   LYS  33           HD2      LYS  33 -18.710  -1.537   1.886
  282   2HD   LYS  33           HD1      LYS  33 -18.034  -3.044   1.264
  283   1HE   LYS  33           HE2      LYS  33 -18.435  -4.147   3.407
  284   2HE   LYS  33           HE1      LYS  33 -19.018  -2.637   4.104
  285   1HZ   LYS  33           HZ2      LYS  33 -20.804  -2.619   2.476
  286   2HZ   LYS  33           HZ1      LYS  33 -20.245  -4.081   1.817
  287   3HZ   LYS  33           HZ3      LYS  33 -20.847  -4.042   3.402
  288    H    GLU  34           HN       GLU  34 -16.182   0.885  -0.156
  289    HA   GLU  34           HA       GLU  34 -16.406  -1.230  -2.126
  290   1HB   GLU  34           HB2      GLU  34 -17.439   0.391  -3.473
  291   2HB   GLU  34           HB1      GLU  34 -17.746   1.028  -1.859
  292   1HG   GLU  34           HG2      GLU  34 -16.017   2.642  -2.041
  293   2HG   GLU  34           HG1      GLU  34 -15.333   1.869  -3.468
  294    H    LEU  35           HN       LEU  35 -14.205   1.423  -1.499
  295    HA   LEU  35           HA       LEU  35 -12.581   1.403  -3.765
  296   1HB   LEU  35           HB2      LEU  35 -12.450   2.520  -1.225
  297   2HB   LEU  35           HB1      LEU  35 -11.022   1.484  -1.287
  298    HG   LEU  35           HG       LEU  35 -10.533   3.757  -2.141
  299   1HD1  LEU  35          HD11      LEU  35  -9.611   1.483  -3.130
  300   2HD1  LEU  35          HD13      LEU  35 -10.523   1.978  -4.557
  301   3HD1  LEU  35          HD12      LEU  35  -9.242   3.012  -3.926
  302   1HD2  LEU  35          HD23      LEU  35 -12.971   3.937  -3.058
  303   2HD2  LEU  35          HD22      LEU  35 -11.670   4.696  -3.974
  304   3HD2  LEU  35          HD21      LEU  35 -12.318   3.139  -4.489
  305    H    ILE  36           HN       ILE  36 -12.432  -0.798  -0.957
  306    HA   ILE  36           HA       ILE  36 -10.212  -2.301  -2.123
  307    HB   ILE  36           HB       ILE  36 -11.877  -3.488   0.041
  308   1HG1  ILE  36          HG12      ILE  36 -10.415  -0.857   0.247
  309   2HG1  ILE  36          HG11      ILE  36 -12.003  -1.289   0.873
  310   1HG2  ILE  36          HG22      ILE  36  -9.416  -3.995  -1.062
  311   2HG2  ILE  36          HG21      ILE  36  -8.979  -3.049   0.361
  312   3HG2  ILE  36          HG23      ILE  36  -9.919  -4.529   0.541
  313   1HD1  ILE  36          HD12      ILE  36 -10.493  -3.084   2.216
  314   2HD1  ILE  36          HD11      ILE  36  -9.317  -1.782   2.040
  315   3HD1  ILE  36          HD13      ILE  36 -10.857  -1.478   2.846
  316    H    ASN  37           HN       ASN  37 -13.591  -3.187  -1.306
  317    HA   ASN  37           HA       ASN  37 -13.490  -5.633  -2.818
  318   1HB   ASN  37           HB2      ASN  37 -15.107  -5.071  -0.938
  319   2HB   ASN  37           HB1      ASN  37 -15.981  -4.071  -2.098
  320   1HD2  ASN  37          HD22      ASN  37 -17.208  -7.712  -2.035
  321   2HD2  ASN  37          HD21      ASN  37 -16.808  -6.673  -0.752
  322    H    ASN  38           HN       ASN  38 -15.386  -2.672  -3.496
  323    HA   ASN  38           HA       ASN  38 -16.248  -3.236  -6.053
  324   1HB   ASN  38           HB2      ASN  38 -16.567  -1.086  -4.671
  325   2HB   ASN  38           HB1      ASN  38 -15.062  -0.538  -5.411
  326   1HD2  ASN  38          HD22      ASN  38 -16.524  -0.524  -8.755
  327   2HD2  ASN  38          HD21      ASN  38 -15.097  -1.008  -7.976
  328    H    GLU  39           HN       GLU  39 -13.081  -1.727  -5.301
  329    HA   GLU  39           HA       GLU  39 -12.220  -1.991  -8.078
  330   1HB   GLU  39           HB2      GLU  39 -10.561  -1.343  -5.626
  331   2HB   GLU  39           HB1      GLU  39 -10.111  -1.056  -7.305
  332   1HG   GLU  39           HG2      GLU  39 -12.478   0.200  -5.884
  333   2HG   GLU  39           HG1      GLU  39 -10.951   1.009  -6.237
  334    H    LEU  40           HN       LEU  40 -10.346  -3.132  -5.268
  335    HA   LEU  40           HA       LEU  40  -9.091  -5.222  -6.690
  336   1HB   LEU  40           HB2      LEU  40  -9.627  -4.983  -3.713
  337   2HB   LEU  40           HB1      LEU  40  -8.453  -6.067  -4.457
  338    HG   LEU  40           HG       LEU  40  -8.448  -3.043  -4.547
  339   1HD1  LEU  40          HD12      LEU  40  -7.459  -4.731  -2.625
  340   2HD1  LEU  40          HD11      LEU  40  -6.066  -4.562  -3.692
  341   3HD1  LEU  40          HD13      LEU  40  -6.806  -3.132  -2.973
  342   1HD2  LEU  40          HD23      LEU  40  -6.953  -5.125  -6.124
  343   2HD2  LEU  40          HD22      LEU  40  -7.654  -3.605  -6.677
  344   3HD2  LEU  40          HD21      LEU  40  -6.165  -3.597  -5.734
  345    H    SER  41           HN       SER  41 -10.861  -6.325  -3.882
  346    HA   SER  41           HA       SER  41 -12.302  -8.165  -3.652
  347   1HB   SER  41           HB2      SER  41 -14.053  -6.819  -4.460
  348   2HB   SER  41           HB1      SER  41 -13.350  -6.711  -6.072
  349    HG   SER  41           HG       SER  41 -14.656  -8.306  -6.489
  350    H    HIS  42           HN       HIS  42  -9.794  -8.337  -5.443
  351    HA   HIS  42           HA       HIS  42 -10.609 -10.563  -7.230
  352   1HB   HIS  42           HB2      HIS  42  -8.862  -8.550  -7.674
  353   2HB   HIS  42           HB1      HIS  42  -7.756  -9.755  -7.017
  354    HD1  HIS  42           HD1      HIS  42  -9.286 -12.269  -8.181
  355    HD2  HIS  42           HD2      HIS  42  -8.153  -8.915 -10.380
  356    HE1  HIS  42           HE1      HIS  42  -9.153 -13.011 -10.599
  357    H    PHE  43           HN       PHE  43  -8.936  -9.933  -4.231
  358    HA   PHE  43           HA       PHE  43  -8.276 -12.845  -4.055
  359   1HB   PHE  43           HB2      PHE  43  -6.969 -10.757  -2.329
  360   2HB   PHE  43           HB1      PHE  43  -6.356 -12.338  -2.816
  361    HD1  PHE  43           HD1      PHE  43  -6.631 -12.460  -5.658
  362    HD2  PHE  43           HD2      PHE  43  -5.612  -9.073  -3.219
  363    HE1  PHE  43           HE1      PHE  43  -5.474 -11.422  -7.588
  364    HE2  PHE  43           HE2      PHE  43  -4.454  -8.035  -5.151
  365    HZ   PHE  43           HZ       PHE  43  -4.385  -9.210  -7.334
  366    H    LEU  44           HN       LEU  44 -10.819 -12.381  -3.431
  367    HA   LEU  44           HA       LEU  44 -10.828 -12.403  -0.443
  368   1HB   LEU  44           HB2      LEU  44 -11.952 -10.383  -2.019
  369   2HB   LEU  44           HB1      LEU  44 -13.318 -11.404  -1.570
  370    HG   LEU  44           HG       LEU  44 -12.087 -11.300   0.815
  371   1HD1  LEU  44          HD12      LEU  44 -10.719  -9.350  -0.767
  372   2HD1  LEU  44          HD11      LEU  44 -11.669  -8.499   0.451
  373   3HD1  LEU  44          HD13      LEU  44 -10.494  -9.719   0.943
  374   1HD2  LEU  44          HD21      LEU  44 -13.996  -9.332  -0.455
  375   2HD2  LEU  44          HD23      LEU  44 -14.374 -10.679   0.618
  376   3HD2  LEU  44          HD22      LEU  44 -13.575  -9.241   1.255
  377    H    GLU  45           HN       GLU  45 -10.663 -14.771  -1.680
  378    HA   GLU  45           HA       GLU  45 -13.429 -15.777  -2.092
  379   1HB   GLU  45           HB2      GLU  45 -10.787 -17.209  -2.488
  380   2HB   GLU  45           HB1      GLU  45 -12.374 -17.779  -2.999
  381   1HG   GLU  45           HG2      GLU  45 -12.371 -15.361  -4.198
  382   2HG   GLU  45           HG1      GLU  45 -10.639 -15.691  -4.203
  383    H    GLU  46           HN       GLU  46 -10.554 -17.265  -0.610
  384    HA   GLU  46           HA       GLU  46 -12.317 -18.312   1.540
  385   1HB   GLU  46           HB2      GLU  46  -9.446 -19.004   0.832
  386   2HB   GLU  46           HB1      GLU  46 -10.425 -19.811   2.059
  387   1HG   GLU  46           HG2      GLU  46 -11.805 -20.829   0.487
  388   2HG   GLU  46           HG1      GLU  46 -11.490 -19.598  -0.737
  389    H    ILE  47           HN       ILE  47  -9.738 -16.048   0.967
  390    HA   ILE  47           HA       ILE  47  -8.711 -14.498   2.395
  391    HB   ILE  47           HB       ILE  47 -11.050 -15.244   4.176
  392   1HG1  ILE  47          HG12      ILE  47 -10.820 -12.687   2.636
  393   2HG1  ILE  47          HG11      ILE  47 -11.276 -14.147   1.758
  394   1HG2  ILE  47          HG23      ILE  47  -8.995 -14.128   5.251
  395   2HG2  ILE  47          HG22      ILE  47  -9.398 -12.718   4.272
  396   3HG2  ILE  47          HG21      ILE  47 -10.545 -13.316   5.470
  397   1HD1  ILE  47          HD11      ILE  47 -12.736 -13.970   4.254
  398   2HD1  ILE  47          HD13      ILE  47 -12.969 -12.507   3.297
  399   3HD1  ILE  47          HD12      ILE  47 -13.360 -14.083   2.607
  400    H    LYS  48           HN       LYS  48  -6.777 -15.198   3.162
  401    HA   LYS  48           HA       LYS  48  -6.676 -17.508   5.004
  402   1HB   LYS  48           HB2      LYS  48  -5.072 -17.244   3.063
  403   2HB   LYS  48           HB1      LYS  48  -4.371 -15.870   3.919
  404   1HG   LYS  48           HG2      LYS  48  -4.662 -18.228   5.627
  405   2HG   LYS  48           HG1      LYS  48  -3.615 -18.519   4.234
  406   1HD   LYS  48           HD2      LYS  48  -2.168 -16.717   4.821
  407   2HD   LYS  48           HD1      LYS  48  -3.320 -16.077   5.993
  408   1HE   LYS  48           HE2      LYS  48  -2.385 -17.337   7.601
  409   2HE   LYS  48           HE1      LYS  48  -2.789 -18.792   6.690
  410   1HZ   LYS  48           HZ1      LYS  48  -0.467 -17.216   5.851
  411   2HZ   LYS  48           HZ3      LYS  48  -0.319 -18.187   7.233
  412   3HZ   LYS  48           HZ2      LYS  48  -0.735 -18.890   5.742
  413    H    GLU  49           HN       GLU  49  -5.760 -14.061   4.948
  414    HA   GLU  49           HA       GLU  49  -5.028 -14.142   7.799
  415   1HB   GLU  49           HB2      GLU  49  -4.926 -12.126   5.598
  416   2HB   GLU  49           HB1      GLU  49  -5.031 -11.517   7.251
  417   1HG   GLU  49           HG2      GLU  49  -3.044 -13.669   6.591
  418   2HG   GLU  49           HG1      GLU  49  -2.672 -11.990   6.203
  419    H    GLN  50           HN       GLN  50  -7.428 -14.990   8.058
  420    HA   GLN  50           HA       GLN  50  -9.699 -13.422   7.781
  421   1HB   GLN  50           HB2      GLN  50  -9.523 -15.759   8.786
  422   2HB   GLN  50           HB1      GLN  50  -9.110 -14.972  10.310
  423   1HG   GLN  50           HG2      GLN  50 -11.396 -13.641   9.238
  424   2HG   GLN  50           HG1      GLN  50 -11.706 -15.377   9.182
  425   1HE2  GLN  50          HE22      GLN  50 -11.528 -13.471  12.777
  426   2HE2  GLN  50          HE21      GLN  50 -11.206 -12.637  11.334
  427    H    GLU  51           HN       GLU  51  -7.014 -12.880   9.948
  428    HA   GLU  51           HA       GLU  51  -8.490 -11.010  11.643
  429   1HB   GLU  51           HB2      GLU  51  -6.048 -12.391  11.824
  430   2HB   GLU  51           HB1      GLU  51  -5.612 -10.683  11.749
  431   1HG   GLU  51           HG2      GLU  51  -7.033 -10.158  13.623
  432   2HG   GLU  51           HG1      GLU  51  -7.735 -11.776  13.611
  433    H    VAL  52           HN       VAL  52  -6.143 -10.725   8.972
  434    HA   VAL  52           HA       VAL  52  -5.991  -7.851   9.113
  435    HB   VAL  52           HB       VAL  52  -5.440  -9.747   6.809
  436   1HG1  VAL  52          HG11      VAL  52  -5.594  -6.881   6.902
  437   2HG1  VAL  52          HG13      VAL  52  -3.912  -7.356   6.665
  438   3HG1  VAL  52          HG12      VAL  52  -5.152  -7.914   5.542
  439   1HG2  VAL  52          HG22      VAL  52  -4.122  -9.549   9.202
  440   2HG2  VAL  52          HG21      VAL  52  -3.361 -10.043   7.689
  441   3HG2  VAL  52          HG23      VAL  52  -3.249  -8.368   8.228
  442    H    VAL  53           HN       VAL  53  -7.898 -10.060   7.054
  443    HA   VAL  53           HA       VAL  53  -9.265  -7.867   5.733
  444    HB   VAL  53           HB       VAL  53  -9.983 -10.810   5.892
  445   1HG1  VAL  53          HG12      VAL  53 -11.554  -8.701   5.029
  446   2HG1  VAL  53          HG11      VAL  53 -10.791  -9.257   3.538
  447   3HG1  VAL  53          HG13      VAL  53 -11.732 -10.380   4.520
  448   1HG2  VAL  53          HG23      VAL  53  -7.861  -9.416   4.555
  449   2HG2  VAL  53          HG22      VAL  53  -8.261 -11.132   4.476
  450   3HG2  VAL  53          HG21      VAL  53  -8.999 -10.003   3.340
  451    H    ASP  54           HN       ASP  54  -9.866  -9.830   8.590
  452    HA   ASP  54           HA       ASP  54 -12.629  -8.893   8.838
  453   1HB   ASP  54           HB2      ASP  54 -11.873 -11.098   9.753
  454   2HB   ASP  54           HB1      ASP  54 -10.881 -10.229  10.924
  455    H    LYS  55           HN       LYS  55  -9.481  -7.759   9.722
  456    HA   LYS  55           HA       LYS  55 -10.407  -6.058  11.900
  457   1HB   LYS  55           HB2      LYS  55  -8.059  -6.852  11.768
  458   2HB   LYS  55           HB1      LYS  55  -7.845  -5.936  10.277
  459   1HG   LYS  55           HG2      LYS  55  -8.842  -4.542  12.745
  460   2HG   LYS  55           HG1      LYS  55  -7.117  -4.863  12.558
  461   1HD   LYS  55           HD2      LYS  55  -7.538  -3.862  10.137
  462   2HD   LYS  55           HD1      LYS  55  -8.898  -3.083  10.945
  463   1HE   LYS  55           HE2      LYS  55  -6.274  -2.989  12.349
  464   2HE   LYS  55           HE1      LYS  55  -6.443  -1.989  10.907
  465   1HZ   LYS  55           HZ2      LYS  55  -8.771  -1.584  12.241
  466   2HZ   LYS  55           HZ1      LYS  55  -7.631  -1.674  13.497
  467   3HZ   LYS  55           HZ3      LYS  55  -7.433  -0.538  12.254
  468    H    VAL  56           HN       VAL  56  -9.600  -5.584   8.452
  469    HA   VAL  56           HA       VAL  56 -10.307  -2.755   8.573
  470    HB   VAL  56           HB       VAL  56 -10.192  -2.987   6.037
  471   1HG1  VAL  56          HG12      VAL  56  -8.145  -2.994   8.007
  472   2HG1  VAL  56          HG11      VAL  56  -7.605  -4.036   6.691
  473   3HG1  VAL  56          HG13      VAL  56  -8.056  -2.363   6.363
  474   1HG2  VAL  56          HG21      VAL  56 -10.242  -5.756   6.750
  475   2HG2  VAL  56          HG23      VAL  56 -10.217  -5.044   5.140
  476   3HG2  VAL  56          HG22      VAL  56  -8.705  -5.410   5.968
  477    H    MET  57           HN       MET  57 -11.846  -5.760   7.581
  478    HA   MET  57           HA       MET  57 -14.226  -4.523   6.500
  479   1HB   MET  57           HB2      MET  57 -13.326  -6.927   6.122
  480   2HB   MET  57           HB1      MET  57 -14.082  -7.300   7.673
  481   1HG   MET  57           HG2      MET  57 -15.613  -7.795   5.799
  482   2HG   MET  57           HG1      MET  57 -16.250  -6.499   6.813
  483   1HE   MET  57           HE1      MET  57 -14.120  -7.454   3.888
  484   2HE   MET  57           HE3      MET  57 -14.138  -6.088   2.766
  485   3HE   MET  57           HE2      MET  57 -13.184  -6.005   4.245
  486    H    GLU  58           HN       GLU  58 -13.107  -5.350   9.695
  487    HA   GLU  58           HA       GLU  58 -15.751  -5.340  10.920
  488   1HB   GLU  58           HB2      GLU  58 -12.943  -5.510  11.868
  489   2HB   GLU  58           HB1      GLU  58 -14.094  -4.804  13.001
  490   1HG   GLU  58           HG2      GLU  58 -15.585  -6.867  12.303
  491   2HG   GLU  58           HG1      GLU  58 -14.035  -7.572  11.849
  492    H    THR  59           HN       THR  59 -13.041  -2.972  10.882
  493    HA   THR  59           HA       THR  59 -14.555  -0.922  12.221
  494    HB   THR  59           HB       THR  59 -12.438  -0.245  10.201
  495    HG1  THR  59           HG1      THR  59 -11.286  -1.767  11.106
  496   1HG2  THR  59          HG23      THR  59 -13.211   0.703  12.969
  497   2HG2  THR  59          HG22      THR  59 -11.760   1.254  12.132
  498   3HG2  THR  59          HG21      THR  59 -13.350   1.589  11.450
  499    H    LEU  60           HN       LEU  60 -14.211  -1.946   8.896
  500    HA   LEU  60           HA       LEU  60 -15.447   0.267   7.595
  501   1HB   LEU  60           HB2      LEU  60 -14.890  -2.587   6.971
  502   2HB   LEU  60           HB1      LEU  60 -16.142  -1.811   6.007
  503    HG   LEU  60           HG       LEU  60 -13.358  -0.690   6.432
  504   1HD1  LEU  60          HD13      LEU  60 -14.547  -2.475   4.340
  505   2HD1  LEU  60          HD12      LEU  60 -13.368  -1.264   3.840
  506   3HD1  LEU  60          HD11      LEU  60 -12.925  -2.487   5.030
  507   1HD2  LEU  60          HD21      LEU  60 -15.849   0.274   5.155
  508   2HD2  LEU  60          HD23      LEU  60 -14.488   1.190   5.801
  509   3HD2  LEU  60          HD22      LEU  60 -14.386   0.477   4.190
  510    H    ASP  61           HN       ASP  61 -16.845  -2.843   8.663
  511    HA   ASP  61           HA       ASP  61 -19.568  -1.892   8.188
  512   1HB   ASP  61           HB2      ASP  61 -18.302  -4.406   8.559
  513   2HB   ASP  61           HB1      ASP  61 -19.473  -4.227   9.865
  514    H    GLU  62           HN       GLU  62 -17.320  -1.417  10.639
  515    HA   GLU  62           HA       GLU  62 -18.996  -1.595  12.966
  516   1HB   GLU  62           HB2      GLU  62 -16.394  -1.331  12.767
  517   2HB   GLU  62           HB1      GLU  62 -16.757   0.395  12.750
  518   1HG   GLU  62           HG2      GLU  62 -18.276  -0.244  14.829
  519   2HG   GLU  62           HG1      GLU  62 -17.158  -1.603  14.942
  520    H    ASP  63           HN       ASP  63 -18.253   1.057  10.729
  521    HA   ASP  63           HA       ASP  63 -20.532   2.551  11.958
  522   1HB   ASP  63           HB2      ASP  63 -17.813   3.341  11.767
  523   2HB   ASP  63           HB1      ASP  63 -18.721   4.331  10.626
  524    H    GLY  64           HN       GLY  64 -18.532   2.452   9.000
  525   1HA   GLY  64           HA2      GLY  64 -19.357   2.130   6.772
  526   2HA   GLY  64           HA1      GLY  64 -21.000   2.334   7.380
  527    H    ASP  65           HN       ASP  65 -20.995   4.730   8.617
  528    HA   ASP  65           HA       ASP  65 -20.285   6.602   6.406
  529   1HB   ASP  65           HB2      ASP  65 -22.707   6.275   7.462
  530   2HB   ASP  65           HB1      ASP  65 -22.075   7.395   8.670
  531    H    GLY  66           HN       GLY  66 -18.086   6.934   7.061
  532   1HA   GLY  66           HA2      GLY  66 -17.831   8.784   9.351
  533   2HA   GLY  66           HA1      GLY  66 -16.825   7.336   9.380
  534    H    GLU  67           HN       GLU  67 -15.392   9.577   9.366
  535    HA   GLU  67           HA       GLU  67 -14.663  10.073   6.509
  536   1HB   GLU  67           HB2      GLU  67 -14.324  11.738   9.012
  537   2HB   GLU  67           HB1      GLU  67 -13.450  12.094   7.521
  538   1HG   GLU  67           HG2      GLU  67 -15.479  12.456   6.307
  539   2HG   GLU  67           HG1      GLU  67 -16.457  11.783   7.611
  540    H    CYS  68           HN       CYS  68 -12.779   9.186   5.833
  541    HA   CYS  68           HA       CYS  68 -10.842   8.254   7.905
  542   1HB   CYS  68           HB2      CYS  68 -11.604   7.279   5.175
  543   2HB   CYS  68           HB1      CYS  68  -9.959   6.990   5.742
  544    HG   CYS  68           HG       CYS  68 -11.302   5.965   7.969
  545    H    ASP  69           HN       ASP  69  -8.490   8.273   6.948
  546    HA   ASP  69           HA       ASP  69  -8.094  10.936   5.640
  547   1HB   ASP  69           HB2      ASP  69  -6.191   9.466   7.492
  548   2HB   ASP  69           HB1      ASP  69  -5.983  11.095   6.849
  549    H    PHE  70           HN       PHE  70  -5.587  10.837   4.741
  550    HA   PHE  70           HA       PHE  70  -5.728   8.912   2.568
  551   1HB   PHE  70           HB2      PHE  70  -4.743  11.174   2.280
  552   2HB   PHE  70           HB1      PHE  70  -3.440  10.730   3.380
  553    HD1  PHE  70           HD1      PHE  70  -5.042   8.480   0.893
  554    HD2  PHE  70           HD2      PHE  70  -1.581  10.827   1.874
  555    HE1  PHE  70           HE1      PHE  70  -3.804   7.440  -0.988
  556    HE2  PHE  70           HE2      PHE  70  -0.345   9.787  -0.008
  557    HZ   PHE  70           HZ       PHE  70  -1.456   8.095  -1.439
  558    H    GLN  71           HN       GLN  71  -3.515   9.356   5.345
  559    HA   GLN  71           HA       GLN  71  -1.943   7.031   4.825
  560   1HB   GLN  71           HB2      GLN  71  -2.574   8.452   7.430
  561   2HB   GLN  71           HB1      GLN  71  -1.359   7.184   7.267
  562   1HG   GLN  71           HG2      GLN  71  -0.891   9.050   5.179
  563   2HG   GLN  71           HG1      GLN  71  -1.112   9.980   6.661
  564   1HE2  GLN  71          HE22      GLN  71   1.784   7.089   6.987
  565   2HE2  GLN  71          HE21      GLN  71   0.254   6.676   6.382
  566    H    GLU  72           HN       GLU  72  -5.128   7.425   6.152
  567    HA   GLU  72           HA       GLU  72  -5.181   4.800   7.436
  568   1HB   GLU  72           HB2      GLU  72  -7.090   7.042   6.990
  569   2HB   GLU  72           HB1      GLU  72  -7.793   5.440   7.198
  570   1HG   GLU  72           HG2      GLU  72  -5.745   5.713   9.150
  571   2HG   GLU  72           HG1      GLU  72  -6.713   7.186   9.204
  572    H    PHE  73           HN       PHE  73  -6.771   6.201   4.551
  573    HA   PHE  73           HA       PHE  73  -7.815   3.735   3.577
  574   1HB   PHE  73           HB2      PHE  73  -8.767   5.484   2.421
  575   2HB   PHE  73           HB1      PHE  73  -7.299   6.452   2.475
  576    HD1  PHE  73           HD1      PHE  73  -5.422   5.962   0.888
  577    HD2  PHE  73           HD2      PHE  73  -9.257   4.060   0.550
  578    HE1  PHE  73           HE1      PHE  73  -4.884   5.293  -1.438
  579    HE2  PHE  73           HE2      PHE  73  -8.719   3.392  -1.778
  580    HZ   PHE  73           HZ       PHE  73  -6.533   4.009  -2.772
  581    H    MET  74           HN       MET  74  -4.620   5.048   3.627
  582    HA   MET  74           HA       MET  74  -3.569   3.406   1.454
  583   1HB   MET  74           HB2      MET  74  -2.660   5.589   2.969
  584   2HB   MET  74           HB1      MET  74  -1.603   4.259   3.422
  585   1HG   MET  74           HG2      MET  74  -0.775   5.559   1.440
  586   2HG   MET  74           HG1      MET  74  -1.017   3.847   1.107
  587   1HE   MET  74           HE2      MET  74  -1.934   2.941  -0.333
  588   2HE   MET  74           HE1      MET  74  -3.622   3.153  -0.784
  589   3HE   MET  74           HE3      MET  74  -2.337   3.725  -1.857
  590    H    ALA  75           HN       ALA  75  -2.984   3.399   4.981
  591    HA   ALA  75           HA       ALA  75  -1.734   0.830   4.984
  592   1HB   ALA  75           HB3      ALA  75  -2.909   2.635   7.046
  593   2HB   ALA  75           HB2      ALA  75  -2.685   0.946   7.496
  594   3HB   ALA  75           HB1      ALA  75  -1.304   1.909   6.972
  595    H    PHE  76           HN       PHE  76  -5.024   1.737   4.659
  596    HA   PHE  76           HA       PHE  76  -6.129  -0.773   5.688
  597   1HB   PHE  76           HB2      PHE  76  -7.147   1.787   4.821
  598   2HB   PHE  76           HB1      PHE  76  -8.017   0.487   4.007
  599    HD1  PHE  76           HD1      PHE  76  -6.900   1.673   7.366
  600    HD2  PHE  76           HD2      PHE  76  -9.622  -0.808   5.159
  601    HE1  PHE  76           HE1      PHE  76  -8.170   1.217   9.448
  602    HE2  PHE  76           HE2      PHE  76 -10.893  -1.263   7.240
  603    HZ   PHE  76           HZ       PHE  76 -10.166  -0.251   9.384
  604    H    VAL  77           HN       VAL  77  -5.544   0.676   2.490
  605    HA   VAL  77           HA       VAL  77  -6.599  -1.578   1.012
  606    HB   VAL  77           HB       VAL  77  -4.648   0.569   0.137
  607   1HG1  VAL  77          HG11      VAL  77  -5.116  -1.676  -1.215
  608   2HG1  VAL  77          HG13      VAL  77  -6.585  -0.818  -1.677
  609   3HG1  VAL  77          HG12      VAL  77  -5.007  -0.125  -2.046
  610   1HG2  VAL  77          HG23      VAL  77  -6.996   1.198   1.113
  611   2HG2  VAL  77          HG22      VAL  77  -6.495   1.907  -0.423
  612   3HG2  VAL  77          HG21      VAL  77  -7.611   0.542  -0.405
  613    H    SER  78           HN       SER  78  -3.489  -0.850   2.433
  614    HA   SER  78           HA       SER  78  -2.025  -2.768   0.814
  615   1HB   SER  78           HB2      SER  78  -0.223  -2.419   2.511
  616   2HB   SER  78           HB1      SER  78  -0.832  -0.915   1.831
  617    HG   SER  78           HG       SER  78  -0.778  -1.688   4.373
  618    H    MET  79           HN       MET  79  -3.113  -2.838   4.243
  619    HA   MET  79           HA       MET  79  -2.242  -5.479   4.755
  620   1HB   MET  79           HB2      MET  79  -4.089  -5.480   6.514
  621   2HB   MET  79           HB1      MET  79  -2.905  -4.183   6.631
  622   1HG   MET  79           HG2      MET  79  -4.462  -2.687   5.405
  623   2HG   MET  79           HG1      MET  79  -5.648  -3.980   5.367
  624   1HE   MET  79           HE3      MET  79  -3.234  -2.050   7.350
  625   2HE   MET  79           HE2      MET  79  -3.963  -1.696   8.915
  626   3HE   MET  79           HE1      MET  79  -3.234  -3.272   8.627
  627    H    VAL  80           HN       VAL  80  -5.360  -4.348   3.446
  628    HA   VAL  80           HA       VAL  80  -6.565  -6.940   3.367
  629    HB   VAL  80           HB       VAL  80  -8.027  -5.865   1.589
  630   1HG1  VAL  80          HG13      VAL  80  -8.439  -5.838   4.092
  631   2HG1  VAL  80          HG12      VAL  80  -7.698  -4.239   4.120
  632   3HG1  VAL  80          HG11      VAL  80  -9.182  -4.506   3.206
  633   1HG2  VAL  80          HG23      VAL  80  -5.854  -3.949   1.714
  634   2HG2  VAL  80          HG22      VAL  80  -7.170  -4.061   0.549
  635   3HG2  VAL  80          HG21      VAL  80  -7.399  -3.173   2.055
  636    H    THR  81           HN       THR  81  -4.640  -5.143   0.960
  637    HA   THR  81           HA       THR  81  -4.932  -7.163  -1.090
  638    HB   THR  81           HB       THR  81  -2.602  -5.257  -0.863
  639    HG1  THR  81           HG1      THR  81  -5.177  -4.701  -1.903
  640   1HG2  THR  81          HG21      THR  81  -3.339  -7.145  -2.755
  641   2HG2  THR  81          HG23      THR  81  -3.960  -5.638  -3.427
  642   3HG2  THR  81          HG22      THR  81  -2.248  -5.790  -3.031
  643    H    THR  82           HN       THR  82  -3.146  -7.042   1.809
  644    HA   THR  82           HA       THR  82  -1.146  -9.005   0.800
  645    HB   THR  82           HB       THR  82  -0.542  -8.620   3.446
  646    HG1  THR  82           HG1      THR  82  -0.723  -6.083   3.180
  647   1HG2  THR  82          HG22      THR  82   0.337  -7.384   0.876
  648   2HG2  THR  82          HG21      THR  82   0.958  -6.695   2.377
  649   3HG2  THR  82          HG23      THR  82   1.240  -8.396   2.001
  650    H    ALA  83           HN       ALA  83  -4.200  -9.087   2.013
  651    HA   ALA  83           HA       ALA  83  -3.714 -11.472   3.726
  652   1HB   ALA  83           HB3      ALA  83  -5.806  -9.398   3.567
  653   2HB   ALA  83           HB2      ALA  83  -6.420 -11.034   3.798
  654   3HB   ALA  83           HB1      ALA  83  -5.273 -10.351   4.950
  655    H    CYS  84           HN       CYS  84  -3.556 -11.353   0.710
  656    HA   CYS  84           HA       CYS  84  -5.837 -12.590  -0.454
  657   1HB   CYS  84           HB2      CYS  84  -4.241 -13.385  -2.203
  658   2HB   CYS  84           HB1      CYS  84  -4.053 -11.671  -1.842
  659    HG   CYS  84           HG       CYS  84  -1.686 -12.910  -1.820
  660    H    HIS  85           HN       HIS  85  -6.558 -14.668  -0.414
  661    HA   HIS  85           HA       HIS  85  -6.022 -16.495   1.556
  662   1HB   HIS  85           HB2      HIS  85  -6.424 -18.223  -0.564
  663   2HB   HIS  85           HB1      HIS  85  -7.697 -17.455   0.377
  664    HD1  HIS  85           HD1      HIS  85  -6.044 -17.397  -2.967
  665    HD2  HIS  85           HD2      HIS  85  -8.901 -15.167  -0.906
  666    HE1  HIS  85           HE1      HIS  85  -7.169 -15.916  -4.683
  667    H    GLU  86           HN       GLU  86  -4.883 -17.668  -1.563
  668    HA   GLU  86           HA       GLU  86  -2.638 -18.993  -0.364
  669   1HB   GLU  86           HB2      GLU  86  -3.438 -18.419  -3.216
  670   2HB   GLU  86           HB1      GLU  86  -1.914 -19.219  -2.834
  671   1HG   GLU  86           HG2      GLU  86  -3.027 -21.047  -1.771
  672   2HG   GLU  86           HG1      GLU  86  -4.568 -20.191  -1.762
  673    H    PHE  87           HN       PHE  87  -0.389 -18.571  -1.637
  674    HA   PHE  87           HA       PHE  87   0.206 -15.667  -1.241
  675   1HB   PHE  87           HB2      PHE  87   1.266 -17.407   0.325
  676   2HB   PHE  87           HB1      PHE  87   2.200 -17.933  -1.075
  677    HD1  PHE  87           HD1      PHE  87   1.140 -14.566   0.219
  678    HD2  PHE  87           HD2      PHE  87   4.376 -17.128  -0.971
  679    HE1  PHE  87           HE1      PHE  87   2.746 -12.710   0.586
  680    HE2  PHE  87           HE2      PHE  87   5.979 -15.274  -0.606
  681    HZ   PHE  87           HZ       PHE  87   5.165 -13.066   0.171
  682    H    PHE  88           HN       PHE  88   0.215 -14.811  -3.302
  683    HA   PHE  88           HA       PHE  88   0.789 -14.549  -5.568
  684   1HB   PHE  88           HB2      PHE  88   3.179 -16.066  -4.494
  685   2HB   PHE  88           HB1      PHE  88   3.103 -15.455  -6.146
  686    HD1  PHE  88           HD1      PHE  88   2.472 -14.263  -2.636
  687    HD2  PHE  88           HD2      PHE  88   3.965 -13.335  -6.557
  688    HE1  PHE  88           HE1      PHE  88   3.169 -12.021  -1.840
  689    HE2  PHE  88           HE2      PHE  88   4.660 -11.093  -5.759
  690    HZ   PHE  88           HZ       PHE  88   4.261 -10.435  -3.401
  691    H    GLU  89           HN       GLU  89  -1.126 -16.168  -5.793
  692    HA   GLU  89           HA       GLU  89  -0.207 -18.343  -7.558
  693   1HB   GLU  89           HB2      GLU  89  -1.014 -18.827  -4.842
  694   2HB   GLU  89           HB1      GLU  89  -2.206 -19.534  -5.932
  695   1HG   GLU  89           HG2      GLU  89  -0.681 -20.997  -6.879
  696   2HG   GLU  89           HG1      GLU  89   0.693 -19.942  -6.549
  697    H    HIS  90           HN       HIS  90  -3.159 -17.217  -5.885
  698    HA   HIS  90           HA       HIS  90  -5.265 -16.646  -6.752
  699   1HB   HIS  90           HB2      HIS  90  -4.072 -14.997  -8.083
  700   2HB   HIS  90           HB1      HIS  90  -3.598 -16.231  -9.250
  701    HD1  HIS  90           HD1      HIS  90  -5.019 -16.173 -11.280
  702    HD2  HIS  90           HD2      HIS  90  -7.187 -15.090  -7.886
  703    HE1  HIS  90           HE1      HIS  90  -7.378 -15.697 -12.061
  704    H    GLU  91           HN       GLU  91  -3.856 -19.437  -7.199
  705    HA   GLU  91           HA       GLU  91  -6.183 -20.633  -8.501
  706   1HB   GLU  91           HB2      GLU  91  -3.827 -20.031 -10.052
  707   2HB   GLU  91           HB1      GLU  91  -4.035 -21.778  -9.943
  708   1HG   GLU  91           HG2      GLU  91  -6.053 -21.751 -11.059
  709   2HG   GLU  91           HG1      GLU  91  -6.460 -20.129 -10.498
  710   1H    MET   0           HT3      MET   0 -10.246  -4.071 -13.541
  711   2H    MET   0           HT2      MET   0  -9.584  -5.218 -14.607
  712   3H    MET   0           HT1      MET   0  -8.643  -4.586 -13.341
  713    HA   MET   0           HA       MET   0  -7.855  -3.360 -15.088
  714   1HB   MET   0           HB2      MET   0  -9.765  -4.411 -16.545
  715   2HB   MET   0           HB1      MET   0 -10.609  -2.900 -16.205
  716   1HG   MET   0           HG2      MET   0  -9.030  -1.608 -17.337
  717   2HG   MET   0           HG1      MET   0  -7.761  -2.819 -17.156
  718   1HE   MET   0           HE3      MET   0 -11.101  -1.890 -18.643
  719   2HE   MET   0           HE2      MET   0 -11.397  -3.036 -19.948
  720   3HE   MET   0           HE1      MET   0 -11.505  -3.570 -18.273
  721    H    SER   1           HN       SER   1  -8.824  -2.597 -12.467
  722    HA   SER   1           HA       SER   1  -9.923   0.128 -12.994
  723   1HB   SER   1           HB2      SER   1 -10.667   0.159 -10.726
  724   2HB   SER   1           HB1      SER   1 -11.058  -1.451 -11.326
  725    HG   SER   1           HG       SER   1  -9.851  -2.160  -9.773
  726    H    GLU   2           HN       GLU   2  -9.018   1.565 -10.889
  727    HA   GLU   2           HA       GLU   2  -6.184   1.892 -11.532
  728   1HB   GLU   2           HB2      GLU   2  -7.762   3.348  -9.397
  729   2HB   GLU   2           HB1      GLU   2  -6.300   3.894 -10.218
  730   1HG   GLU   2           HG2      GLU   2  -9.015   3.464 -11.497
  731   2HG   GLU   2           HG1      GLU   2  -8.246   5.019 -11.182
  732    H    LEU   3           HN       LEU   3  -8.081   0.981  -8.658
  733    HA   LEU   3           HA       LEU   3  -5.782   0.622  -6.948
  734   1HB   LEU   3           HB2      LEU   3  -8.449   0.753  -6.497
  735   2HB   LEU   3           HB1      LEU   3  -8.215  -0.993  -6.427
  736    HG   LEU   3           HG       LEU   3  -6.225  -0.480  -4.867
  737   1HD1  LEU   3          HD12      LEU   3  -6.631   2.083  -5.561
  738   2HD1  LEU   3          HD11      LEU   3  -7.676   2.019  -4.142
  739   3HD1  LEU   3          HD13      LEU   3  -5.964   1.629  -3.993
  740   1HD2  LEU   3          HD21      LEU   3  -9.123  -0.465  -4.345
  741   2HD2  LEU   3          HD23      LEU   3  -7.850  -1.414  -3.581
  742   3HD2  LEU   3          HD22      LEU   3  -8.161   0.237  -3.046
  743    H    GLU   4           HN       GLU   4  -7.577  -1.474  -9.127
  744    HA   GLU   4           HA       GLU   4  -6.361  -3.939  -8.248
  745   1HB   GLU   4           HB2      GLU   4  -8.259  -3.102 -10.233
  746   2HB   GLU   4           HB1      GLU   4  -7.053  -4.132 -11.003
  747   1HG   GLU   4           HG2      GLU   4  -7.435  -5.891  -9.380
  748   2HG   GLU   4           HG1      GLU   4  -8.512  -4.851  -8.446
  749    H    LYS   5           HN       LYS   5  -5.821  -2.140 -11.303
  750    HA   LYS   5           HA       LYS   5  -3.477  -3.564 -12.018
  751   1HB   LYS   5           HB2      LYS   5  -3.954  -2.385 -13.876
  752   2HB   LYS   5           HB1      LYS   5  -4.957  -1.264 -12.969
  753   1HG   LYS   5           HG2      LYS   5  -1.981  -0.951 -12.781
  754   2HG   LYS   5           HG1      LYS   5  -2.785  -0.437 -14.260
  755   1HD   LYS   5           HD2      LYS   5  -4.371   0.916 -12.881
  756   2HD   LYS   5           HD1      LYS   5  -3.433   0.496 -11.451
  757   1HE   LYS   5           HE2      LYS   5  -1.500   1.637 -12.263
  758   2HE   LYS   5           HE1      LYS   5  -2.191   1.797 -13.879
  759   1HZ   LYS   5           HZ2      LYS   5  -3.917   3.220 -12.951
  760   2HZ   LYS   5           HZ1      LYS   5  -3.224   3.082 -11.406
  761   3HZ   LYS   5           HZ3      LYS   5  -2.373   3.861 -12.649
  762    H    ALA   6           HN       ALA   6  -3.894  -0.747  -9.921
  763    HA   ALA   6           HA       ALA   6  -1.012  -0.299  -9.698
  764   1HB   ALA   6           HB3      ALA   6  -3.401   0.811  -8.208
  765   2HB   ALA   6           HB2      ALA   6  -1.739   1.267  -7.832
  766   3HB   ALA   6           HB1      ALA   6  -2.414   1.627  -9.420
  767    H    MET   7           HN       MET   7  -3.371  -0.953  -7.104
  768    HA   MET   7           HA       MET   7  -1.606  -1.861  -5.160
  769   1HB   MET   7           HB2      MET   7  -4.070  -1.532  -4.850
  770   2HB   MET   7           HB1      MET   7  -4.344  -3.045  -5.719
  771   1HG   MET   7           HG2      MET   7  -4.332  -3.807  -3.524
  772   2HG   MET   7           HG1      MET   7  -2.631  -4.000  -3.944
  773   1HE   MET   7           HE2      MET   7  -0.860  -2.719  -3.444
  774   2HE   MET   7           HE1      MET   7  -0.660  -1.688  -2.028
  775   3HE   MET   7           HE3      MET   7  -1.035  -3.405  -1.832
  776    H    VAL   8           HN       VAL   8  -3.355  -3.925  -7.481
  777    HA   VAL   8           HA       VAL   8  -2.024  -6.340  -6.774
  778    HB   VAL   8           HB       VAL   8  -3.019  -5.692  -9.556
  779   1HG1  VAL   8          HG11      VAL   8  -2.595  -8.167  -7.892
  780   2HG1  VAL   8          HG13      VAL   8  -3.746  -8.172  -9.228
  781   3HG1  VAL   8          HG12      VAL   8  -2.044  -7.833  -9.535
  782   1HG2  VAL   8          HG23      VAL   8  -4.495  -5.362  -7.209
  783   2HG2  VAL   8          HG22      VAL   8  -5.161  -5.606  -8.824
  784   3HG2  VAL   8          HG21      VAL   8  -4.922  -6.984  -7.752
  785    H    ALA   9           HN       ALA   9  -1.138  -3.744  -9.005
  786    HA   ALA   9           HA       ALA   9   1.016  -5.070 -10.329
  787   1HB   ALA   9           HB1      ALA   9   0.338  -2.207  -9.732
  788   2HB   ALA   9           HB3      ALA   9   1.940  -2.591 -10.359
  789   3HB   ALA   9           HB2      ALA   9   0.505  -3.011 -11.293
  790    H    LEU  10           HN       LEU  10   0.778  -3.469  -7.192
  791    HA   LEU  10           HA       LEU  10   3.537  -3.335  -6.552
  792   1HB   LEU  10           HB2      LEU  10   1.029  -3.092  -5.150
  793   2HB   LEU  10           HB1      LEU  10   2.141  -4.072  -4.194
  794    HG   LEU  10           HG       LEU  10   3.074  -1.507  -5.464
  795   1HD1  LEU  10          HD12      LEU  10   0.986  -1.661  -3.575
  796   2HD1  LEU  10          HD11      LEU  10   2.426  -1.221  -2.657
  797   3HD1  LEU  10          HD13      LEU  10   1.911  -0.228  -4.019
  798   1HD2  LEU  10          HD22      LEU  10   3.972  -3.416  -3.343
  799   2HD2  LEU  10          HD21      LEU  10   4.914  -2.614  -4.597
  800   3HD2  LEU  10          HD23      LEU  10   4.407  -1.717  -3.164
  801    H    ILE  11           HN       ILE  11   1.199  -5.993  -6.225
  802    HA   ILE  11           HA       ILE  11   2.908  -7.832  -4.886
  803    HB   ILE  11           HB       ILE  11   0.593  -8.194  -6.797
  804   1HG1  ILE  11          HG12      ILE  11  -0.582  -8.886  -4.800
  805   2HG1  ILE  11          HG11      ILE  11   0.914  -8.903  -3.867
  806   1HG2  ILE  11          HG23      ILE  11   2.176 -10.356  -5.374
  807   2HG2  ILE  11          HG22      ILE  11   0.653 -10.607  -6.226
  808   3HG2  ILE  11          HG21      ILE  11   2.092 -10.114  -7.119
  809   1HD1  ILE  11          HD13      ILE  11  -0.267  -6.432  -5.165
  810   2HD1  ILE  11          HD12      ILE  11  -0.455  -6.852  -3.462
  811   3HD1  ILE  11          HD11      ILE  11   1.145  -6.490  -4.110
  812    H    ASP  12           HN       ASP  12   2.603  -6.951  -8.286
  813    HA   ASP  12           HA       ASP  12   4.216  -9.032  -9.390
  814   1HB   ASP  12           HB2      ASP  12   2.750  -7.263 -10.586
  815   2HB   ASP  12           HB1      ASP  12   4.157  -6.213 -10.464
  816    H    VAL  13           HN       VAL  13   5.096  -5.700  -8.440
  817    HA   VAL  13           HA       VAL  13   7.805  -5.687  -8.992
  818    HB   VAL  13           HB       VAL  13   6.373  -4.641  -6.535
  819   1HG1  VAL  13          HG11      VAL  13   9.233  -4.778  -7.180
  820   2HG1  VAL  13          HG13      VAL  13   8.669  -3.139  -6.858
  821   3HG1  VAL  13          HG12      VAL  13   8.444  -4.401  -5.648
  822   1HG2  VAL  13          HG23      VAL  13   6.832  -3.729  -9.292
  823   2HG2  VAL  13          HG22      VAL  13   5.641  -3.182  -8.111
  824   3HG2  VAL  13          HG21      VAL  13   7.280  -2.532  -8.076
  825    H    PHE  14           HN       PHE  14   6.196  -7.355  -6.313
  826    HA   PHE  14           HA       PHE  14   8.558  -8.142  -4.910
  827   1HB   PHE  14           HB2      PHE  14   5.995  -8.358  -4.293
  828   2HB   PHE  14           HB1      PHE  14   6.165  -9.947  -5.036
  829    HD1  PHE  14           HD2      PHE  14   9.328  -9.716  -4.113
  830    HD2  PHE  14           HD1      PHE  14   5.493  -9.722  -2.179
  831    HE1  PHE  14           HE2      PHE  14  10.374 -10.572  -2.036
  832    HE2  PHE  14           HE1      PHE  14   6.541 -10.576  -0.102
  833    HZ   PHE  14           HZ       PHE  14   8.982 -11.000  -0.031
  834    H    HIS  15           HN       HIS  15   6.671  -9.832  -7.436
  835    HA   HIS  15           HA       HIS  15   8.507 -12.073  -7.542
  836   1HB   HIS  15           HB2      HIS  15   5.969 -11.502  -8.574
  837   2HB   HIS  15           HB1      HIS  15   7.004 -11.637  -9.997
  838    HD1  HIS  15           HD1      HIS  15   6.280 -13.969 -10.751
  839    HD2  HIS  15           HD2      HIS  15   7.534 -13.872  -6.776
  840    HE1  HIS  15           HE1      HIS  15   6.451 -16.380  -9.995
  841    H    GLN  16           HN       GLN  16   8.913  -8.908  -8.456
  842    HA   GLN  16           HA       GLN  16  10.463  -9.507 -10.908
  843   1HB   GLN  16           HB2      GLN  16   8.984  -7.296 -10.049
  844   2HB   GLN  16           HB1      GLN  16  10.663  -6.778  -9.908
  845   1HG   GLN  16           HG2      GLN  16  10.516  -6.347 -12.130
  846   2HG   GLN  16           HG1      GLN  16  10.670  -8.093 -12.327
  847   1HE2  GLN  16          HE22      GLN  16   6.904  -6.442 -12.589
  848   2HE2  GLN  16          HE21      GLN  16   8.076  -5.671 -11.633
  849    H    TYR  17           HN       TYR  17  10.987  -8.177  -7.636
  850    HA   TYR  17           HA       TYR  17  13.904  -8.194  -8.060
  851   1HB   TYR  17           HB2      TYR  17  12.186  -7.459  -5.671
  852   2HB   TYR  17           HB1      TYR  17  13.945  -7.356  -5.687
  853    HD1  TYR  17           HD1      TYR  17  10.820  -5.955  -7.051
  854    HD2  TYR  17           HD2      TYR  17  15.105  -5.672  -7.016
  855    HE1  TYR  17           HE1      TYR  17  10.681  -3.731  -8.141
  856    HE2  TYR  17           HE2      TYR  17  14.965  -3.449  -8.107
  857    HH   TYR  17           HH       TYR  17  11.817  -2.034  -9.000
  858    H    SER  18           HN       SER  18  11.677  -9.668  -5.663
  859    HA   SER  18           HA       SER  18  13.627 -11.485  -4.622
  860   1HB   SER  18           HB2      SER  18  11.314 -10.803  -3.652
  861   2HB   SER  18           HB1      SER  18  10.674 -12.083  -4.678
  862    HG   SER  18           HG       SER  18  11.248 -13.328  -3.084
  863    H    GLY  19           HN       GLY  19  11.586 -11.602  -7.455
  864   1HA   GLY  19           HA2      GLY  19  11.516 -14.389  -7.929
  865   2HA   GLY  19           HA1      GLY  19  11.503 -13.169  -9.202
  866    H    ARG  20           HN       ARG  20  14.144 -12.106  -8.222
  867    HA   ARG  20           HA       ARG  20  15.885 -13.358  -9.997
  868   1HB   ARG  20           HB2      ARG  20  16.447 -11.982  -7.365
  869   2HB   ARG  20           HB1      ARG  20  17.733 -12.529  -8.441
  870   1HG   ARG  20           HG2      ARG  20  16.934 -11.118 -10.230
  871   2HG   ARG  20           HG1      ARG  20  15.484 -10.699  -9.315
  872   1HD   ARG  20           HD2      ARG  20  16.980  -8.850  -9.061
  873   2HD   ARG  20           HD1      ARG  20  17.036  -9.735  -7.537
  874    HE   ARG  20           HE       ARG  20  19.112 -10.243  -9.621
  875   1HH1  ARG  20          HH11      ARG  20  19.054 -11.471  -6.820
  876   2HH1  ARG  20          HH12      ARG  20  20.227 -10.490  -6.006
  877   1HH2  ARG  20          HH21      ARG  20  20.228  -8.012  -8.431
  878   2HH2  ARG  20          HH22      ARG  20  20.890  -8.532  -6.918
  879    H    GLU  21           HN       GLU  21  16.460 -13.833  -6.525
  880    HA   GLU  21           HA       GLU  21  17.829 -16.275  -6.819
  881   1HB   GLU  21           HB2      GLU  21  16.135 -15.532  -4.424
  882   2HB   GLU  21           HB1      GLU  21  17.592 -16.523  -4.453
  883   1HG   GLU  21           HG2      GLU  21  18.191 -14.001  -5.663
  884   2HG   GLU  21           HG1      GLU  21  17.412 -13.707  -4.107
  885    H    GLY  22           HN       GLY  22  16.646 -18.199  -5.259
  886   1HA   GLY  22           HA2      GLY  22  14.508 -19.145  -7.053
  887   2HA   GLY  22           HA1      GLY  22  15.349 -20.118  -5.851
  888    H    ASP  23           HN       ASP  23  14.963 -18.174  -3.700
  889    HA   ASP  23           HA       ASP  23  12.630 -19.127  -2.506
  890   1HB   ASP  23           HB2      ASP  23  12.712 -16.720  -1.342
  891   2HB   ASP  23           HB1      ASP  23  13.898 -17.967  -0.973
  892    H    LYS  24           HN       LYS  24  12.886 -15.864  -3.977
  893    HA   LYS  24           HA       LYS  24  11.233 -14.536  -4.977
  894   1HB   LYS  24           HB2      LYS  24   9.924 -17.180  -5.657
  895   2HB   LYS  24           HB1      LYS  24   9.772 -15.654  -6.526
  896   1HG   LYS  24           HG2      LYS  24  12.392 -15.845  -6.724
  897   2HG   LYS  24           HG1      LYS  24  12.089 -17.557  -6.439
  898   1HD   LYS  24           HD2      LYS  24  10.614 -15.975  -8.552
  899   2HD   LYS  24           HD1      LYS  24  12.115 -16.840  -8.886
  900   1HE   LYS  24           HE2      LYS  24   9.521 -18.038  -7.875
  901   2HE   LYS  24           HE1      LYS  24  10.254 -18.288  -9.461
  902   1HZ   LYS  24           HZ2      LYS  24  12.262 -19.088  -8.077
  903   2HZ   LYS  24           HZ1      LYS  24  11.120 -19.295  -6.837
  904   3HZ   LYS  24           HZ3      LYS  24  10.942 -20.133  -8.301
  905    H    HIS  25           HN       HIS  25  10.868 -15.635  -2.139
  906    HA   HIS  25           HA       HIS  25   8.018 -14.821  -1.923
  907   1HB   HIS  25           HB2      HIS  25   9.209 -17.347  -0.754
  908   2HB   HIS  25           HB1      HIS  25   7.665 -16.670  -0.237
  909    HD1  HIS  25           HD1      HIS  25   8.877 -19.152  -2.431
  910    HD2  HIS  25           HD2      HIS  25   6.011 -16.152  -2.839
  911    HE1  HIS  25           HE1      HIS  25   7.402 -19.830  -4.376
  912    H    LYS  26           HN       LYS  26  11.016 -14.080  -1.128
  913    HA   LYS  26           HA       LYS  26  10.198 -12.833   1.424
  914   1HB   LYS  26           HB2      LYS  26  12.292 -13.633   2.551
  915   2HB   LYS  26           HB1      LYS  26  11.150 -14.931   2.202
  916   1HG   LYS  26           HG2      LYS  26  12.697 -15.987   0.959
  917   2HG   LYS  26           HG1      LYS  26  12.843 -14.572  -0.084
  918   1HD   LYS  26           HD2      LYS  26  14.777 -13.917   0.893
  919   2HD   LYS  26           HD1      LYS  26  14.156 -14.223   2.515
  920   1HE   LYS  26           HE2      LYS  26  14.533 -16.658   2.170
  921   2HE   LYS  26           HE1      LYS  26  15.235 -16.305   0.591
  922   1HZ   LYS  26           HZ2      LYS  26  16.902 -14.937   1.686
  923   2HZ   LYS  26           HZ1      LYS  26  16.235 -15.308   3.204
  924   3HZ   LYS  26           HZ3      LYS  26  16.947 -16.532   2.267
  925    H    LEU  27           HN       LEU  27  11.003 -10.785   1.482
  926    HA   LEU  27           HA       LEU  27  13.075 -10.075  -0.538
  927   1HB   LEU  27           HB2      LEU  27  10.661  -8.822   0.388
  928   2HB   LEU  27           HB1      LEU  27  12.020  -7.757   0.741
  929    HG   LEU  27           HG       LEU  27  11.259  -8.935  -1.943
  930   1HD1  LEU  27          HD13      LEU  27  10.826  -6.409  -0.581
  931   2HD1  LEU  27          HD12      LEU  27  11.722  -6.170  -2.081
  932   3HD1  LEU  27          HD11      LEU  27  10.156  -6.979  -2.110
  933   1HD2  LEU  27          HD21      LEU  27  13.858  -8.325  -0.937
  934   2HD2  LEU  27          HD23      LEU  27  13.410  -8.759  -2.587
  935   3HD2  LEU  27          HD22      LEU  27  13.428  -7.067  -2.094
  936    H    LYS  28           HN       LYS  28  13.847  -7.626   0.812
  937    HA   LYS  28           HA       LYS  28  14.944  -8.489   3.413
  938   1HB   LYS  28           HB2      LYS  28  16.673  -7.811   1.022
  939   2HB   LYS  28           HB1      LYS  28  17.275  -7.890   2.678
  940   1HG   LYS  28           HG2      LYS  28  16.267 -10.258   2.745
  941   2HG   LYS  28           HG1      LYS  28  16.149 -10.126   0.989
  942   1HD   LYS  28           HD2      LYS  28  18.677  -9.864   2.639
  943   2HD   LYS  28           HD1      LYS  28  18.257 -11.209   1.579
  944   1HE   LYS  28           HE2      LYS  28  18.069  -9.424  -0.285
  945   2HE   LYS  28           HE1      LYS  28  18.956  -8.375   0.823
  946   1HZ   LYS  28           HZ3      LYS  28  19.864 -11.062  -0.054
  947   2HZ   LYS  28           HZ2      LYS  28  20.410  -9.595  -0.713
  948   3HZ   LYS  28           HZ1      LYS  28  20.729  -9.969   0.912
  949    H    LYS  29           HN       LYS  29  16.243  -6.589   4.388
  950    HA   LYS  29           HA       LYS  29  14.645  -4.170   4.048
  951   1HB   LYS  29           HB2      LYS  29  16.165  -3.252   5.820
  952   2HB   LYS  29           HB1      LYS  29  15.383  -4.764   6.283
  953   1HG   LYS  29           HG2      LYS  29  17.750  -5.518   4.957
  954   2HG   LYS  29           HG1      LYS  29  18.205  -4.185   6.018
  955   1HD   LYS  29           HD2      LYS  29  16.740  -6.710   6.833
  956   2HD   LYS  29           HD1      LYS  29  18.399  -6.280   7.248
  957   1HE   LYS  29           HE2      LYS  29  17.682  -4.450   8.611
  958   2HE   LYS  29           HE1      LYS  29  16.033  -4.556   8.005
  959   1HZ   LYS  29           HZ1      LYS  29  16.544  -7.049   8.966
  960   2HZ   LYS  29           HZ3      LYS  29  17.295  -6.038  10.100
  961   3HZ   LYS  29           HZ2      LYS  29  15.643  -5.844   9.754
  962    H    SER  30           HN       SER  30  17.605  -5.401   2.768
  963    HA   SER  30           HA       SER  30  18.712  -2.781   2.069
  964   1HB   SER  30           HB2      SER  30  19.497  -5.616   1.751
  965   2HB   SER  30           HB1      SER  30  20.009  -4.556   0.441
  966    HG   SER  30           HG       SER  30  21.566  -4.487   2.033
  967    H    GLU  31           HN       GLU  31  17.027  -5.416   0.348
  968    HA   GLU  31           HA       GLU  31  16.957  -3.886  -2.146
  969   1HB   GLU  31           HB2      GLU  31  16.898  -6.471  -1.886
  970   2HB   GLU  31           HB1      GLU  31  15.193  -6.253  -1.493
  971   1HG   GLU  31           HG2      GLU  31  14.644  -5.572  -3.626
  972   2HG   GLU  31           HG1      GLU  31  16.236  -4.872  -3.924
  973    H    LEU  32           HN       LEU  32  15.158  -4.024   0.766
  974    HA   LEU  32           HA       LEU  32  12.651  -3.033  -0.387
  975   1HB   LEU  32           HB2      LEU  32  12.449  -4.288   1.662
  976   2HB   LEU  32           HB1      LEU  32  13.674  -3.298   2.457
  977    HG   LEU  32           HG       LEU  32  12.177  -1.313   2.194
  978   1HD1  LEU  32          HD11      LEU  32  10.926  -2.348   0.235
  979   2HD1  LEU  32          HD13      LEU  32  10.068  -3.341   1.414
  980   3HD1  LEU  32          HD12      LEU  32   9.908  -1.585   1.459
  981   1HD2  LEU  32          HD22      LEU  32  11.653  -3.692   3.848
  982   2HD2  LEU  32          HD21      LEU  32  11.793  -2.001   4.327
  983   3HD2  LEU  32          HD23      LEU  32  10.266  -2.616   3.693
  984    H    LYS  33           HN       LYS  33  15.451  -1.764   1.364
  985    HA   LYS  33           HA       LYS  33  14.639   0.937   1.649
  986   1HB   LYS  33           HB2      LYS  33  16.762  -0.271   2.515
  987   2HB   LYS  33           HB1      LYS  33  17.459   0.113   0.945
  988   1HG   LYS  33           HG2      LYS  33  16.245   2.497   1.824
  989   2HG   LYS  33           HG1      LYS  33  17.074   1.845   3.237
  990   1HD   LYS  33           HD2      LYS  33  18.900   1.428   1.191
  991   2HD   LYS  33           HD1      LYS  33  18.200   2.997   0.792
  992   1HE   LYS  33           HE2      LYS  33  18.702   3.833   3.033
  993   2HE   LYS  33           HE1      LYS  33  19.314   2.250   3.511
  994   1HZ   LYS  33           HZ2      LYS  33  21.023   2.437   1.812
  995   2HZ   LYS  33           HZ1      LYS  33  20.437   3.967   1.363
  996   3HZ   LYS  33           HZ3      LYS  33  21.112   3.738   2.902
  997    H    GLU  34           HN       GLU  34  16.275  -0.735  -1.012
  998    HA   GLU  34           HA       GLU  34  16.413   1.604  -2.716
  999   1HB   GLU  34           HB2      GLU  34  17.378   0.163  -4.299
 1000   2HB   GLU  34           HB1      GLU  34  17.758  -0.665  -2.791
 1001   1HG   GLU  34           HG2      GLU  34  16.018  -2.250  -3.089
 1002   2HG   GLU  34           HG1      GLU  34  15.271  -1.312  -4.377
 1003    H    LEU  35           HN       LEU  35  14.236  -1.114  -2.317
 1004    HA   LEU  35           HA       LEU  35  12.509  -0.823  -4.486
 1005   1HB   LEU  35           HB2      LEU  35  12.494  -2.241  -2.097
 1006   2HB   LEU  35           HB1      LEU  35  11.066  -1.212  -1.965
 1007    HG   LEU  35           HG       LEU  35  10.533  -3.364  -3.068
 1008   1HD1  LEU  35          HD11      LEU  35   9.572  -0.990  -3.726
 1009   2HD1  LEU  35          HD13      LEU  35  10.416  -1.304  -5.244
 1010   3HD1  LEU  35          HD12      LEU  35   9.162  -2.412  -4.687
 1011   1HD2  LEU  35          HD23      LEU  35  12.927  -3.423  -4.113
 1012   2HD2  LEU  35          HD22      LEU  35  11.583  -4.069  -5.053
 1013   3HD2  LEU  35          HD21      LEU  35  12.209  -2.460  -5.404
 1014    H    ILE  36           HN       ILE  36  12.496   1.018  -1.425
 1015    HA   ILE  36           HA       ILE  36  10.226   2.645  -2.291
 1016    HB   ILE  36           HB       ILE  36  11.993   3.566  -0.079
 1017   1HG1  ILE  36          HG12      ILE  36  10.537   0.924  -0.129
 1018   2HG1  ILE  36          HG11      ILE  36  12.153   1.282   0.471
 1019   1HG2  ILE  36          HG22      ILE  36   9.485   4.195  -0.995
 1020   2HG2  ILE  36          HG21      ILE  36   9.112   3.081   0.321
 1021   3HG2  ILE  36          HG23      ILE  36  10.064   4.531   0.637
 1022   1HD1  ILE  36          HD12      ILE  36  10.711   2.896   2.093
 1023   2HD1  ILE  36          HD11      ILE  36   9.526   1.620   1.813
 1024   3HD1  ILE  36          HD13      ILE  36  11.100   1.225   2.503
 1025    H    ASN  37           HN       ASN  37  13.642   3.436  -1.530
 1026    HA   ASN  37           HA       ASN  37  13.477   6.048  -2.726
 1027   1HB   ASN  37           HB2      ASN  37  15.178   5.266  -1.005
 1028   2HB   ASN  37           HB1      ASN  37  15.995   4.418  -2.319
 1029   1HD2  ASN  37          HD22      ASN  37  17.232   8.029  -1.867
 1030   2HD2  ASN  37          HD21      ASN  37  16.890   6.840  -0.705
 1031    H    ASN  38           HN       ASN  38  15.333   3.198  -3.849
 1032    HA   ASN  38           HA       ASN  38  16.078   4.072  -6.356
 1033   1HB   ASN  38           HB2      ASN  38  16.455   1.770  -5.264
 1034   2HB   ASN  38           HB1      ASN  38  14.915   1.312  -5.995
 1035   1HD2  ASN  38          HD22      ASN  38  16.221   1.711  -9.380
 1036   2HD2  ASN  38          HD21      ASN  38  14.833   2.090  -8.482
 1037    H    GLU  39           HN       GLU  39  12.944   2.473  -5.647
 1038    HA   GLU  39           HA       GLU  39  11.957   3.070  -8.327
 1039   1HB   GLU  39           HB2      GLU  39  10.411   2.121  -5.898
 1040   2HB   GLU  39           HB1      GLU  39   9.883   2.039  -7.578
 1041   1HG   GLU  39           HG2      GLU  39  12.310   0.627  -6.434
 1042   2HG   GLU  39           HG1      GLU  39  10.767  -0.138  -6.811
 1043    H    LEU  40           HN       LEU  40  10.218   3.853  -5.314
 1044    HA   LEU  40           HA       LEU  40   8.903   6.096  -6.408
 1045   1HB   LEU  40           HB2      LEU  40   9.576   5.499  -3.512
 1046   2HB   LEU  40           HB1      LEU  40   8.371   6.661  -4.061
 1047    HG   LEU  40           HG       LEU  40   8.354   3.670  -4.522
 1048   1HD1  LEU  40          HD12      LEU  40   7.461   5.109  -2.362
 1049   2HD1  LEU  40          HD11      LEU  40   6.018   5.066  -3.376
 1050   3HD1  LEU  40          HD13      LEU  40   6.788   3.562  -2.873
 1051   1HD2  LEU  40          HD23      LEU  40   6.792   5.923  -5.760
 1052   2HD2  LEU  40          HD22      LEU  40   7.464   4.484  -6.528
 1053   3HD2  LEU  40          HD21      LEU  40   6.020   4.357  -5.523
 1054    H    SER  41           HN       SER  41  10.804   6.855  -3.572
 1055    HA   SER  41           HA       SER  41  12.259   8.657  -3.185
 1056   1HB   SER  41           HB2      SER  41  13.967   7.427  -4.235
 1057   2HB   SER  41           HB1      SER  41  13.188   7.513  -5.812
 1058    HG   SER  41           HG       SER  41  14.478   9.152  -6.092
 1059    H    HIS  42           HN       HIS  42   9.669   9.038  -4.823
 1060    HA   HIS  42           HA       HIS  42  10.406  11.468  -6.360
 1061   1HB   HIS  42           HB2      HIS  42   8.634   9.518  -6.966
 1062   2HB   HIS  42           HB1      HIS  42   7.563  10.630  -6.113
 1063    HD1  HIS  42           HD1      HIS  42   9.045  13.272  -7.030
 1064    HD2  HIS  42           HD2      HIS  42   7.803  10.207  -9.570
 1065    HE1  HIS  42           HE1      HIS  42   8.801  14.301  -9.331
 1066    H    PHE  43           HN       PHE  43   8.872  10.472  -3.385
 1067    HA   PHE  43           HA       PHE  43   8.228  13.339  -2.822
 1068   1HB   PHE  43           HB2      PHE  43   6.997  11.052  -1.307
 1069   2HB   PHE  43           HB1      PHE  43   6.366  12.677  -1.567
 1070    HD1  PHE  43           HD1      PHE  43   6.510  13.145  -4.381
 1071    HD2  PHE  43           HD2      PHE  43   5.597   9.484  -2.333
 1072    HE1  PHE  43           HE1      PHE  43   5.262  12.346  -6.368
 1073    HE2  PHE  43           HE2      PHE  43   4.348   8.685  -4.321
 1074    HZ   PHE  43           HZ       PHE  43   4.181  10.115  -6.339
 1075    H    LEU  44           HN       LEU  44  10.796  12.809  -2.379
 1076    HA   LEU  44           HA       LEU  44  10.943  12.468   0.585
 1077   1HB   LEU  44           HB2      LEU  44  11.989  10.660  -1.278
 1078   2HB   LEU  44           HB1      LEU  44  13.378  11.622  -0.771
 1079    HG   LEU  44           HG       LEU  44  12.258  11.226   1.637
 1080   1HD1  LEU  44          HD12      LEU  44  10.813   9.477  -0.106
 1081   2HD1  LEU  44          HD11      LEU  44  11.816   8.488   0.954
 1082   3HD1  LEU  44          HD13      LEU  44  10.669   9.634   1.645
 1083   1HD2  LEU  44          HD21      LEU  44  14.102   9.434   0.047
 1084   2HD2  LEU  44          HD23      LEU  44  14.531  10.641   1.260
 1085   3HD2  LEU  44          HD22      LEU  44  13.760   9.134   1.751
 1086    H    GLU  45           HN       GLU  45  10.727  14.968  -0.344
 1087    HA   GLU  45           HA       GLU  45  13.473  16.028  -0.757
 1088   1HB   GLU  45           HB2      GLU  45  10.819  17.488  -0.850
 1089   2HB   GLU  45           HB1      GLU  45  12.384  18.121  -1.361
 1090   1HG   GLU  45           HG2      GLU  45  12.317  15.867  -2.846
 1091   2HG   GLU  45           HG1      GLU  45  10.587  16.189  -2.729
 1092    H    GLU  46           HN       GLU  46  10.673  17.313   1.028
 1093    HA   GLU  46           HA       GLU  46  12.536  18.097   3.207
 1094   1HB   GLU  46           HB2      GLU  46   9.638  18.861   2.724
 1095   2HB   GLU  46           HB1      GLU  46  10.674  19.517   3.993
 1096   1HG   GLU  46           HG2      GLU  46  11.981  20.721   2.495
 1097   2HG   GLU  46           HG1      GLU  46  11.608  19.649   1.146
 1098    H    ILE  47           HN       ILE  47   9.928  15.912   2.481
 1099    HA   ILE  47           HA       ILE  47   8.966  14.196   3.754
 1100    HB   ILE  47           HB       ILE  47  11.387  14.728   5.502
 1101   1HG1  ILE  47          HG12      ILE  47  11.079  12.377   3.674
 1102   2HG1  ILE  47          HG11      ILE  47  11.498  13.934   2.959
 1103   1HG2  ILE  47          HG23      ILE  47   9.381  13.483   6.527
 1104   2HG2  ILE  47          HG22      ILE  47   9.734  12.204   5.365
 1105   3HG2  ILE  47          HG21      ILE  47  10.937  12.655   6.572
 1106   1HD1  ILE  47          HD11      ILE  47  13.071  13.460   5.344
 1107   2HD1  ILE  47          HD13      ILE  47  13.256  12.125   4.206
 1108   3HD1  ILE  47          HD12      ILE  47  13.618  13.774   3.697
 1109    H    LYS  48           HN       LYS  48   7.070  14.790   4.691
 1110    HA   LYS  48           HA       LYS  48   7.061  16.859   6.806
 1111   1HB   LYS  48           HB2      LYS  48   5.367  16.827   4.924
 1112   2HB   LYS  48           HB1      LYS  48   4.704  15.357   5.637
 1113   1HG   LYS  48           HG2      LYS  48   5.079  17.491   7.606
 1114   2HG   LYS  48           HG1      LYS  48   3.970  17.946   6.311
 1115   1HD   LYS  48           HD2      LYS  48   2.548  16.081   6.738
 1116   2HD   LYS  48           HD1      LYS  48   3.751  15.307   7.767
 1117   1HE   LYS  48           HE2      LYS  48   2.895  16.359   9.560
 1118   2HE   LYS  48           HE1      LYS  48   3.259  17.915   8.817
 1119   1HZ   LYS  48           HZ1      LYS  48   0.897  16.445   7.900
 1120   2HZ   LYS  48           HZ3      LYS  48   0.815  17.240   9.395
 1121   3HZ   LYS  48           HZ2      LYS  48   1.164  18.120   7.985
 1122    H    GLU  49           HN       GLU  49   6.135  13.442   6.371
 1123    HA   GLU  49           HA       GLU  49   5.536  13.172   9.241
 1124   1HB   GLU  49           HB2      GLU  49   5.328  11.439   6.817
 1125   2HB   GLU  49           HB1      GLU  49   5.509  10.634   8.375
 1126   1HG   GLU  49           HG2      GLU  49   3.497  12.844   8.077
 1127   2HG   GLU  49           HG1      GLU  49   3.104  11.222   7.504
 1128    H    GLN  50           HN       GLN  50   7.948  13.991   9.489
 1129    HA   GLN  50           HA       GLN  50  10.201  12.476   8.917
 1130   1HB   GLN  50           HB2      GLN  50  10.076  14.672  10.209
 1131   2HB   GLN  50           HB1      GLN  50   9.733  13.704  11.641
 1132   1HG   GLN  50           HG2      GLN  50  11.963  12.522  10.307
 1133   2HG   GLN  50           HG1      GLN  50  12.275  14.251  10.451
 1134   1HE2  GLN  50          HE22      GLN  50  12.258  11.924  13.789
 1135   2HE2  GLN  50          HE21      GLN  50  11.867  11.270  12.272
 1136    H    GLU  51           HN       GLU  51   7.617  11.666  11.124
 1137    HA   GLU  51           HA       GLU  51   9.166   9.608  12.506
 1138   1HB   GLU  51           HB2      GLU  51   6.739  10.948  12.969
 1139   2HB   GLU  51           HB1      GLU  51   6.295   9.262  12.705
 1140   1HG   GLU  51           HG2      GLU  51   7.801   8.517  14.433
 1141   2HG   GLU  51           HG1      GLU  51   8.505  10.126  14.586
 1142    H    VAL  52           HN       VAL  52   6.697   9.642   9.932
 1143    HA   VAL  52           HA       VAL  52   6.546   6.773   9.727
 1144    HB   VAL  52           HB       VAL  52   5.893   8.932   7.701
 1145   1HG1  VAL  52          HG11      VAL  52   6.044   6.078   7.434
 1146   2HG1  VAL  52          HG13      VAL  52   4.354   6.572   7.336
 1147   3HG1  VAL  52          HG12      VAL  52   5.541   7.266   6.233
 1148   1HG2  VAL  52          HG22      VAL  52   4.686   8.441  10.110
 1149   2HG2  VAL  52          HG21      VAL  52   3.856   9.112   8.707
 1150   3HG2  VAL  52          HG23      VAL  52   3.765   7.383   9.041
 1151    H    VAL  53           HN       VAL  53   8.359   9.221   7.867
 1152    HA   VAL  53           HA       VAL  53   9.658   7.210   6.224
 1153    HB   VAL  53           HB       VAL  53  10.391  10.115   6.709
 1154   1HG1  VAL  53          HG12      VAL  53  11.914   8.133   5.522
 1155   2HG1  VAL  53          HG11      VAL  53  11.085   8.863   4.148
 1156   3HG1  VAL  53          HG13      VAL  53  12.073   9.861   5.214
 1157   1HG2  VAL  53          HG23      VAL  53   8.206   8.887   5.312
 1158   2HG2  VAL  53          HG22      VAL  53   8.604  10.600   5.426
 1159   3HG2  VAL  53          HG21      VAL  53   9.287   9.620   4.128
 1160    H    ASP  54           HN       ASP  54  10.397   8.814   9.270
 1161    HA   ASP  54           HA       ASP  54  13.166   7.862   9.271
 1162   1HB   ASP  54           HB2      ASP  54  12.458   9.938  10.485
 1163   2HB   ASP  54           HB1      ASP  54  11.520   8.929  11.585
 1164    H    LYS  55           HN       LYS  55  10.059   6.619  10.156
 1165    HA   LYS  55           HA       LYS  55  11.080   4.670  12.063
 1166   1HB   LYS  55           HB2      LYS  55   8.732   5.465  12.139
 1167   2HB   LYS  55           HB1      LYS  55   8.447   4.737  10.558
 1168   1HG   LYS  55           HG2      LYS  55   9.554   3.056  12.787
 1169   2HG   LYS  55           HG1      LYS  55   7.824   3.391  12.722
 1170   1HD   LYS  55           HD2      LYS  55   8.128   2.694  10.180
 1171   2HD   LYS  55           HD1      LYS  55   9.524   1.828  10.821
 1172   1HE   LYS  55           HE2      LYS  55   6.967   1.554  12.324
 1173   2HE   LYS  55           HE1      LYS  55   7.066   0.736  10.764
 1174   1HZ   LYS  55           HZ2      LYS  55   9.453   0.183  11.928
 1175   2HZ   LYS  55           HZ1      LYS  55   8.372   0.114  13.238
 1176   3HZ   LYS  55           HZ3      LYS  55   8.115  -0.862  11.874
 1177    H    VAL  56           HN       VAL  56  10.114   4.615   8.623
 1178    HA   VAL  56           HA       VAL  56  10.820   1.795   8.364
 1179    HB   VAL  56           HB       VAL  56  10.588   2.332   5.884
 1180   1HG1  VAL  56          HG12      VAL  56   8.634   2.093   7.933
 1181   2HG1  VAL  56          HG11      VAL  56   8.036   3.285   6.781
 1182   3HG1  VAL  56          HG13      VAL  56   8.468   1.667   6.230
 1183   1HG2  VAL  56          HG21      VAL  56  10.678   4.995   6.927
 1184   2HG2  VAL  56          HG23      VAL  56  10.575   4.483   5.246
 1185   3HG2  VAL  56          HG22      VAL  56   9.104   4.741   6.183
 1186    H    MET  57           HN       MET  57  12.317   4.903   7.678
 1187    HA   MET  57           HA       MET  57  14.643   3.816   6.343
 1188   1HB   MET  57           HB2      MET  57  13.731   6.243   6.305
 1189   2HB   MET  57           HB1      MET  57  14.559   6.428   7.852
 1190   1HG   MET  57           HG2      MET  57  16.003   7.153   5.985
 1191   2HG   MET  57           HG1      MET  57  16.683   5.745   6.800
 1192   1HE   MET  57           HE1      MET  57  14.421   7.042   4.117
 1193   2HE   MET  57           HE3      MET  57  14.384   5.823   2.836
 1194   3HE   MET  57           HE2      MET  57  13.501   5.557   4.337
 1195    H    GLU  58           HN       GLU  58  13.675   4.243   9.665
 1196    HA   GLU  58           HA       GLU  58  16.372   4.094  10.753
 1197   1HB   GLU  58           HB2      GLU  58  13.613   4.138  11.844
 1198   2HB   GLU  58           HB1      GLU  58  14.812   3.303  12.828
 1199   1HG   GLU  58           HG2      GLU  58  16.275   5.440  12.320
 1200   2HG   GLU  58           HG1      GLU  58  14.707   6.190  12.029
 1201    H    THR  59           HN       THR  59  13.658   1.740  10.551
 1202    HA   THR  59           HA       THR  59  15.229  -0.454  11.556
 1203    HB   THR  59           HB       THR  59  13.017  -0.887   9.570
 1204    HG1  THR  59           HG1      THR  59  11.912   0.509  10.708
 1205   1HG2  THR  59          HG23      THR  59  13.916  -2.163  12.162
 1206   2HG2  THR  59          HG22      THR  59  12.426  -2.612  11.331
 1207   3HG2  THR  59          HG21      THR  59  13.983  -2.857  10.541
 1208    H    LEU  60           HN       LEU  60  14.733   0.966   8.402
 1209    HA   LEU  60           HA       LEU  60  15.902  -1.068   6.784
 1210   1HB   LEU  60           HB2      LEU  60  15.323   1.840   6.541
 1211   2HB   LEU  60           HB1      LEU  60  16.527   1.190   5.431
 1212    HG   LEU  60           HG       LEU  60  13.763   0.016   5.845
 1213   1HD1  LEU  60          HD13      LEU  60  14.858   2.047   3.936
 1214   2HD1  LEU  60          HD12      LEU  60  13.655   0.902   3.346
 1215   3HD1  LEU  60          HD11      LEU  60  13.269   1.969   4.696
 1216   1HD2  LEU  60          HD21      LEU  60  16.189  -0.776   4.344
 1217   2HD2  LEU  60          HD23      LEU  60  14.858  -1.769   4.935
 1218   3HD2  LEU  60          HD22      LEU  60  14.684  -0.866   3.431
 1219    H    ASP  61           HN       ASP  61  17.354   1.894   8.158
 1220    HA   ASP  61           HA       ASP  61  20.051   1.017   7.444
 1221   1HB   ASP  61           HB2      ASP  61  18.808   3.463   8.179
 1222   2HB   ASP  61           HB1      ASP  61  20.039   3.130   9.396
 1223    H    GLU  62           HN       GLU  62  17.917   0.240   9.920
 1224    HA   GLU  62           HA       GLU  62  19.700   0.139  12.170
 1225   1HB   GLU  62           HB2      GLU  62  17.091  -0.108  12.062
 1226   2HB   GLU  62           HB1      GLU  62  17.449  -1.816  11.816
 1227   1HG   GLU  62           HG2      GLU  62  19.065  -1.431  13.886
 1228   2HG   GLU  62           HG1      GLU  62  17.956  -0.100  14.217
 1229    H    ASP  63           HN       ASP  63  18.848  -2.224   9.661
 1230    HA   ASP  63           HA       ASP  63  21.179  -3.848  10.590
 1231   1HB   ASP  63           HB2      ASP  63  18.452  -4.618  10.430
 1232   2HB   ASP  63           HB1      ASP  63  19.304  -5.459   9.135
 1233    H    GLY  64           HN       GLY  64  19.044  -3.396   7.763
 1234   1HA   GLY  64           HA2      GLY  64  19.765  -2.803   5.555
 1235   2HA   GLY  64           HA1      GLY  64  21.434  -3.074   6.056
 1236    H    ASP  65           HN       ASP  65  21.481  -5.602   6.989
 1237    HA   ASP  65           HA       ASP  65  20.665  -7.193   4.599
 1238   1HB   ASP  65           HB2      ASP  65  23.134  -6.991   5.574
 1239   2HB   ASP  65           HB1      ASP  65  22.556  -8.250   6.663
 1240    H    GLY  66           HN       GLY  66  18.499  -7.611   5.312
 1241   1HA   GLY  66           HA2      GLY  66  18.345  -9.727   7.367
 1242   2HA   GLY  66           HA1      GLY  66  17.346  -8.297   7.620
 1243    H    GLU  67           HN       GLU  67  15.909 -10.524   7.398
 1244    HA   GLU  67           HA       GLU  67  15.046 -10.670   4.539
 1245   1HB   GLU  67           HB2      GLU  67  14.820 -12.628   6.831
 1246   2HB   GLU  67           HB1      GLU  67  13.876 -12.804   5.351
 1247   1HG   GLU  67           HG2      GLU  67  15.847 -13.009   4.007
 1248   2HG   GLU  67           HG1      GLU  67  16.885 -12.497   5.337
 1249    H    CYS  68           HN       CYS  68  13.134  -9.715   4.065
 1250    HA   CYS  68           HA       CYS  68  11.297  -9.049   6.325
 1251   1HB   CYS  68           HB2      CYS  68  11.935  -7.746   3.702
 1252   2HB   CYS  68           HB1      CYS  68  10.319  -7.534   4.377
 1253    HG   CYS  68           HG       CYS  68  11.765  -6.783   6.648
 1254    H    ASP  69           HN       ASP  69   8.903  -8.959   5.484
 1255    HA   ASP  69           HA       ASP  69   8.442 -11.445   3.881
 1256   1HB   ASP  69           HB2      ASP  69   6.630 -10.216   5.984
 1257   2HB   ASP  69           HB1      ASP  69   6.388 -11.756   5.157
 1258    H    PHE  70           HN       PHE  70   5.896 -11.246   3.117
 1259    HA   PHE  70           HA       PHE  70   5.941  -9.070   1.193
 1260   1HB   PHE  70           HB2      PHE  70   4.937 -11.284   0.676
 1261   2HB   PHE  70           HB1      PHE  70   3.688 -10.981   1.882
 1262    HD1  PHE  70           HD1      PHE  70   5.178  -8.440  -0.383
 1263    HD2  PHE  70           HD2      PHE  70   1.761 -10.900   0.464
 1264    HE1  PHE  70           HE1      PHE  70   3.857  -7.184  -2.063
 1265    HE2  PHE  70           HE2      PHE  70   0.441  -9.644  -1.218
 1266    HZ   PHE  70           HZ       PHE  70   1.489  -7.786  -2.480
 1267    H    GLN  71           HN       GLN  71   3.858  -9.856   3.994
 1268    HA   GLN  71           HA       GLN  71   2.268  -7.491   3.838
 1269   1HB   GLN  71           HB2      GLN  71   3.017  -9.217   6.217
 1270   2HB   GLN  71           HB1      GLN  71   1.799  -7.942   6.268
 1271   1HG   GLN  71           HG2      GLN  71   1.230  -9.540   3.989
 1272   2HG   GLN  71           HG1      GLN  71   1.516 -10.644   5.335
 1273   1HE2  GLN  71          HE22      GLN  71  -1.354  -7.825   6.149
 1274   2HE2  GLN  71          HE21      GLN  71   0.148  -7.336   5.528
 1275    H    GLU  72           HN       GLU  72   5.510  -8.032   4.957
 1276    HA   GLU  72           HA       GLU  72   5.629  -5.582   6.548
 1277   1HB   GLU  72           HB2      GLU  72   7.511  -7.747   5.741
 1278   2HB   GLU  72           HB1      GLU  72   8.227  -6.180   6.112
 1279   1HG   GLU  72           HG2      GLU  72   6.270  -6.696   8.110
 1280   2HG   GLU  72           HG1      GLU  72   7.237  -8.161   7.937
 1281    H    PHE  73           HN       PHE  73   7.081  -6.617   3.442
 1282    HA   PHE  73           HA       PHE  73   8.084  -4.047   2.730
 1283   1HB   PHE  73           HB2      PHE  73   8.977  -5.639   1.325
 1284   2HB   PHE  73           HB1      PHE  73   7.511  -6.611   1.329
 1285    HD1  PHE  73           HD1      PHE  73   5.563  -5.938  -0.096
 1286    HD2  PHE  73           HD2      PHE  73   9.383  -3.996  -0.378
 1287    HE1  PHE  73           HE1      PHE  73   4.920  -4.993  -2.296
 1288    HE2  PHE  73           HE2      PHE  73   8.739  -3.052  -2.580
 1289    HZ   PHE  73           HZ       PHE  73   6.507  -3.551  -3.537
 1290    H    MET  74           HN       MET  74   4.892  -5.368   2.768
 1291    HA   MET  74           HA       MET  74   3.744  -3.478   0.864
 1292   1HB   MET  74           HB2      MET  74   2.903  -5.832   2.141
 1293   2HB   MET  74           HB1      MET  74   1.870  -4.571   2.803
 1294   1HG   MET  74           HG2      MET  74   0.948  -5.621   0.716
 1295   2HG   MET  74           HG1      MET  74   1.178  -3.881   0.587
 1296   1HE   MET  74           HE2      MET  74   2.029  -2.803  -0.772
 1297   2HE   MET  74           HE1      MET  74   3.695  -2.952  -1.326
 1298   3HE   MET  74           HE3      MET  74   2.360  -3.395  -2.399
 1299    H    ALA  75           HN       ALA  75   3.325  -3.901   4.389
 1300    HA   ALA  75           HA       ALA  75   2.082  -1.356   4.767
 1301   1HB   ALA  75           HB3      ALA  75   3.347  -3.395   6.533
 1302   2HB   ALA  75           HB2      ALA  75   3.148  -1.774   7.198
 1303   3HB   ALA  75           HB1      ALA  75   1.742  -2.670   6.625
 1304    H    PHE  76           HN       PHE  76   5.350  -2.204   4.179
 1305    HA   PHE  76           HA       PHE  76   6.508   0.165   5.456
 1306   1HB   PHE  76           HB2      PHE  76   7.479  -2.268   4.233
 1307   2HB   PHE  76           HB1      PHE  76   8.312  -0.876   3.545
 1308    HD1  PHE  76           HD1      PHE  76   7.349  -2.464   6.783
 1309    HD2  PHE  76           HD2      PHE  76   9.974   0.276   4.772
 1310    HE1  PHE  76           HE1      PHE  76   8.716  -2.261   8.843
 1311    HE2  PHE  76           HE2      PHE  76  11.340   0.480   6.832
 1312    HZ   PHE  76           HZ       PHE  76  10.710  -0.790   8.867
 1313    H    VAL  77           HN       VAL  77   5.771  -0.887   2.134
 1314    HA   VAL  77           HA       VAL  77   6.763   1.534   0.896
 1315    HB   VAL  77           HB       VAL  77   4.768  -0.497  -0.143
 1316   1HG1  VAL  77          HG11      VAL  77   5.178   1.897  -1.230
 1317   2HG1  VAL  77          HG13      VAL  77   6.622   1.106  -1.862
 1318   3HG1  VAL  77          HG12      VAL  77   5.027   0.459  -2.240
 1319   1HG2  VAL  77          HG23      VAL  77   7.157  -1.233   0.637
 1320   2HG2  VAL  77          HG22      VAL  77   6.584  -1.751  -0.949
 1321   3HG2  VAL  77          HG21      VAL  77   7.702  -0.394  -0.814
 1322    H    SER  78           HN       SER  78   3.720   0.628   2.362
 1323    HA   SER  78           HA       SER  78   2.186   2.722   1.059
 1324   1HB   SER  78           HB2      SER  78   0.465   2.165   2.784
 1325   2HB   SER  78           HB1      SER  78   1.038   0.755   1.897
 1326    HG   SER  78           HG       SER  78   1.104   1.215   4.515
 1327    H    MET  79           HN       MET  79   3.432   2.379   4.418
 1328    HA   MET  79           HA       MET  79   2.593   4.935   5.290
 1329   1HB   MET  79           HB2      MET  79   4.521   4.728   6.949
 1330   2HB   MET  79           HB1      MET  79   3.339   3.422   6.960
 1331   1HG   MET  79           HG2      MET  79   4.834   2.093   5.488
 1332   2HG   MET  79           HG1      MET  79   6.018   3.385   5.553
 1333   1HE   MET  79           HE3      MET  79   3.696   1.220   7.396
 1334   2HE   MET  79           HE2      MET  79   4.497   0.681   8.869
 1335   3HE   MET  79           HE1      MET  79   3.758   2.278   8.812
 1336    H    VAL  80           HN       VAL  80   5.644   3.983   3.708
 1337    HA   VAL  80           HA       VAL  80   6.852   6.568   3.891
 1338    HB   VAL  80           HB       VAL  80   8.226   5.723   1.926
 1339   1HG1  VAL  80          HG13      VAL  80   8.752   5.393   4.385
 1340   2HG1  VAL  80          HG12      VAL  80   8.009   3.801   4.253
 1341   3HG1  VAL  80          HG11      VAL  80   9.451   4.182   3.311
 1342   1HG2  VAL  80          HG23      VAL  80   6.056   3.799   1.918
 1343   2HG2  VAL  80          HG22      VAL  80   7.316   4.055   0.714
 1344   3HG2  VAL  80          HG21      VAL  80   7.613   2.992   2.088
 1345    H    THR  81           HN       THR  81   4.812   5.072   1.373
 1346    HA   THR  81           HA       THR  81   5.012   7.327  -0.424
 1347    HB   THR  81           HB       THR  81   2.692   5.399  -0.325
 1348    HG1  THR  81           HG1      THR  81   5.215   4.983  -1.544
 1349   1HG2  THR  81          HG21      THR  81   3.345   7.506  -2.003
 1350   2HG2  THR  81          HG23      THR  81   3.929   6.093  -2.884
 1351   3HG2  THR  81          HG22      THR  81   2.238   6.191  -2.392
 1352    H    THR  82           HN       THR  82   3.361   6.848   2.518
 1353    HA   THR  82           HA       THR  82   1.321   8.913   1.853
 1354    HB   THR  82           HB       THR  82   0.841   8.206   4.455
 1355    HG1  THR  82           HG1      THR  82   1.005   5.722   3.876
 1356   1HG2  THR  82          HG22      THR  82  -0.158   7.288   1.798
 1357   2HG2  THR  82          HG21      THR  82  -0.712   6.421   3.230
 1358   3HG2  THR  82          HG23      THR  82  -1.006   8.152   3.081
 1359    H    ALA  83           HN       ALA  83   4.429   8.857   2.922
 1360    HA   ALA  83           HA       ALA  83   4.029  11.013   4.936
 1361   1HB   ALA  83           HB3      ALA  83   6.106   8.982   4.425
 1362   2HB   ALA  83           HB2      ALA  83   6.733  10.579   4.828
 1363   3HB   ALA  83           HB1      ALA  83   5.640   9.757   5.939
 1364    H    CYS  84           HN       CYS  84   3.731  11.261   1.940
 1365    HA   CYS  84           HA       CYS  84   5.958  12.639   0.831
 1366   1HB   CYS  84           HB2      CYS  84   4.284  13.635  -0.731
 1367   2HB   CYS  84           HB1      CYS  84   4.110  11.889  -0.575
 1368    HG   CYS  84           HG       CYS  84   1.749  13.109  -0.291
 1369    H    HIS  85           HN       HIS  85   6.686  14.698   1.093
 1370    HA   HIS  85           HA       HIS  85   6.246  16.271   3.294
 1371   1HB   HIS  85           HB2      HIS  85   6.552  18.245   1.385
 1372   2HB   HIS  85           HB1      HIS  85   7.867  17.374   2.164
 1373    HD1  HIS  85           HD1      HIS  85   6.058  17.716  -1.081
 1374    HD2  HIS  85           HD2      HIS  85   9.003  15.261   0.555
 1375    HE1  HIS  85           HE1      HIS  85   7.100  16.459  -3.016
 1376    H    GLU  86           HN       GLU  86   4.965  17.811   0.399
 1377    HA   GLU  86           HA       GLU  86   2.781  18.973   1.855
 1378   1HB   GLU  86           HB2      GLU  86   3.447  18.751  -1.079
 1379   2HB   GLU  86           HB1      GLU  86   1.944  19.495  -0.533
 1380   1HG   GLU  86           HG2      GLU  86   3.110  21.182   0.694
 1381   2HG   GLU  86           HG1      GLU  86   4.648  20.337   0.526
 1382    H    PHE  87           HN       PHE  87   0.476  18.702   0.649
 1383    HA   PHE  87           HA       PHE  87  -0.107  15.768   0.710
 1384   1HB   PHE  87           HB2      PHE  87  -1.091  17.300   2.527
 1385   2HB   PHE  87           HB1      PHE  87  -2.088  17.990   1.247
 1386    HD1  PHE  87           HD1      PHE  87  -0.976  14.493   2.065
 1387    HD2  PHE  87           HD2      PHE  87  -4.257  17.171   1.351
 1388    HE1  PHE  87           HE1      PHE  87  -2.568  12.602   2.277
 1389    HE2  PHE  87           HE2      PHE  87  -5.847  15.282   1.561
 1390    HZ   PHE  87           HZ       PHE  87  -5.003  12.999   2.026
 1391    H    PHE  88           HN       PHE  88  -0.213  15.170  -1.439
 1392    HA   PHE  88           HA       PHE  88  -0.894  15.182  -3.690
 1393   1HB   PHE  88           HB2      PHE  88  -3.226  16.550  -2.326
 1394   2HB   PHE  88           HB1      PHE  88  -3.231  16.147  -4.043
 1395    HD1  PHE  88           HD1      PHE  88  -2.440  14.536  -0.741
 1396    HD2  PHE  88           HD2      PHE  88  -4.115  14.086  -4.672
 1397    HE1  PHE  88           HE1      PHE  88  -3.101  12.212  -0.194
 1398    HE2  PHE  88           HE2      PHE  88  -4.776  11.760  -4.123
 1399    HZ   PHE  88           HZ       PHE  88  -4.268  10.824  -1.886
 1400    H    GLU  89           HN       GLU  89   1.013  16.824  -3.803
 1401    HA   GLU  89           HA       GLU  89   0.019  19.195  -5.242
 1402   1HB   GLU  89           HB2      GLU  89   0.952  19.346  -2.528
 1403   2HB   GLU  89           HB1      GLU  89   2.093  20.184  -3.579
 1404   1HG   GLU  89           HG2      GLU  89   0.529  21.747  -4.266
 1405   2HG   GLU  89           HG1      GLU  89  -0.831  20.654  -4.005
 1406    H    HIS  90           HN       HIS  90   3.043  17.885  -3.860
 1407    HA   HIS  90           HA       HIS  90   5.103  17.428  -4.889
 1408   1HB   HIS  90           HB2      HIS  90   3.846  15.949  -6.355
 1409   2HB   HIS  90           HB1      HIS  90   3.321  17.314  -7.339
 1410    HD1  HIS  90           HD1      HIS  90   4.647  17.509  -9.424
 1411    HD2  HIS  90           HD2      HIS  90   6.966  16.029  -6.294
 1412    HE1  HIS  90           HE1      HIS  90   6.967  17.142 -10.367
 1413    H    GLU  91           HN       GLU  91   3.681  20.246  -4.924
 1414    HA   GLU  91           HA       GLU  91   5.948  21.600  -6.176
 1415   1HB   GLU  91           HB2      GLU  91   3.522  21.183  -7.677
 1416   2HB   GLU  91           HB1      GLU  91   3.737  22.906  -7.365
 1417   1HG   GLU  91           HG2      GLU  91   5.703  23.022  -8.568
 1418   2HG   GLU  91           HG1      GLU  91   6.131  21.344  -8.230
   
  No H/Q in entry =        1418
  Start of MODEL   11
    1   1H    MET   0           HT2      MET   0   6.780   3.866 -15.050
    2   2H    MET   0           HT1      MET   0   6.974   5.537 -14.813
    3   3H    MET   0           HT3      MET   0   6.564   4.943 -16.348
    4    HA   MET   0           HA       MET   0   8.660   4.408 -16.874
    5   1HB   MET   0           HB2      MET   0   9.065   6.231 -14.484
    6   2HB   MET   0           HB1      MET   0  10.327   5.828 -15.647
    7   1HG   MET   0           HG2      MET   0   7.976   6.646 -17.079
    8   2HG   MET   0           HG1      MET   0   8.357   7.864 -15.862
    9   1HE   MET   0           HE3      MET   0   8.166   7.512 -18.855
   10   2HE   MET   0           HE2      MET   0   9.123   8.944 -19.226
   11   3HE   MET   0           HE1      MET   0   9.649   7.365 -19.806
   12    H    SER   1           HN       SER   1   7.949   3.842 -13.473
   13    HA   SER   1           HA       SER   1  10.019   1.679 -13.499
   14   1HB   SER   1           HB2      SER   1  10.923   3.007 -11.854
   15   2HB   SER   1           HB1      SER   1   9.381   3.766 -11.473
   16    HG   SER   1           HG       SER   1  10.566   1.834 -10.169
   17    H    GLU   2           HN       GLU   2   9.448  -0.001 -11.698
   18    HA   GLU   2           HA       GLU   2   6.734  -0.933 -12.253
   19   1HB   GLU   2           HB2      GLU   2   9.197  -2.110 -11.456
   20   2HB   GLU   2           HB1      GLU   2   8.025  -2.456 -10.186
   21   1HG   GLU   2           HG2      GLU   2   7.873  -4.222 -11.833
   22   2HG   GLU   2           HG1      GLU   2   6.425  -3.224 -11.971
   23    H    LEU   3           HN       LEU   3   8.542   0.137  -9.366
   24    HA   LEU   3           HA       LEU   3   6.182  -0.077  -7.655
   25   1HB   LEU   3           HB2      LEU   3   8.753  -0.191  -7.042
   26   2HB   LEU   3           HB1      LEU   3   8.576   1.559  -6.911
   27    HG   LEU   3           HG       LEU   3   6.566   1.130  -5.417
   28   1HD1  LEU   3          HD12      LEU   3   7.430  -1.628  -6.029
   29   2HD1  LEU   3          HD11      LEU   3   7.116  -1.321  -4.321
   30   3HD1  LEU   3          HD13      LEU   3   5.853  -1.029  -5.516
   31   1HD2  LEU   3          HD22      LEU   3   9.358   1.092  -4.875
   32   2HD2  LEU   3          HD21      LEU   3   8.058   1.577  -3.789
   33   3HD2  LEU   3          HD23      LEU   3   8.612  -0.098  -3.808
   34    H    GLU   4           HN       GLU   4   8.026   2.586  -9.135
   35    HA   GLU   4           HA       GLU   4   6.487   4.697  -7.996
   36   1HB   GLU   4           HB2      GLU   4   8.646   5.069  -9.136
   37   2HB   GLU   4           HB1      GLU   4   7.908   4.629 -10.676
   38   1HG   GLU   4           HG2      GLU   4   6.158   6.523  -9.873
   39   2HG   GLU   4           HG1      GLU   4   7.618   7.121  -9.084
   40    H    LYS   5           HN       LYS   5   6.061   2.942 -11.090
   41    HA   LYS   5           HA       LYS   5   3.747   4.500 -11.848
   42   1HB   LYS   5           HB2      LYS   5   3.491   2.952 -13.645
   43   2HB   LYS   5           HB1      LYS   5   5.230   3.089 -13.386
   44   1HG   LYS   5           HG2      LYS   5   5.116   1.045 -11.932
   45   2HG   LYS   5           HG1      LYS   5   3.420   0.874 -12.380
   46   1HD   LYS   5           HD2      LYS   5   4.799   1.225 -14.809
   47   2HD   LYS   5           HD1      LYS   5   5.780   0.099 -13.867
   48   1HE   LYS   5           HE2      LYS   5   4.156  -1.528 -13.856
   49   2HE   LYS   5           HE1      LYS   5   2.837  -0.357 -13.865
   50   1HZ   LYS   5           HZ2      LYS   5   4.586  -0.608 -16.216
   51   2HZ   LYS   5           HZ1      LYS   5   3.333  -1.730 -15.978
   52   3HZ   LYS   5           HZ3      LYS   5   2.974  -0.077 -16.128
   53    H    ALA   6           HN       ALA   6   4.183   1.467 -10.071
   54    HA   ALA   6           HA       ALA   6   1.311   0.932  -9.973
   55   1HB   ALA   6           HB2      ALA   6   3.071  -0.862  -9.904
   56   2HB   ALA   6           HB1      ALA   6   3.523  -0.288  -8.298
   57   3HB   ALA   6           HB3      ALA   6   1.916  -0.956  -8.576
   58    H    MET   7           HN       MET   7   3.605   1.335  -7.279
   59    HA   MET   7           HA       MET   7   1.822   1.895  -5.247
   60   1HB   MET   7           HB2      MET   7   4.222   1.680  -4.848
   61   2HB   MET   7           HB1      MET   7   4.527   3.186  -5.721
   62   1HG   MET   7           HG2      MET   7   4.471   3.423  -3.199
   63   2HG   MET   7           HG1      MET   7   3.346   4.474  -4.061
   64   1HE   MET   7           HE1      MET   7   3.464   4.055  -1.368
   65   2HE   MET   7           HE3      MET   7   1.772   3.924  -0.875
   66   3HE   MET   7           HE2      MET   7   2.879   2.580  -0.605
   67    H    VAL   8           HN       VAL   8   3.328   4.338  -7.380
   68    HA   VAL   8           HA       VAL   8   1.907   6.557  -6.286
   69    HB   VAL   8           HB       VAL   8   2.856   6.267  -9.150
   70   1HG1  VAL   8          HG13      VAL   8   2.290   8.621  -7.331
   71   2HG1  VAL   8          HG12      VAL   8   3.168   8.764  -8.854
   72   3HG1  VAL   8          HG11      VAL   8   1.488   8.228  -8.852
   73   1HG2  VAL   8          HG23      VAL   8   4.547   5.740  -7.260
   74   2HG2  VAL   8          HG22      VAL   8   5.007   6.974  -8.433
   75   3HG2  VAL   8          HG21      VAL   8   4.411   7.449  -6.844
   76    H    ALA   9           HN       ALA   9   1.032   4.223  -8.797
   77    HA   ALA   9           HA       ALA   9  -1.245   5.538  -9.856
   78   1HB   ALA   9           HB3      ALA   9  -0.759   2.582  -9.361
   79   2HB   ALA   9           HB2      ALA   9  -2.097   3.218 -10.319
   80   3HB   ALA   9           HB1      ALA   9  -0.435   3.469 -10.850
   81    H    LEU  10           HN       LEU  10  -0.856   3.604  -6.904
   82    HA   LEU  10           HA       LEU  10  -3.595   3.468  -6.158
   83   1HB   LEU  10           HB2      LEU  10  -1.183   2.677  -5.028
   84   2HB   LEU  10           HB1      LEU  10  -1.773   3.901  -3.904
   85    HG   LEU  10           HG       LEU  10  -3.565   1.699  -4.929
   86   1HD1  LEU  10          HD13      LEU  10  -1.275   1.253  -3.411
   87   2HD1  LEU  10          HD12      LEU  10  -2.556   1.366  -2.205
   88   3HD1  LEU  10          HD11      LEU  10  -2.673   0.182  -3.507
   89   1HD2  LEU  10          HD22      LEU  10  -3.850   4.001  -3.237
   90   2HD2  LEU  10          HD21      LEU  10  -5.080   2.823  -3.696
   91   3HD2  LEU  10          HD23      LEU  10  -4.091   2.551  -2.261
   92    H    ILE  11           HN       ILE  11  -1.105   5.869  -5.233
   93    HA   ILE  11           HA       ILE  11  -2.698   7.610  -3.728
   94    HB   ILE  11           HB       ILE  11  -0.349   8.029  -5.562
   95   1HG1  ILE  11          HG12      ILE  11   0.328   9.024  -3.147
   96   2HG1  ILE  11          HG11      ILE  11  -0.926   7.888  -2.650
   97   1HG2  ILE  11          HG22      ILE  11  -2.262  10.089  -4.832
   98   2HG2  ILE  11          HG21      ILE  11  -0.687  10.418  -4.116
   99   3HG2  ILE  11          HG23      ILE  11  -0.837  10.211  -5.860
  100   1HD1  ILE  11          HD11      ILE  11   0.234   6.098  -3.945
  101   2HD1  ILE  11          HD13      ILE  11   1.524   7.242  -4.313
  102   3HD1  ILE  11          HD12      ILE  11   1.230   6.749  -2.644
  103    H    ASP  12           HN       ASP  12  -2.479   7.260  -7.240
  104    HA   ASP  12           HA       ASP  12  -3.971   9.522  -8.040
  105   1HB   ASP  12           HB2      ASP  12  -2.779   7.712  -9.465
  106   2HB   ASP  12           HB1      ASP  12  -4.292   6.822  -9.350
  107    H    VAL  13           HN       VAL  13  -5.160   6.235  -7.280
  108    HA   VAL  13           HA       VAL  13  -7.897   6.634  -7.667
  109    HB   VAL  13           HB       VAL  13  -6.448   5.014  -5.559
  110   1HG1  VAL  13          HG11      VAL  13  -9.301   5.639  -5.846
  111   2HG1  VAL  13          HG13      VAL  13  -8.967   3.907  -5.864
  112   3HG1  VAL  13          HG12      VAL  13  -8.446   4.890  -4.497
  113   1HG2  VAL  13          HG21      VAL  13  -7.183   4.674  -8.359
  114   2HG2  VAL  13          HG23      VAL  13  -6.109   3.694  -7.361
  115   3HG2  VAL  13          HG22      VAL  13  -7.844   3.385  -7.352
  116    H    PHE  14           HN       PHE  14  -5.919   7.634  -4.899
  117    HA   PHE  14           HA       PHE  14  -8.011   8.396  -3.145
  118   1HB   PHE  14           HB2      PHE  14  -5.349   8.405  -2.913
  119   2HB   PHE  14           HB1      PHE  14  -5.574  10.111  -3.297
  120    HD1  PHE  14           HD1      PHE  14  -7.425  11.374  -1.943
  121    HD2  PHE  14           HD2      PHE  14  -5.643   7.663  -0.710
  122    HE1  PHE  14           HE1      PHE  14  -8.136  11.807   0.392
  123    HE2  PHE  14           HE2      PHE  14  -6.356   8.096   1.624
  124    HZ   PHE  14           HZ       PHE  14  -7.602  10.168   2.176
  125    H    HIS  15           HN       HIS  15  -6.389  10.279  -5.712
  126    HA   HIS  15           HA       HIS  15  -8.122  12.594  -5.246
  127   1HB   HIS  15           HB2      HIS  15  -5.662  12.376  -6.329
  128   2HB   HIS  15           HB1      HIS  15  -6.628  12.332  -7.804
  129    HD1  HIS  15           HD1      HIS  15  -4.878  14.799  -7.234
  130    HD2  HIS  15           HD2      HIS  15  -8.873  14.504  -6.085
  131    HE1  HIS  15           HE1      HIS  15  -5.715  17.172  -6.944
  132    H    GLN  16           HN       GLN  16  -8.519   9.632  -6.782
  133    HA   GLN  16           HA       GLN  16 -10.208  10.602  -8.978
  134   1HB   GLN  16           HB2      GLN  16  -9.051   8.052  -8.117
  135   2HB   GLN  16           HB1      GLN  16 -10.722   7.889  -8.659
  136   1HG   GLN  16           HG2      GLN  16  -8.624   9.388 -10.244
  137   2HG   GLN  16           HG1      GLN  16  -8.967   7.674 -10.487
  138   1HE2  GLN  16          HE22      GLN  16 -11.547   8.534 -12.718
  139   2HE2  GLN  16          HE21      GLN  16 -10.180   7.580 -12.398
  140    H    TYR  17           HN       TYR  17 -10.594   9.528  -5.677
  141    HA   TYR  17           HA       TYR  17 -13.558   9.537  -6.027
  142   1HB   TYR  17           HB2      TYR  17 -11.749   8.339  -3.918
  143   2HB   TYR  17           HB1      TYR  17 -13.492   8.488  -3.690
  144    HD1  TYR  17           HD2      TYR  17 -10.927   7.136  -6.050
  145    HD2  TYR  17           HD1      TYR  17 -14.955   6.880  -4.587
  146    HE1  TYR  17           HE2      TYR  17 -11.280   5.077  -7.388
  147    HE2  TYR  17           HE1      TYR  17 -15.310   4.821  -5.925
  148    HH   TYR  17           HH       TYR  17 -13.491   3.911  -8.416
  149    H    SER  18           HN       SER  18 -11.053  10.637  -3.712
  150    HA   SER  18           HA       SER  18 -12.617  12.293  -2.101
  151   1HB   SER  18           HB2      SER  18  -9.902  11.874  -2.432
  152   2HB   SER  18           HB1      SER  18 -10.092  13.569  -2.875
  153    HG   SER  18           HG       SER  18 -11.322  12.499  -0.571
  154    H    GLY  19           HN       GLY  19 -10.880  13.349  -5.055
  155   1HA   GLY  19           HA2      GLY  19 -11.804  15.958  -5.248
  156   2HA   GLY  19           HA1      GLY  19 -11.549  14.938  -6.666
  157    H    ARG  20           HN       ARG  20 -13.467  13.140  -6.719
  158    HA   ARG  20           HA       ARG  20 -15.797  14.449  -7.552
  159   1HB   ARG  20           HB2      ARG  20 -15.476  11.656  -6.412
  160   2HB   ARG  20           HB1      ARG  20 -16.936  12.229  -7.220
  161   1HG   ARG  20           HG2      ARG  20 -15.662  12.681  -9.264
  162   2HG   ARG  20           HG1      ARG  20 -14.170  12.185  -8.464
  163   1HD   ARG  20           HD2      ARG  20 -14.834  10.257  -9.657
  164   2HD   ARG  20           HD1      ARG  20 -15.392   9.946  -8.013
  165    HE   ARG  20           HE       ARG  20 -17.225  11.012 -10.126
  166   1HH1  ARG  20          HH11      ARG  20 -18.690  10.985  -7.746
  167   2HH1  ARG  20          HH12      ARG  20 -19.255   9.358  -7.549
  168   1HH2  ARG  20          HH21      ARG  20 -16.965   8.013  -9.778
  169   2HH2  ARG  20          HH22      ARG  20 -18.278   7.675  -8.701
  170    H    GLU  21           HN       GLU  21 -16.337  12.262  -4.867
  171    HA   GLU  21           HA       GLU  21 -17.739  14.490  -3.455
  172   1HB   GLU  21           HB2      GLU  21 -19.062  12.717  -2.364
  173   2HB   GLU  21           HB1      GLU  21 -19.170  12.584  -4.119
  174   1HG   GLU  21           HG2      GLU  21 -16.905  11.098  -2.995
  175   2HG   GLU  21           HG1      GLU  21 -18.465  10.530  -2.402
  176    H    GLY  22           HN       GLY  22 -17.933  13.212  -0.940
  177   1HA   GLY  22           HA2      GLY  22 -16.696  12.751   1.011
  178   2HA   GLY  22           HA1      GLY  22 -15.323  12.346  -0.018
  179    H    ASP  23           HN       ASP  23 -13.843  13.541   1.269
  180    HA   ASP  23           HA       ASP  23 -14.322  16.442   1.605
  181   1HB   ASP  23           HB2      ASP  23 -12.698  14.417   2.912
  182   2HB   ASP  23           HB1      ASP  23 -11.726  15.824   2.476
  183    H    LYS  24           HN       LYS  24 -11.903  17.591   1.303
  184    HA   LYS  24           HA       LYS  24 -11.558  17.597  -1.591
  185   1HB   LYS  24           HB2      LYS  24 -10.788  19.274   0.664
  186   2HB   LYS  24           HB1      LYS  24  -9.455  19.062  -0.470
  187   1HG   LYS  24           HG2      LYS  24 -12.196  19.686  -1.527
  188   2HG   LYS  24           HG1      LYS  24 -11.207  20.988  -0.865
  189   1HD   LYS  24           HD2      LYS  24  -9.358  19.789  -2.414
  190   2HD   LYS  24           HD1      LYS  24 -10.806  19.374  -3.330
  191   1HE   LYS  24           HE2      LYS  24 -11.365  21.950  -2.904
  192   2HE   LYS  24           HE1      LYS  24  -9.610  22.058  -2.789
  193   1HZ   LYS  24           HZ2      LYS  24  -9.983  20.490  -4.958
  194   2HZ   LYS  24           HZ1      LYS  24 -11.268  21.593  -5.088
  195   3HZ   LYS  24           HZ3      LYS  24  -9.674  22.161  -5.000
  196    H    HIS  25           HN       HIS  25  -9.760  16.372   1.196
  197    HA   HIS  25           HA       HIS  25  -8.145  14.720  -0.656
  198   1HB   HIS  25           HB2      HIS  25  -6.757  16.243   1.546
  199   2HB   HIS  25           HB1      HIS  25  -6.049  15.449   0.141
  200    HD1  HIS  25           HD1      HIS  25  -7.105  16.549  -2.251
  201    HD2  HIS  25           HD2      HIS  25  -6.922  18.968   1.137
  202    HE1  HIS  25           HE1      HIS  25  -7.232  18.943  -3.072
  203    H    LYS  26           HN       LYS  26 -10.283  14.121   1.216
  204    HA   LYS  26           HA       LYS  26  -8.788  12.256   3.008
  205   1HB   LYS  26           HB2      LYS  26 -11.304  13.622   3.951
  206   2HB   LYS  26           HB1      LYS  26 -10.053  12.826   4.907
  207   1HG   LYS  26           HG2      LYS  26  -8.610  14.785   3.643
  208   2HG   LYS  26           HG1      LYS  26 -10.160  15.591   3.882
  209   1HD   LYS  26           HD2      LYS  26 -10.086  14.944   6.288
  210   2HD   LYS  26           HD1      LYS  26  -8.493  14.236   6.025
  211   1HE   LYS  26           HE2      LYS  26  -8.652  16.955   4.978
  212   2HE   LYS  26           HE1      LYS  26  -9.017  16.894   6.702
  213   1HZ   LYS  26           HZ2      LYS  26  -6.706  15.424   5.617
  214   2HZ   LYS  26           HZ1      LYS  26  -6.582  17.086   5.956
  215   3HZ   LYS  26           HZ3      LYS  26  -6.968  15.993   7.196
  216    H    LEU  27           HN       LEU  27  -9.839  10.245   3.287
  217    HA   LEU  27           HA       LEU  27 -12.276   9.866   1.590
  218   1HB   LEU  27           HB2      LEU  27  -9.757   8.533   1.535
  219   2HB   LEU  27           HB1      LEU  27 -10.947   7.381   2.143
  220    HG   LEU  27           HG       LEU  27 -12.388   8.429   0.134
  221   1HD1  LEU  27          HD13      LEU  27  -9.594   9.212  -0.359
  222   2HD1  LEU  27          HD12      LEU  27 -10.345   8.361  -1.708
  223   3HD1  LEU  27          HD11      LEU  27 -11.080   9.834  -1.077
  224   1HD2  LEU  27          HD23      LEU  27 -10.254   6.281  -0.088
  225   2HD2  LEU  27          HD22      LEU  27 -11.930   6.051   0.410
  226   3HD2  LEU  27          HD21      LEU  27 -11.559   6.510  -1.253
  227    H    LYS  28           HN       LYS  28 -14.043   8.903   2.581
  228    HA   LYS  28           HA       LYS  28 -13.861   8.550   5.504
  229   1HB   LYS  28           HB2      LYS  28 -15.959   9.048   3.524
  230   2HB   LYS  28           HB1      LYS  28 -16.442   7.904   4.776
  231   1HG   LYS  28           HG2      LYS  28 -16.544   9.532   6.343
  232   2HG   LYS  28           HG1      LYS  28 -14.988  10.200   5.852
  233   1HD   LYS  28           HD2      LYS  28 -16.135  11.941   4.990
  234   2HD   LYS  28           HD1      LYS  28 -16.683  10.831   3.732
  235   1HE   LYS  28           HE2      LYS  28 -18.461  10.145   5.574
  236   2HE   LYS  28           HE1      LYS  28 -18.111  11.757   6.194
  237   1HZ   LYS  28           HZ3      LYS  28 -18.658  11.385   3.330
  238   2HZ   LYS  28           HZ2      LYS  28 -19.951  11.442   4.428
  239   3HZ   LYS  28           HZ1      LYS  28 -18.887  12.761   4.294
  240    H    LYS  29           HN       LYS  29 -15.218   6.594   6.363
  241    HA   LYS  29           HA       LYS  29 -13.925   4.187   5.359
  242   1HB   LYS  29           HB2      LYS  29 -15.498   3.098   7.127
  243   2HB   LYS  29           HB1      LYS  29 -14.200   4.149   7.686
  244   1HG   LYS  29           HG2      LYS  29 -15.701   5.981   8.026
  245   2HG   LYS  29           HG1      LYS  29 -16.999   5.165   7.153
  246   1HD   LYS  29           HD2      LYS  29 -17.493   4.903   9.481
  247   2HD   LYS  29           HD1      LYS  29 -16.875   3.344   8.932
  248   1HE   LYS  29           HE2      LYS  29 -14.551   4.304   9.670
  249   2HE   LYS  29           HE1      LYS  29 -15.521   5.417  10.634
  250   1HZ   LYS  29           HZ1      LYS  29 -16.487   2.764  10.884
  251   2HZ   LYS  29           HZ3      LYS  29 -14.840   2.824  11.275
  252   3HZ   LYS  29           HZ2      LYS  29 -15.942   3.825  12.093
  253    H    SER  30           HN       SER  30 -16.855   5.816   4.640
  254    HA   SER  30           HA       SER  30 -18.286   3.410   3.763
  255   1HB   SER  30           HB2      SER  30 -18.918   6.196   4.160
  256   2HB   SER  30           HB1      SER  30 -19.379   5.728   2.526
  257    HG   SER  30           HG       SER  30 -20.877   5.335   4.432
  258    H    GLU  31           HN       GLU  31 -16.535   6.106   2.228
  259    HA   GLU  31           HA       GLU  31 -16.832   4.915  -0.435
  260   1HB   GLU  31           HB2      GLU  31 -16.668   7.385  -0.128
  261   2HB   GLU  31           HB1      GLU  31 -15.036   7.181   0.508
  262   1HG   GLU  31           HG2      GLU  31 -14.142   6.814  -1.550
  263   2HG   GLU  31           HG1      GLU  31 -15.523   5.857  -2.086
  264    H    LEU  32           HN       LEU  32 -14.755   4.600   2.271
  265    HA   LEU  32           HA       LEU  32 -12.435   3.622   0.767
  266   1HB   LEU  32           HB2      LEU  32 -11.925   4.593   2.898
  267   2HB   LEU  32           HB1      LEU  32 -13.179   3.652   3.705
  268    HG   LEU  32           HG       LEU  32 -11.943   1.575   3.241
  269   1HD1  LEU  32          HD11      LEU  32 -10.421   3.423   1.530
  270   2HD1  LEU  32          HD13      LEU  32  -9.410   2.340   2.487
  271   3HD1  LEU  32          HD12      LEU  32 -10.626   1.677   1.395
  272   1HD2  LEU  32          HD23      LEU  32 -11.012   3.757   4.905
  273   2HD2  LEU  32          HD22      LEU  32 -11.002   2.026   5.242
  274   3HD2  LEU  32          HD21      LEU  32  -9.652   2.766   4.382
  275    H    LYS  33           HN       LYS  33 -15.122   2.292   2.647
  276    HA   LYS  33           HA       LYS  33 -14.428  -0.467   2.492
  277   1HB   LYS  33           HB2      LYS  33 -16.327   0.706   3.813
  278   2HB   LYS  33           HB1      LYS  33 -17.262   0.568   2.328
  279   1HG   LYS  33           HG2      LYS  33 -16.444  -1.946   2.416
  280   2HG   LYS  33           HG1      LYS  33 -16.246  -1.601   4.134
  281   1HD   LYS  33           HD2      LYS  33 -18.560  -0.994   4.362
  282   2HD   LYS  33           HD1      LYS  33 -18.798  -1.024   2.614
  283   1HE   LYS  33           HE2      LYS  33 -17.782  -3.546   3.142
  284   2HE   LYS  33           HE1      LYS  33 -18.821  -3.240   4.533
  285   1HZ   LYS  33           HZ3      LYS  33 -19.785  -2.637   1.818
  286   2HZ   LYS  33           HZ2      LYS  33 -19.826  -4.237   2.393
  287   3HZ   LYS  33           HZ1      LYS  33 -20.674  -3.014   3.213
  288    H    GLU  34           HN       GLU  34 -16.307   1.629   0.349
  289    HA   GLU  34           HA       GLU  34 -16.857  -0.439  -1.602
  290   1HB   GLU  34           HB2      GLU  34 -17.913   1.271  -2.830
  291   2HB   GLU  34           HB1      GLU  34 -18.043   1.859  -1.175
  292   1HG   GLU  34           HG2      GLU  34 -16.211   3.366  -1.455
  293   2HG   GLU  34           HG1      GLU  34 -15.777   2.653  -3.006
  294    H    LEU  35           HN       LEU  35 -14.410   2.025  -1.159
  295    HA   LEU  35           HA       LEU  35 -13.085   1.980  -3.629
  296   1HB   LEU  35           HB2      LEU  35 -12.568   3.048  -1.128
  297   2HB   LEU  35           HB1      LEU  35 -11.245   1.899  -1.339
  298    HG   LEU  35           HG       LEU  35 -10.596   4.071  -2.257
  299   1HD1  LEU  35          HD13      LEU  35 -11.163   1.841  -4.207
  300   2HD1  LEU  35          HD12      LEU  35 -10.349   3.317  -4.727
  301   3HD1  LEU  35          HD11      LEU  35  -9.624   2.300  -3.481
  302   1HD2  LEU  35          HD22      LEU  35 -13.166   4.518  -2.782
  303   2HD2  LEU  35          HD21      LEU  35 -11.902   5.310  -3.722
  304   3HD2  LEU  35          HD23      LEU  35 -12.716   3.883  -4.363
  305    H    ILE  36           HN       ILE  36 -12.747  -0.294  -0.904
  306    HA   ILE  36           HA       ILE  36 -10.775  -1.909  -2.339
  307    HB   ILE  36           HB       ILE  36 -12.206  -3.052  -0.003
  308   1HG1  ILE  36          HG12      ILE  36 -10.659  -0.459   0.076
  309   2HG1  ILE  36          HG11      ILE  36 -12.196  -0.845   0.844
  310   1HG2  ILE  36          HG21      ILE  36 -10.208  -4.089  -1.057
  311   2HG2  ILE  36          HG23      ILE  36  -9.275  -2.643  -0.668
  312   3HG2  ILE  36          HG22      ILE  36  -9.914  -3.656   0.627
  313   1HD1  ILE  36          HD13      ILE  36 -11.014  -2.460   2.333
  314   2HD1  ILE  36          HD12      ILE  36  -9.485  -1.967   1.610
  315   3HD1  ILE  36          HD11      ILE  36 -10.436  -0.807   2.537
  316    H    ASN  37           HN       ASN  37 -14.079  -2.577  -1.130
  317    HA   ASN  37           HA       ASN  37 -14.340  -5.038  -2.593
  318   1HB   ASN  37           HB2      ASN  37 -15.693  -4.053  -0.554
  319   2HB   ASN  37           HB1      ASN  37 -16.727  -3.407  -1.828
  320   1HD2  ASN  37          HD22      ASN  37 -18.042  -6.787  -1.017
  321   2HD2  ASN  37          HD21      ASN  37 -17.896  -5.306  -0.202
  322    H    ASN  38           HN       ASN  38 -14.194  -1.962  -3.846
  323    HA   ASN  38           HA       ASN  38 -16.081  -2.646  -6.059
  324   1HB   ASN  38           HB2      ASN  38 -16.500  -0.493  -4.815
  325   2HB   ASN  38           HB1      ASN  38 -14.943   0.086  -5.404
  326   1HD2  ASN  38          HD22      ASN  38 -16.075   0.413  -8.803
  327   2HD2  ASN  38          HD21      ASN  38 -14.693   0.120  -7.862
  328    H    GLU  39           HN       GLU  39 -13.265  -0.449  -5.968
  329    HA   GLU  39           HA       GLU  39 -12.378  -0.976  -8.568
  330   1HB   GLU  39           HB2      GLU  39 -10.613  -0.439  -6.157
  331   2HB   GLU  39           HB1      GLU  39 -10.185  -0.161  -7.846
  332   1HG   GLU  39           HG2      GLU  39 -12.691   1.130  -7.315
  333   2HG   GLU  39           HG1      GLU  39 -11.530   1.619  -6.081
  334    H    LEU  40           HN       LEU  40 -11.359  -2.632  -5.558
  335    HA   LEU  40           HA       LEU  40  -9.968  -4.687  -7.157
  336   1HB   LEU  40           HB2      LEU  40 -10.147  -3.977  -4.252
  337   2HB   LEU  40           HB1      LEU  40  -9.714  -5.631  -4.683
  338    HG   LEU  40           HG       LEU  40  -8.324  -3.213  -5.854
  339   1HD1  LEU  40          HD13      LEU  40  -7.497  -4.938  -3.494
  340   2HD1  LEU  40          HD12      LEU  40  -6.511  -3.680  -4.239
  341   3HD1  LEU  40          HD11      LEU  40  -8.003  -3.250  -3.404
  342   1HD2  LEU  40          HD22      LEU  40  -7.890  -6.198  -5.862
  343   2HD2  LEU  40          HD21      LEU  40  -7.920  -5.082  -7.229
  344   3HD2  LEU  40          HD23      LEU  40  -6.542  -5.095  -6.131
  345    H    SER  41           HN       SER  41 -11.518  -5.824  -4.285
  346    HA   SER  41           HA       SER  41 -13.461  -7.112  -3.950
  347   1HB   SER  41           HB2      SER  41 -15.225  -6.689  -5.295
  348   2HB   SER  41           HB1      SER  41 -14.158  -5.571  -6.138
  349    HG   SER  41           HG       SER  41 -15.305  -7.463  -7.285
  350    H    HIS  42           HN       HIS  42 -11.659  -7.733  -6.970
  351    HA   HIS  42           HA       HIS  42 -12.285 -10.534  -7.070
  352   1HB   HIS  42           HB2      HIS  42 -10.075  -8.857  -8.264
  353   2HB   HIS  42           HB1      HIS  42 -10.170 -10.599  -8.528
  354    HD1  HIS  42           HD1      HIS  42 -12.482 -11.467  -9.633
  355    HD2  HIS  42           HD2      HIS  42 -11.776  -7.365  -9.890
  356    HE1  HIS  42           HE1      HIS  42 -14.060 -10.576 -11.403
  357    H    PHE  43           HN       PHE  43 -10.224  -8.729  -5.018
  358    HA   PHE  43           HA       PHE  43  -8.680 -11.192  -4.323
  359   1HB   PHE  43           HB2      PHE  43  -8.116  -8.249  -4.020
  360   2HB   PHE  43           HB1      PHE  43  -7.280  -9.429  -3.008
  361    HD1  PHE  43           HD2      PHE  43  -8.059  -8.601  -6.570
  362    HD2  PHE  43           HD1      PHE  43  -5.441 -10.642  -3.843
  363    HE1  PHE  43           HE2      PHE  43  -6.517  -9.120  -8.440
  364    HE2  PHE  43           HE1      PHE  43  -3.899 -11.162  -5.714
  365    HZ   PHE  43           HZ       PHE  43  -4.437 -10.401  -8.012
  366    H    LEU  44           HN       LEU  44 -11.307 -11.111  -3.418
  367    HA   LEU  44           HA       LEU  44 -10.901 -10.626  -0.496
  368   1HB   LEU  44           HB2      LEU  44 -12.454  -8.962  -1.609
  369   2HB   LEU  44           HB1      LEU  44 -13.522 -10.308  -1.988
  370    HG   LEU  44           HG       LEU  44 -13.929  -8.896   0.188
  371   1HD1  LEU  44          HD13      LEU  44 -14.544 -11.508  -0.624
  372   2HD1  LEU  44          HD12      LEU  44 -14.027 -11.663   1.056
  373   3HD1  LEU  44          HD11      LEU  44 -15.352 -10.576   0.636
  374   1HD2  LEU  44          HD21      LEU  44 -11.518  -9.235   0.933
  375   2HD2  LEU  44          HD23      LEU  44 -12.741  -9.632   2.140
  376   3HD2  LEU  44          HD22      LEU  44 -11.936 -10.920   1.244
  377    H    GLU  45           HN       GLU  45 -11.494 -12.878  -2.906
  378    HA   GLU  45           HA       GLU  45 -13.019 -14.672  -1.081
  379   1HB   GLU  45           HB2      GLU  45 -13.432 -16.042  -3.088
  380   2HB   GLU  45           HB1      GLU  45 -13.946 -14.374  -3.353
  381   1HG   GLU  45           HG2      GLU  45 -11.716 -13.932  -4.429
  382   2HG   GLU  45           HG1      GLU  45 -11.373 -15.659  -4.306
  383    H    GLU  46           HN       GLU  46  -9.988 -13.971  -1.206
  384    HA   GLU  46           HA       GLU  46  -9.118 -16.763  -0.774
  385   1HB   GLU  46           HB2      GLU  46  -7.136 -16.489  -2.233
  386   2HB   GLU  46           HB1      GLU  46  -8.635 -16.390  -3.157
  387   1HG   GLU  46           HG2      GLU  46  -7.871 -13.775  -2.151
  388   2HG   GLU  46           HG1      GLU  46  -6.571 -14.487  -3.109
  389    H    ILE  47           HN       ILE  47  -9.010 -15.923   1.430
  390    HA   ILE  47           HA       ILE  47  -6.418 -14.635   1.968
  391    HB   ILE  47           HB       ILE  47  -9.090 -13.401   2.631
  392   1HG1  ILE  47          HG12      ILE  47  -7.356 -11.390   2.061
  393   2HG1  ILE  47          HG11      ILE  47  -6.641 -12.696   1.115
  394   1HG2  ILE  47          HG22      ILE  47  -6.463 -13.114   4.104
  395   2HG2  ILE  47          HG21      ILE  47  -7.687 -11.844   4.128
  396   3HG2  ILE  47          HG23      ILE  47  -8.059 -13.440   4.779
  397   1HD1  ILE  47          HD12      ILE  47  -9.166 -13.103   0.404
  398   2HD1  ILE  47          HD11      ILE  47  -9.320 -11.399   0.831
  399   3HD1  ILE  47          HD13      ILE  47  -8.180 -11.895  -0.417
  400    H    LYS  48           HN       LYS  48  -5.553 -15.374   3.900
  401    HA   LYS  48           HA       LYS  48  -7.213 -17.335   5.401
  402   1HB   LYS  48           HB2      LYS  48  -4.888 -17.922   4.483
  403   2HB   LYS  48           HB1      LYS  48  -4.247 -16.856   5.733
  404   1HG   LYS  48           HG2      LYS  48  -4.958 -18.236   7.470
  405   2HG   LYS  48           HG1      LYS  48  -6.230 -18.975   6.497
  406   1HD   LYS  48           HD2      LYS  48  -4.639 -20.683   6.566
  407   2HD   LYS  48           HD1      LYS  48  -4.226 -19.870   5.055
  408   1HE   LYS  48           HE2      LYS  48  -2.811 -18.429   6.959
  409   2HE   LYS  48           HE1      LYS  48  -2.676 -20.094   7.528
  410   1HZ   LYS  48           HZ1      LYS  48  -2.161 -20.579   5.059
  411   2HZ   LYS  48           HZ3      LYS  48  -1.785 -18.926   4.979
  412   3HZ   LYS  48           HZ2      LYS  48  -0.941 -19.938   6.052
  413    H    GLU  49           HN       GLU  49  -5.772 -14.202   5.638
  414    HA   GLU  49           HA       GLU  49  -5.871 -14.141   8.575
  415   1HB   GLU  49           HB2      GLU  49  -4.961 -12.315   6.410
  416   2HB   GLU  49           HB1      GLU  49  -5.577 -11.542   7.868
  417   1HG   GLU  49           HG2      GLU  49  -3.546 -13.776   7.991
  418   2HG   GLU  49           HG1      GLU  49  -3.067 -12.083   7.835
  419    H    GLN  50           HN       GLN  50  -8.276 -14.812   8.346
  420    HA   GLN  50           HA       GLN  50 -10.264 -13.095   7.332
  421   1HB   GLN  50           HB2      GLN  50 -10.850 -15.293   8.187
  422   2HB   GLN  50           HB1      GLN  50 -10.312 -14.849   9.807
  423   1HG   GLN  50           HG2      GLN  50 -12.100 -13.309  10.097
  424   2HG   GLN  50           HG1      GLN  50 -12.488 -13.317   8.377
  425   1HE2  GLN  50          HE22      GLN  50 -14.964 -15.733   9.059
  426   2HE2  GLN  50          HE21      GLN  50 -14.594 -14.212   8.403
  427    H    GLU  51           HN       GLU  51  -8.181 -12.686  10.075
  428    HA   GLU  51           HA       GLU  51  -9.868 -10.677  11.364
  429   1HB   GLU  51           HB2      GLU  51  -7.476 -12.137  12.009
  430   2HB   GLU  51           HB1      GLU  51  -7.176 -10.411  12.224
  431   1HG   GLU  51           HG2      GLU  51  -9.167 -10.215  13.640
  432   2HG   GLU  51           HG1      GLU  51  -9.527 -11.925  13.394
  433    H    VAL  52           HN       VAL  52  -7.113 -10.666   9.133
  434    HA   VAL  52           HA       VAL  52  -6.652  -7.825   9.311
  435    HB   VAL  52           HB       VAL  52  -6.025  -9.736   7.036
  436   1HG1  VAL  52          HG12      VAL  52  -5.975  -7.143   6.693
  437   2HG1  VAL  52          HG11      VAL  52  -4.534  -7.209   7.706
  438   3HG1  VAL  52          HG13      VAL  52  -4.583  -8.096   6.183
  439   1HG2  VAL  52          HG22      VAL  52  -5.116 -10.127   9.470
  440   2HG2  VAL  52          HG21      VAL  52  -4.009 -10.221   8.100
  441   3HG2  VAL  52          HG23      VAL  52  -4.065  -8.762   9.089
  442    H    VAL  53           HN       VAL  53  -8.466  -9.821   6.958
  443    HA   VAL  53           HA       VAL  53  -9.425  -7.453   5.555
  444    HB   VAL  53           HB       VAL  53 -10.187 -10.382   5.433
  445   1HG1  VAL  53          HG13      VAL  53 -11.627  -8.020   4.484
  446   2HG1  VAL  53          HG12      VAL  53 -11.210  -9.120   3.169
  447   3HG1  VAL  53          HG11      VAL  53 -12.152  -9.705   4.541
  448   1HG2  VAL  53          HG23      VAL  53  -7.977  -9.531   4.485
  449   2HG2  VAL  53          HG22      VAL  53  -9.031 -10.349   3.332
  450   3HG2  VAL  53          HG21      VAL  53  -8.931  -8.588   3.340
  451    H    ASP  54           HN       ASP  54 -10.650  -9.580   8.091
  452    HA   ASP  54           HA       ASP  54 -13.295  -8.333   8.048
  453   1HB   ASP  54           HB2      ASP  54 -12.865 -10.711   8.808
  454   2HB   ASP  54           HB1      ASP  54 -12.086 -10.039  10.241
  455    H    LYS  55           HN       LYS  55 -10.224  -7.542   9.360
  456    HA   LYS  55           HA       LYS  55 -11.309  -6.044  11.635
  457   1HB   LYS  55           HB2      LYS  55  -9.048  -6.917  11.843
  458   2HB   LYS  55           HB1      LYS  55  -8.549  -6.093  10.365
  459   1HG   LYS  55           HG2      LYS  55  -9.767  -4.343  12.410
  460   2HG   LYS  55           HG1      LYS  55  -8.223  -5.058  12.871
  461   1HD   LYS  55           HD2      LYS  55  -7.536  -4.312  10.414
  462   2HD   LYS  55           HD1      LYS  55  -8.843  -3.150  10.649
  463   1HE   LYS  55           HE2      LYS  55  -6.464  -3.538  12.492
  464   2HE   LYS  55           HE1      LYS  55  -6.701  -2.188  11.381
  465   1HZ   LYS  55           HZ1      LYS  55  -8.858  -1.802  12.606
  466   2HZ   LYS  55           HZ3      LYS  55  -8.279  -2.871  13.789
  467   3HZ   LYS  55           HZ2      LYS  55  -7.434  -1.434  13.456
  468    H    VAL  56           HN       VAL  56 -10.189  -5.349   8.340
  469    HA   VAL  56           HA       VAL  56 -10.684  -2.473   8.676
  470    HB   VAL  56           HB       VAL  56 -10.386  -2.568   6.102
  471   1HG1  VAL  56          HG12      VAL  56  -8.285  -3.275   8.142
  472   2HG1  VAL  56          HG11      VAL  56  -7.860  -3.055   6.445
  473   3HG1  VAL  56          HG13      VAL  56  -8.573  -1.721   7.354
  474   1HG2  VAL  56          HG23      VAL  56 -10.680  -5.263   6.507
  475   2HG2  VAL  56          HG22      VAL  56  -9.918  -4.546   5.089
  476   3HG2  VAL  56          HG21      VAL  56  -8.926  -5.104   6.436
  477    H    MET  57           HN       MET  57 -12.268  -5.314   7.447
  478    HA   MET  57           HA       MET  57 -14.500  -3.888   6.223
  479   1HB   MET  57           HB2      MET  57 -13.679  -6.191   5.544
  480   2HB   MET  57           HB1      MET  57 -14.341  -6.798   7.062
  481   1HG   MET  57           HG2      MET  57 -16.355  -6.965   6.082
  482   2HG   MET  57           HG1      MET  57 -16.367  -5.215   5.866
  483   1HE   MET  57           HE2      MET  57 -14.387  -4.387   4.421
  484   2HE   MET  57           HE1      MET  57 -13.413  -5.573   3.556
  485   3HE   MET  57           HE3      MET  57 -14.576  -4.570   2.679
  486    H    GLU  58           HN       GLU  58 -13.698  -5.095   9.399
  487    HA   GLU  58           HA       GLU  58 -16.476  -5.070  10.327
  488   1HB   GLU  58           HB2      GLU  58 -15.537  -5.511  12.551
  489   2HB   GLU  58           HB1      GLU  58 -14.776  -6.577  11.376
  490   1HG   GLU  58           HG2      GLU  58 -12.853  -5.071  11.243
  491   2HG   GLU  58           HG1      GLU  58 -13.611  -3.972  12.391
  492    H    THR  59           HN       THR  59 -13.612  -2.958  10.682
  493    HA   THR  59           HA       THR  59 -15.056  -0.991  12.260
  494    HB   THR  59           HB       THR  59 -12.744  -0.137  10.588
  495    HG1  THR  59           HG1      THR  59 -11.325  -1.299  11.939
  496   1HG2  THR  59          HG21      THR  59 -13.878   0.310  13.299
  497   2HG2  THR  59          HG23      THR  59 -12.127   0.439  13.146
  498   3HG2  THR  59          HG22      THR  59 -13.175   1.467  12.167
  499    H    LEU  60           HN       LEU  60 -14.579  -1.685   8.899
  500    HA   LEU  60           HA       LEU  60 -15.471   0.837   7.821
  501   1HB   LEU  60           HB2      LEU  60 -14.987  -1.933   6.819
  502   2HB   LEU  60           HB1      LEU  60 -16.013  -0.893   5.837
  503    HG   LEU  60           HG       LEU  60 -13.278  -0.082   6.851
  504   1HD1  LEU  60          HD11      LEU  60 -14.130  -1.662   4.497
  505   2HD1  LEU  60          HD13      LEU  60 -13.017  -0.339   4.150
  506   3HD1  LEU  60          HD12      LEU  60 -12.562  -1.595   5.302
  507   1HD2  LEU  60          HD22      LEU  60 -15.390   1.435   5.861
  508   2HD2  LEU  60          HD21      LEU  60 -13.699   1.933   5.907
  509   3HD2  LEU  60          HD23      LEU  60 -14.362   1.192   4.450
  510    H    ASP  61           HN       ASP  61 -17.096  -2.327   8.156
  511    HA   ASP  61           HA       ASP  61 -19.710  -1.174   7.536
  512   1HB   ASP  61           HB2      ASP  61 -18.761  -3.632   7.164
  513   2HB   ASP  61           HB1      ASP  61 -19.400  -3.878   8.790
  514    H    GLU  62           HN       GLU  62 -17.791  -1.318  10.314
  515    HA   GLU  62           HA       GLU  62 -19.858  -1.747  12.287
  516   1HB   GLU  62           HB2      GLU  62 -17.616  -2.110  13.009
  517   2HB   GLU  62           HB1      GLU  62 -17.096  -0.530  12.419
  518   1HG   GLU  62           HG2      GLU  62 -17.977   0.587  14.228
  519   2HG   GLU  62           HG1      GLU  62 -19.290  -0.572  14.436
  520    H    ASP  63           HN       ASP  63 -18.055   1.254  11.581
  521    HA   ASP  63           HA       ASP  63 -20.277   2.835  12.664
  522   1HB   ASP  63           HB2      ASP  63 -17.672   3.296  12.776
  523   2HB   ASP  63           HB1      ASP  63 -17.968   4.078  11.222
  524    H    GLY  64           HN       GLY  64 -18.542   2.823   9.544
  525   1HA   GLY  64           HA2      GLY  64 -19.499   2.922   7.368
  526   2HA   GLY  64           HA1      GLY  64 -21.091   3.087   8.106
  527    H    ASP  65           HN       ASP  65 -19.700   5.285   9.853
  528    HA   ASP  65           HA       ASP  65 -19.679   7.428   7.778
  529   1HB   ASP  65           HB2      ASP  65 -21.870   7.134   9.173
  530   2HB   ASP  65           HB1      ASP  65 -20.932   7.863  10.476
  531    H    GLY  66           HN       GLY  66 -17.285   7.065   8.190
  532   1HA   GLY  66           HA2      GLY  66 -16.434   8.808  10.436
  533   2HA   GLY  66           HA1      GLY  66 -15.665   7.234  10.254
  534    H    GLU  67           HN       GLU  67 -14.203   9.656  10.088
  535    HA   GLU  67           HA       GLU  67 -13.724  10.045   7.183
  536   1HB   GLU  67           HB2      GLU  67 -12.832  11.539   9.653
  537   2HB   GLU  67           HB1      GLU  67 -12.140  11.860   8.062
  538   1HG   GLU  67           HG2      GLU  67 -13.887  13.208   7.623
  539   2HG   GLU  67           HG1      GLU  67 -14.945  11.797   7.705
  540    H    CYS  68           HN       CYS  68 -11.667   9.686   6.255
  541    HA   CYS  68           HA       CYS  68  -9.737   8.157   7.964
  542   1HB   CYS  68           HB2      CYS  68 -10.049   7.529   5.047
  543   2HB   CYS  68           HB1      CYS  68  -9.458   6.499   6.349
  544    HG   CYS  68           HG       CYS  68 -12.451   7.266   6.501
  545    H    ASP  69           HN       ASP  69  -7.526   8.041   6.680
  546    HA   ASP  69           HA       ASP  69  -7.084  10.746   5.466
  547   1HB   ASP  69           HB2      ASP  69  -5.036   9.176   7.048
  548   2HB   ASP  69           HB1      ASP  69  -4.952  10.866   6.548
  549    H    PHE  70           HN       PHE  70  -4.278  10.064   4.932
  550    HA   PHE  70           HA       PHE  70  -4.741   8.550   2.435
  551   1HB   PHE  70           HB2      PHE  70  -2.459  10.236   3.468
  552   2HB   PHE  70           HB1      PHE  70  -2.329   9.283   1.991
  553    HD1  PHE  70           HD1      PHE  70  -4.105  12.084   3.636
  554    HD2  PHE  70           HD2      PHE  70  -3.505   9.908  -0.019
  555    HE1  PHE  70           HE1      PHE  70  -5.279  13.870   2.379
  556    HE2  PHE  70           HE2      PHE  70  -4.683  11.695  -1.274
  557    HZ   PHE  70           HZ       PHE  70  -5.569  13.674  -0.076
  558    H    GLN  71           HN       GLN  71  -2.443   8.468   5.184
  559    HA   GLN  71           HA       GLN  71  -1.267   5.966   4.361
  560   1HB   GLN  71           HB2      GLN  71  -1.391   7.056   7.188
  561   2HB   GLN  71           HB1      GLN  71  -0.180   5.967   6.509
  562   1HG   GLN  71           HG2      GLN  71   0.330   7.842   4.830
  563   2HG   GLN  71           HG1      GLN  71  -0.610   8.894   5.888
  564   1HE2  GLN  71          HE22      GLN  71   2.812   7.252   7.492
  565   2HE2  GLN  71          HE21      GLN  71   1.879   6.323   6.423
  566    H    GLU  72           HN       GLU  72  -4.251   6.777   5.830
  567    HA   GLU  72           HA       GLU  72  -4.609   4.188   7.157
  568   1HB   GLU  72           HB2      GLU  72  -6.247   6.667   6.754
  569   2HB   GLU  72           HB1      GLU  72  -7.093   5.166   7.128
  570   1HG   GLU  72           HG2      GLU  72  -4.851   5.316   8.871
  571   2HG   GLU  72           HG1      GLU  72  -5.648   6.889   8.912
  572    H    PHE  73           HN       PHE  73  -6.250   5.840   4.437
  573    HA   PHE  73           HA       PHE  73  -7.559   3.482   3.473
  574   1HB   PHE  73           HB2      PHE  73  -8.549   5.268   2.443
  575   2HB   PHE  73           HB1      PHE  73  -7.102   6.256   2.564
  576    HD1  PHE  73           HD1      PHE  73  -5.253   5.958   0.870
  577    HD2  PHE  73           HD2      PHE  73  -9.101   4.108   0.428
  578    HE1  PHE  73           HE1      PHE  73  -4.799   5.589  -1.540
  579    HE2  PHE  73           HE2      PHE  73  -8.648   3.739  -1.981
  580    HZ   PHE  73           HZ       PHE  73  -6.497   4.479  -2.966
  581    H    MET  74           HN       MET  74  -4.317   4.630   3.239
  582    HA   MET  74           HA       MET  74  -3.612   3.032   0.895
  583   1HB   MET  74           HB2      MET  74  -2.183   4.816   2.822
  584   2HB   MET  74           HB1      MET  74  -1.223   3.635   1.941
  585   1HG   MET  74           HG2      MET  74  -3.055   5.726   0.722
  586   2HG   MET  74           HG1      MET  74  -1.293   5.750   0.699
  587   1HE   MET  74           HE1      MET  74  -0.069   3.316   0.007
  588   2HE   MET  74           HE3      MET  74  -1.412   2.321   0.584
  589   3HE   MET  74           HE2      MET  74  -0.828   2.146  -1.067
  590    H    ALA  75           HN       ALA  75  -2.736   2.894   4.360
  591    HA   ALA  75           HA       ALA  75  -1.527   0.287   4.140
  592   1HB   ALA  75           HB2      ALA  75  -2.637   1.710   6.582
  593   2HB   ALA  75           HB1      ALA  75  -1.579   0.299   6.613
  594   3HB   ALA  75           HB3      ALA  75  -0.983   1.837   5.987
  595    H    PHE  76           HN       PHE  76  -4.746   1.352   4.131
  596    HA   PHE  76           HA       PHE  76  -5.919  -1.042   5.338
  597   1HB   PHE  76           HB2      PHE  76  -6.851   1.526   4.278
  598   2HB   PHE  76           HB1      PHE  76  -7.894   0.186   3.809
  599    HD1  PHE  76           HD2      PHE  76  -5.843   0.687   6.900
  600    HD2  PHE  76           HD1      PHE  76  -9.773   0.294   5.215
  601    HE1  PHE  76           HE2      PHE  76  -6.817   0.647   9.181
  602    HE2  PHE  76           HE1      PHE  76 -10.746   0.254   7.495
  603    HZ   PHE  76           HZ       PHE  76  -9.268   0.431   9.479
  604    H    VAL  77           HN       VAL  77  -5.483   0.260   2.043
  605    HA   VAL  77           HA       VAL  77  -6.738  -1.917   0.659
  606    HB   VAL  77           HB       VAL  77  -4.573   0.038  -0.166
  607   1HG1  VAL  77          HG11      VAL  77  -5.363  -2.407  -1.431
  608   2HG1  VAL  77          HG13      VAL  77  -5.961  -1.062  -2.403
  609   3HG1  VAL  77          HG12      VAL  77  -4.244  -1.182  -2.026
  610   1HG2  VAL  77          HG21      VAL  77  -7.106   0.629   0.358
  611   2HG2  VAL  77          HG23      VAL  77  -6.296   1.331  -1.042
  612   3HG2  VAL  77          HG22      VAL  77  -7.368  -0.055  -1.246
  613    H    SER  78           HN       SER  78  -3.571  -1.527   2.092
  614    HA   SER  78           HA       SER  78  -2.376  -3.783   0.686
  615   1HB   SER  78           HB2      SER  78  -1.077  -3.208   3.194
  616   2HB   SER  78           HB1      SER  78  -0.486  -2.942   1.557
  617    HG   SER  78           HG       SER  78  -1.380  -0.945   1.555
  618    H    MET  79           HN       MET  79  -3.577  -3.317   4.029
  619    HA   MET  79           HA       MET  79  -3.055  -5.858   5.047
  620   1HB   MET  79           HB2      MET  79  -5.633  -4.357   5.541
  621   2HB   MET  79           HB1      MET  79  -4.789  -5.444   6.640
  622   1HG   MET  79           HG2      MET  79  -2.976  -3.381   5.800
  623   2HG   MET  79           HG1      MET  79  -4.457  -2.634   6.398
  624   1HE   MET  79           HE1      MET  79  -5.670  -3.377   8.364
  625   2HE   MET  79           HE3      MET  79  -4.875  -3.585   9.932
  626   3HE   MET  79           HE2      MET  79  -4.656  -2.094   9.016
  627    H    VAL  80           HN       VAL  80  -5.841  -4.872   3.041
  628    HA   VAL  80           HA       VAL  80  -6.992  -7.549   3.162
  629    HB   VAL  80           HB       VAL  80  -8.473  -6.541   1.286
  630   1HG1  VAL  80          HG13      VAL  80  -8.772  -6.702   3.916
  631   2HG1  VAL  80          HG12      VAL  80  -8.622  -4.948   3.813
  632   3HG1  VAL  80          HG11      VAL  80  -9.908  -5.776   2.937
  633   1HG2  VAL  80          HG21      VAL  80  -6.519  -4.573   1.339
  634   2HG2  VAL  80          HG23      VAL  80  -8.119  -4.402   0.623
  635   3HG2  VAL  80          HG22      VAL  80  -7.829  -3.858   2.274
  636    H    THR  81           HN       THR  81  -5.219  -5.684   0.668
  637    HA   THR  81           HA       THR  81  -5.417  -7.818  -1.285
  638    HB   THR  81           HB       THR  81  -3.236  -5.747  -1.332
  639    HG1  THR  81           HG1      THR  81  -5.099  -4.567  -2.481
  640   1HG2  THR  81          HG23      THR  81  -3.888  -7.668  -3.095
  641   2HG2  THR  81          HG22      THR  81  -4.993  -6.408  -3.642
  642   3HG2  THR  81          HG21      THR  81  -3.259  -6.100  -3.603
  643    H    THR  82           HN       THR  82  -3.664  -7.575   1.557
  644    HA   THR  82           HA       THR  82  -1.834  -9.719   0.604
  645    HB   THR  82           HB       THR  82   0.027  -8.718   1.903
  646    HG1  THR  82           HG1      THR  82  -0.525  -6.318   2.282
  647   1HG2  THR  82          HG21      THR  82  -0.955  -7.919  -0.585
  648   2HG2  THR  82          HG23      THR  82  -0.598  -6.403   0.244
  649   3HG2  THR  82          HG22      THR  82   0.666  -7.617   0.042
  650    H    ALA  83           HN       ALA  83  -4.337  -9.324   2.388
  651    HA   ALA  83           HA       ALA  83  -3.774  -9.757   5.093
  652   1HB   ALA  83           HB3      ALA  83  -5.975 -10.550   3.260
  653   2HB   ALA  83           HB2      ALA  83  -5.859 -11.451   4.773
  654   3HB   ALA  83           HB1      ALA  83  -6.046  -9.696   4.801
  655    H    CYS  84           HN       CYS  84  -4.074 -12.292   2.558
  656    HA   CYS  84           HA       CYS  84  -1.862 -13.823   3.171
  657   1HB   CYS  84           HB2      CYS  84  -3.818 -13.948   5.337
  658   2HB   CYS  84           HB1      CYS  84  -3.411 -15.542   4.702
  659    HG   CYS  84           HG       CYS  84  -1.679 -14.532   6.605
  660    H    HIS  85           HN       HIS  85  -2.534 -16.408   3.044
  661    HA   HIS  85           HA       HIS  85  -3.604 -18.089   1.780
  662   1HB   HIS  85           HB2      HIS  85  -5.641 -16.322   2.199
  663   2HB   HIS  85           HB1      HIS  85  -5.507 -16.258   0.443
  664    HD1  HIS  85           HD1      HIS  85  -7.967 -17.585   1.767
  665    HD2  HIS  85           HD2      HIS  85  -4.558 -19.679   0.600
  666    HE1  HIS  85           HE1      HIS  85  -8.682 -19.993   1.442
  667    H    GLU  86           HN       GLU  86  -4.694 -17.764  -0.852
  668    HA   GLU  86           HA       GLU  86  -2.191 -17.294  -2.317
  669   1HB   GLU  86           HB2      GLU  86  -3.960 -19.172  -2.741
  670   2HB   GLU  86           HB1      GLU  86  -4.840 -17.912  -3.608
  671   1HG   GLU  86           HG2      GLU  86  -3.399 -17.952  -5.352
  672   2HG   GLU  86           HG1      GLU  86  -1.992 -17.988  -4.291
  673    H    PHE  87           HN       PHE  87  -2.024 -14.981  -1.993
  674    HA   PHE  87           HA       PHE  87  -4.060 -13.398  -3.504
  675   1HB   PHE  87           HB2      PHE  87  -3.441 -11.488  -2.142
  676   2HB   PHE  87           HB1      PHE  87  -3.782 -12.845  -1.067
  677    HD1  PHE  87           HD2      PHE  87  -1.783 -14.293  -0.293
  678    HD2  PHE  87           HD1      PHE  87  -1.356 -10.395  -2.056
  679    HE1  PHE  87           HE2      PHE  87   0.500 -14.114   0.658
  680    HE2  PHE  87           HE1      PHE  87   0.925 -10.216  -1.097
  681    HZ   PHE  87           HZ       PHE  87   1.850 -12.074   0.257
  682    H    PHE  88           HN       PHE  88  -1.483 -14.870  -4.341
  683    HA   PHE  88           HA       PHE  88  -0.311 -12.541  -5.803
  684   1HB   PHE  88           HB2      PHE  88   0.986 -14.389  -3.979
  685   2HB   PHE  88           HB1      PHE  88   1.705 -14.487  -5.586
  686    HD1  PHE  88           HD1      PHE  88   0.480 -11.913  -3.148
  687    HD2  PHE  88           HD2      PHE  88   3.365 -12.953  -6.149
  688    HE1  PHE  88           HE1      PHE  88   1.671  -9.774  -2.742
  689    HE2  PHE  88           HE2      PHE  88   4.556 -10.817  -5.743
  690    HZ   PHE  88           HZ       PHE  88   3.709  -9.228  -4.038
  691    H    GLU  89           HN       GLU  89  -1.889 -15.491  -6.012
  692    HA   GLU  89           HA       GLU  89  -2.096 -17.102  -7.720
  693   1HB   GLU  89           HB2      GLU  89  -3.118 -14.883  -8.580
  694   2HB   GLU  89           HB1      GLU  89  -1.667 -14.763  -9.577
  695   1HG   GLU  89           HG2      GLU  89  -2.139 -16.915 -10.611
  696   2HG   GLU  89           HG1      GLU  89  -3.518 -17.163  -9.540
  697    H    HIS  90           HN       HIS  90   0.435 -17.338  -6.832
  698    HA   HIS  90           HA       HIS  90   2.408 -16.851  -8.914
  699   1HB   HIS  90           HB2      HIS  90   3.899 -18.211  -7.473
  700   2HB   HIS  90           HB1      HIS  90   3.078 -16.951  -6.552
  701    HD1  HIS  90           HD1      HIS  90   2.913 -20.675  -7.239
  702    HD2  HIS  90           HD2      HIS  90   1.393 -17.898  -4.529
  703    HE1  HIS  90           HE1      HIS  90   1.755 -22.008  -5.424
  704    H    GLU  91           HN       GLU  91   0.276 -19.489  -8.025
  705    HA   GLU  91           HA       GLU  91   1.456 -21.695  -9.238
  706   1HB   GLU  91           HB2      GLU  91  -1.058 -21.131  -8.260
  707   2HB   GLU  91           HB1      GLU  91  -1.376 -21.396  -9.975
  708   1HG   GLU  91           HG2      GLU  91   0.186 -23.489  -9.646
  709   2HG   GLU  91           HG1      GLU  91  -0.238 -23.297  -7.946
  710   1H    MET   0           HT2      MET   0  -7.363  -1.977 -15.073
  711   2H    MET   0           HT1      MET   0  -7.547  -3.666 -15.032
  712   3H    MET   0           HT3      MET   0  -7.209  -2.885 -16.500
  713    HA   MET   0           HA       MET   0  -9.327  -2.302 -16.859
  714   1HB   MET   0           HB2      MET   0  -9.620  -4.405 -14.692
  715   2HB   MET   0           HB1      MET   0 -10.936  -3.871 -15.738
  716   1HG   MET   0           HG2      MET   0  -8.656  -4.494 -17.366
  717   2HG   MET   0           HG1      MET   0  -8.979  -5.855 -16.290
  718   1HE   MET   0           HE3      MET   0  -8.928  -5.136 -19.223
  719   2HE   MET   0           HE2      MET   0  -9.902  -6.518 -19.720
  720   3HE   MET   0           HE1      MET   0 -10.455  -4.883 -20.079
  721    H    SER   1           HN       SER   1  -8.456  -2.153 -13.451
  722    HA   SER   1           HA       SER   1 -10.525  -0.014 -13.118
  723   1HB   SER   1           HB2      SER   1 -11.351  -1.537 -11.607
  724   2HB   SER   1           HB1      SER   1  -9.792  -2.330 -11.393
  725    HG   SER   1           HG       SER   1 -10.914  -0.578  -9.809
  726    H    GLU   2           HN       GLU   2  -9.869   1.436 -11.156
  727    HA   GLU   2           HA       GLU   2  -7.184   2.445 -11.718
  728   1HB   GLU   2           HB2      GLU   2  -9.605   3.502 -10.669
  729   2HB   GLU   2           HB1      GLU   2  -8.373   3.696  -9.423
  730   1HG   GLU   2           HG2      GLU   2  -8.300   5.651 -10.850
  731   2HG   GLU   2           HG1      GLU   2  -6.861   4.685 -11.175
  732    H    LEU   3           HN       LEU   3  -8.854   1.019  -8.902
  733    HA   LEU   3           HA       LEU   3  -6.416   1.033  -7.290
  734   1HB   LEU   3           HB2      LEU   3  -8.956   1.058  -6.549
  735   2HB   LEU   3           HB1      LEU   3  -8.774  -0.693  -6.640
  736    HG   LEU   3           HG       LEU   3  -6.695  -0.440  -5.200
  737   1HD1  LEU   3          HD12      LEU   3  -7.584   2.367  -5.431
  738   2HD1  LEU   3          HD11      LEU   3  -7.192   1.855  -3.790
  739   3HD1  LEU   3          HD13      LEU   3  -5.985   1.719  -5.069
  740   1HD2  LEU   3          HD22      LEU   3  -9.457  -0.483  -4.527
  741   2HD2  LEU   3          HD21      LEU   3  -8.107  -1.090  -3.569
  742   3HD2  LEU   3          HD23      LEU   3  -8.661   0.571  -3.360
  743    H    GLU   4           HN       GLU   4  -8.331  -1.437  -8.994
  744    HA   GLU   4           HA       GLU   4  -6.739  -3.663  -8.193
  745   1HB   GLU   4           HB2      GLU   4  -8.948  -3.905  -9.268
  746   2HB   GLU   4           HB1      GLU   4  -8.285  -3.276 -10.776
  747   1HG   GLU   4           HG2      GLU   4  -6.499  -5.245 -10.291
  748   2HG   GLU   4           HG1      GLU   4  -7.921  -5.943  -9.514
  749    H    LYS   5           HN       LYS   5  -6.458  -1.541 -11.068
  750    HA   LYS   5           HA       LYS   5  -4.183  -2.982 -12.116
  751   1HB   LYS   5           HB2      LYS   5  -4.011  -1.225 -13.722
  752   2HB   LYS   5           HB1      LYS   5  -5.736  -1.401 -13.401
  753   1HG   LYS   5           HG2      LYS   5  -5.553   0.450 -11.716
  754   2HG   LYS   5           HG1      LYS   5  -3.879   0.683 -12.218
  755   1HD   LYS   5           HD2      LYS   5  -5.373   0.626 -14.604
  756   2HD   LYS   5           HD1      LYS   5  -6.307   1.622 -13.489
  757   1HE   LYS   5           HE2      LYS   5  -4.684   3.244 -13.355
  758   2HE   LYS   5           HE1      LYS   5  -3.367   2.090 -13.567
  759   1HZ   LYS   5           HZ2      LYS   5  -5.225   2.618 -15.788
  760   2HZ   LYS   5           HZ1      LYS   5  -3.962   3.709 -15.473
  761   3HZ   LYS   5           HZ3      LYS   5  -3.611   2.090 -15.839
  762    H    ALA   6           HN       ALA   6  -4.533  -0.192  -9.965
  763    HA   ALA   6           HA       ALA   6  -1.660   0.342  -9.937
  764   1HB   ALA   6           HB2      ALA   6  -3.414   2.106  -9.570
  765   2HB   ALA   6           HB1      ALA   6  -3.790   1.337  -8.027
  766   3HB   ALA   6           HB3      ALA   6  -2.197   2.042  -8.295
  767    H    MET   7           HN       MET   7  -3.824  -0.399  -7.208
  768    HA   MET   7           HA       MET   7  -1.948  -1.195  -5.345
  769   1HB   MET   7           HB2      MET   7  -4.327  -1.043  -4.811
  770   2HB   MET   7           HB1      MET   7  -4.672  -2.432  -5.845
  771   1HG   MET   7           HG2      MET   7  -4.498  -2.976  -3.377
  772   2HG   MET   7           HG1      MET   7  -3.416  -3.907  -4.411
  773   1HE   MET   7           HE1      MET   7  -3.406  -3.823  -1.686
  774   2HE   MET   7           HE3      MET   7  -1.693  -3.743  -1.259
  775   3HE   MET   7           HE2      MET   7  -2.786  -2.448  -0.777
  776    H    VAL   8           HN       VAL   8  -3.553  -3.366  -7.686
  777    HA   VAL   8           HA       VAL   8  -2.084  -5.695  -6.936
  778    HB   VAL   8           HB       VAL   8  -3.166  -5.062  -9.696
  779   1HG1  VAL   8          HG13      VAL   8  -2.516  -7.618  -8.205
  780   2HG1  VAL   8          HG12      VAL   8  -3.466  -7.577  -9.691
  781   3HG1  VAL   8          HG11      VAL   8  -1.787  -7.037  -9.702
  782   1HG2  VAL   8          HG23      VAL   8  -4.767  -4.780  -7.681
  783   2HG2  VAL   8          HG22      VAL   8  -5.281  -5.863  -8.972
  784   3HG2  VAL   8          HG21      VAL   8  -4.612  -6.526  -7.481
  785    H    ALA   9           HN       ALA   9  -1.327  -3.067  -9.184
  786    HA   ALA   9           HA       ALA   9   0.897  -4.230 -10.500
  787   1HB   ALA   9           HB3      ALA   9   0.436  -1.359  -9.629
  788   2HB   ALA   9           HB2      ALA   9   1.726  -1.866 -10.717
  789   3HB   ALA   9           HB1      ALA   9   0.041  -2.060 -11.196
  790    H    LEU  10           HN       LEU  10   0.647  -2.674  -7.320
  791    HA   LEU  10           HA       LEU  10   3.419  -2.615  -6.691
  792   1HB   LEU  10           HB2      LEU  10   1.064  -1.982  -5.362
  793   2HB   LEU  10           HB1      LEU  10   1.706  -3.332  -4.424
  794    HG   LEU  10           HG       LEU  10   3.449  -1.010  -5.256
  795   1HD1  LEU  10          HD13      LEU  10   1.233  -0.766  -3.591
  796   2HD1  LEU  10          HD12      LEU  10   2.569  -1.019  -2.468
  797   3HD1  LEU  10          HD11      LEU  10   2.625   0.316  -3.621
  798   1HD2  LEU  10          HD22      LEU  10   3.812  -3.500  -3.871
  799   2HD2  LEU  10          HD21      LEU  10   5.018  -2.269  -4.241
  800   3HD2  LEU  10          HD23      LEU  10   4.099  -2.180  -2.739
  801    H    ILE  11           HN       ILE  11   0.974  -5.124  -5.949
  802    HA   ILE  11           HA       ILE  11   2.636  -7.028  -4.743
  803    HB   ILE  11           HB       ILE  11   0.202  -7.232  -6.504
  804   1HG1  ILE  11          HG12      ILE  11  -0.360  -8.519  -4.198
  805   2HG1  ILE  11          HG11      ILE  11   0.917  -7.446  -3.626
  806   1HG2  ILE  11          HG22      ILE  11   2.147  -9.356  -6.121
  807   2HG2  ILE  11          HG21      ILE  11   0.609  -9.779  -5.376
  808   3HG2  ILE  11          HG23      ILE  11   0.674  -9.359  -7.087
  809   1HD1  ILE  11          HD11      ILE  11  -0.302  -5.517  -4.639
  810   2HD1  ILE  11          HD13      ILE  11  -1.609  -6.614  -5.081
  811   3HD1  ILE  11          HD12      ILE  11  -1.236  -6.328  -3.382
  812    H    ASP  12           HN       ASP  12   2.253  -6.253  -8.172
  813    HA   ASP  12           HA       ASP  12   3.704  -8.391  -9.310
  814   1HB   ASP  12           HB2      ASP  12   2.446  -6.427 -10.447
  815   2HB   ASP  12           HB1      ASP  12   3.965  -5.550 -10.296
  816    H    VAL  13           HN       VAL  13   4.928  -5.215  -8.213
  817    HA   VAL  13           HA       VAL  13   7.645  -5.550  -8.772
  818    HB   VAL  13           HB       VAL  13   6.297  -4.208  -6.418
  819   1HG1  VAL  13          HG11      VAL  13   9.132  -4.778  -6.912
  820   2HG1  VAL  13          HG13      VAL  13   8.799  -3.058  -6.704
  821   3HG1  VAL  13          HG12      VAL  13   8.343  -4.205  -5.443
  822   1HG2  VAL  13          HG21      VAL  13   6.897  -3.525  -9.186
  823   2HG2  VAL  13          HG23      VAL  13   5.874  -2.678  -8.028
  824   3HG2  VAL  13          HG22      VAL  13   7.608  -2.364  -8.064
  825    H    PHE  14           HN       PHE  14   5.799  -6.892  -6.057
  826    HA   PHE  14           HA       PHE  14   7.970  -7.853  -4.507
  827   1HB   PHE  14           HB2      PHE  14   5.321  -7.905  -4.156
  828   2HB   PHE  14           HB1      PHE  14   5.527  -9.551  -4.754
  829    HD1  PHE  14           HD1      PHE  14   7.441 -10.959  -3.652
  830    HD2  PHE  14           HD2      PHE  14   5.720  -7.436  -1.896
  831    HE1  PHE  14           HE1      PHE  14   8.262 -11.671  -1.422
  832    HE2  PHE  14           HE2      PHE  14   6.543  -8.146   0.333
  833    HZ   PHE  14           HZ       PHE  14   7.812 -10.265   0.571
  834    H    HIS  15           HN       HIS  15   6.229  -9.416  -7.207
  835    HA   HIS  15           HA       HIS  15   7.980 -11.761  -7.107
  836   1HB   HIS  15           HB2      HIS  15   5.472 -11.425  -8.039
  837   2HB   HIS  15           HB1      HIS  15   6.369 -11.196  -9.541
  838    HD1  HIS  15           HD1      HIS  15   4.645 -13.723  -9.194
  839    HD2  HIS  15           HD2      HIS  15   8.690 -13.550  -8.205
  840    HE1  HIS  15           HE1      HIS  15   5.495 -16.109  -9.233
  841    H    GLN  16           HN       GLN  16   8.306  -8.632  -8.288
  842    HA   GLN  16           HA       GLN  16   9.889  -9.316 -10.661
  843   1HB   GLN  16           HB2      GLN  16   8.776  -6.896  -9.445
  844   2HB   GLN  16           HB1      GLN  16  10.419  -6.659 -10.040
  845   1HG   GLN  16           HG2      GLN  16   8.248  -7.964 -11.695
  846   2HG   GLN  16           HG1      GLN  16   8.580  -6.231 -11.744
  847   1HE2  GLN  16          HE22      GLN  16  11.051  -6.797 -14.181
  848   2HE2  GLN  16          HE21      GLN  16   9.701  -5.898 -13.684
  849    H    TYR  17           HN       TYR  17  10.431  -8.653  -7.276
  850    HA   TYR  17           HA       TYR  17  13.375  -8.602  -7.761
  851   1HB   TYR  17           HB2      TYR  17  11.669  -7.680  -5.441
  852   2HB   TYR  17           HB1      TYR  17  13.420  -7.847  -5.314
  853    HD1  TYR  17           HD2      TYR  17  10.747  -6.230  -7.371
  854    HD2  TYR  17           HD1      TYR  17  14.840  -6.133  -6.078
  855    HE1  TYR  17           HE2      TYR  17  11.039  -4.021  -8.464
  856    HE2  TYR  17           HE1      TYR  17  15.133  -3.925  -7.171
  857    HH   TYR  17           HH       TYR  17  13.197  -2.725  -9.445
  858    H    SER  18           HN       SER  18  10.982  -9.991  -5.484
  859    HA   SER  18           HA       SER  18  12.619 -11.823  -4.161
  860   1HB   SER  18           HB2      SER  18   9.891 -11.381  -4.312
  861   2HB   SER  18           HB1      SER  18  10.060 -13.008  -4.966
  862    HG   SER  18           HG       SER  18  11.398 -12.221  -2.609
  863    H    GLY  19           HN       GLY  19  10.745 -12.519  -7.136
  864   1HA   GLY  19           HA2      GLY  19  11.657 -15.079  -7.688
  865   2HA   GLY  19           HA1      GLY  19  11.336 -13.895  -8.958
  866    H    ARG  20           HN       ARG  20  13.250 -12.093  -8.881
  867    HA   ARG  20           HA       ARG  20  15.538 -13.278  -9.976
  868   1HB   ARG  20           HB2      ARG  20  15.272 -10.649  -8.491
  869   2HB   ARG  20           HB1      ARG  20  16.692 -11.110  -9.430
  870   1HG   ARG  20           HG2      ARG  20  15.323 -11.315 -11.452
  871   2HG   ARG  20           HG1      ARG  20  13.871 -10.928 -10.528
  872   1HD   ARG  20           HD2      ARG  20  14.479  -8.865 -11.508
  873   2HD   ARG  20           HD1      ARG  20  15.113  -8.755  -9.866
  874    HE   ARG  20           HE       ARG  20  16.844  -9.544 -12.175
  875   1HH1  ARG  20          HH11      ARG  20  18.420  -9.801  -9.882
  876   2HH1  ARG  20          HH12      ARG  20  18.994  -8.207  -9.515
  877   1HH2  ARG  20          HH21      ARG  20  16.602  -6.611 -11.455
  878   2HH2  ARG  20          HH22      ARG  20  17.964  -6.401 -10.407
  879    H    GLU  21           HN       GLU  21  16.205 -11.434  -7.073
  880    HA   GLU  21           HA       GLU  21  17.671 -13.810  -6.010
  881   1HB   GLU  21           HB2      GLU  21  19.044 -12.177  -4.772
  882   2HB   GLU  21           HB1      GLU  21  19.070 -11.830  -6.502
  883   1HG   GLU  21           HG2      GLU  21  16.860 -10.504  -5.102
  884   2HG   GLU  21           HG1      GLU  21  18.447 -10.005  -4.517
  885    H    GLY  22           HN       GLY  22  17.983 -12.849  -3.369
  886   1HA   GLY  22           HA2      GLY  22  16.840 -12.638  -1.321
  887   2HA   GLY  22           HA1      GLY  22  15.421 -12.116  -2.228
  888    H    ASP  23           HN       ASP  23  14.002 -13.468  -1.029
  889    HA   ASP  23           HA       ASP  23  14.496 -16.385  -1.070
  890   1HB   ASP  23           HB2      ASP  23  12.936 -14.545   0.547
  891   2HB   ASP  23           HB1      ASP  23  11.944 -15.892  -0.011
  892    H    LYS  24           HN       LYS  24  12.065 -17.503  -1.396
  893    HA   LYS  24           HA       LYS  24  11.583 -17.156  -4.250
  894   1HB   LYS  24           HB2      LYS  24  10.921 -19.100  -2.182
  895   2HB   LYS  24           HB1      LYS  24   9.536 -18.759  -3.219
  896   1HG   LYS  24           HG2      LYS  24  12.222 -19.233  -4.470
  897   2HG   LYS  24           HG1      LYS  24  11.266 -20.612  -3.926
  898   1HD   LYS  24           HD2      LYS  24   9.346 -19.242  -5.230
  899   2HD   LYS  24           HD1      LYS  24  10.750 -18.711  -6.155
  900   1HE   LYS  24           HE2      LYS  24  11.328 -21.316  -6.073
  901   2HE   LYS  24           HE1      LYS  24   9.579 -21.447  -5.889
  902   1HZ   LYS  24           HZ2      LYS  24   9.850 -19.624  -7.867
  903   2HZ   LYS  24           HZ1      LYS  24  11.128 -20.696  -8.189
  904   3HZ   LYS  24           HZ3      LYS  24   9.539 -21.278  -8.097
  905    H    HIS  25           HN       HIS  25   9.918 -16.291  -1.254
  906    HA   HIS  25           HA       HIS  25   8.218 -14.434  -2.815
  907   1HB   HIS  25           HB2      HIS  25   6.932 -16.220  -0.751
  908   2HB   HIS  25           HB1      HIS  25   6.161 -15.264  -2.017
  909    HD1  HIS  25           HD1      HIS  25   7.104 -16.058  -4.571
  910    HD2  HIS  25           HD2      HIS  25   7.080 -18.875  -1.495
  911    HE1  HIS  25           HE1      HIS  25   7.192 -18.334  -5.680
  912    H    LYS  26           HN       LYS  26  10.443 -14.056  -0.985
  913    HA   LYS  26           HA       LYS  26   9.036 -12.432   1.089
  914   1HB   LYS  26           HB2      LYS  26  11.592 -13.890   1.739
  915   2HB   LYS  26           HB1      LYS  26  10.388 -13.225   2.842
  916   1HG   LYS  26           HG2      LYS  26   8.886 -15.021   1.418
  917   2HG   LYS  26           HG1      LYS  26  10.445 -15.843   1.485
  918   1HD   LYS  26           HD2      LYS  26  10.487 -15.495   3.951
  919   2HD   LYS  26           HD1      LYS  26   8.882 -14.768   3.850
  920   1HE   LYS  26           HE2      LYS  26   8.991 -17.338   2.476
  921   2HE   LYS  26           HE1      LYS  26   9.437 -17.487   4.176
  922   1HZ   LYS  26           HZ2      LYS  26   7.078 -15.908   3.385
  923   2HZ   LYS  26           HZ1      LYS  26   6.969 -17.598   3.526
  924   3HZ   LYS  26           HZ3      LYS  26   7.414 -16.664   4.869
  925    H    LEU  27           HN       LEU  27  10.098 -10.465   1.560
  926    HA   LEU  27           HA       LEU  27  12.454  -9.868  -0.192
  927   1HB   LEU  27           HB2      LEU  27   9.936  -8.552   0.033
  928   2HB   LEU  27           HB1      LEU  27  11.153  -7.477   0.721
  929    HG   LEU  27           HG       LEU  27  12.497  -8.262  -1.465
  930   1HD1  LEU  27          HD13      LEU  27   9.683  -8.995  -1.919
  931   2HD1  LEU  27          HD12      LEU  27  10.370  -7.980  -3.188
  932   3HD1  LEU  27          HD11      LEU  27  11.133  -9.517  -2.776
  933   1HD2  LEU  27          HD23      LEU  27  10.356  -6.116  -1.325
  934   2HD2  LEU  27          HD22      LEU  27  12.053  -5.939  -0.883
  935   3HD2  LEU  27          HD21      LEU  27  11.604  -6.193  -2.569
  936    H    LYS  28           HN       LYS  28  14.266  -9.024   0.826
  937    HA   LYS  28           HA       LYS  28  14.222  -9.034   3.776
  938   1HB   LYS  28           HB2      LYS  28  16.223  -9.274   1.654
  939   2HB   LYS  28           HB1      LYS  28  16.766  -8.289   3.013
  940   1HG   LYS  28           HG2      LYS  28  16.941 -10.096   4.363
  941   2HG   LYS  28           HG1      LYS  28  15.363 -10.706   3.868
  942   1HD   LYS  28           HD2      LYS  28  16.468 -12.322   2.748
  943   2HD   LYS  28           HD1      LYS  28  16.956 -11.065   1.610
  944   1HE   LYS  28           HE2      LYS  28  18.820 -10.599   3.437
  945   2HE   LYS  28           HE1      LYS  28  18.498 -12.278   3.873
  946   1HZ   LYS  28           HZ3      LYS  28  18.910 -11.554   1.052
  947   2HZ   LYS  28           HZ2      LYS  28  20.253 -11.739   2.074
  948   3HZ   LYS  28           HZ1      LYS  28  19.184 -13.037   1.830
  949    H    LYS  29           HN       LYS  29  15.619  -7.189   4.802
  950    HA   LYS  29           HA       LYS  29  14.281  -4.685   4.159
  951   1HB   LYS  29           HB2      LYS  29  15.935  -3.812   5.971
  952   2HB   LYS  29           HB1      LYS  29  14.665  -4.930   6.459
  953   1HG   LYS  29           HG2      LYS  29  16.179  -6.783   6.501
  954   2HG   LYS  29           HG1      LYS  29  17.435  -5.858   5.675
  955   1HD   LYS  29           HD2      LYS  29  18.039  -5.881   7.993
  956   2HD   LYS  29           HD1      LYS  29  17.396  -4.270   7.666
  957   1HE   LYS  29           HE2      LYS  29  15.110  -5.325   8.391
  958   2HE   LYS  29           HE1      LYS  29  16.123  -6.543   9.166
  959   1HZ   LYS  29           HZ1      LYS  29  17.101  -3.936   9.690
  960   2HZ   LYS  29           HZ3      LYS  29  15.473  -4.051  10.147
  961   3HZ   LYS  29           HZ2      LYS  29  16.613  -5.139  10.786
  962    H    SER  30           HN       SER  30  17.173  -6.198   3.111
  963    HA   SER  30           HA       SER  30  18.563  -3.694   2.467
  964   1HB   SER  30           HB2      SER  30  19.210  -6.504   2.494
  965   2HB   SER  30           HB1      SER  30  19.594  -5.837   0.909
  966    HG   SER  30           HG       SER  30  21.182  -5.673   2.777
  967    H    GLU  31           HN       GLU  31  16.740  -6.191   0.701
  968    HA   GLU  31           HA       GLU  31  16.911  -4.682  -1.809
  969   1HB   GLU  31           HB2      GLU  31  16.761  -7.172  -1.798
  970   2HB   GLU  31           HB1      GLU  31  15.161  -7.055  -1.065
  971   1HG   GLU  31           HG2      GLU  31  14.170  -6.445  -3.021
  972   2HG   GLU  31           HG1      GLU  31  15.526  -5.422  -3.500
  973    H    LEU  32           HN       LEU  32  14.963  -4.711   1.009
  974    HA   LEU  32           HA       LEU  32  12.577  -3.570  -0.256
  975   1HB   LEU  32           HB2      LEU  32  12.167  -4.797   1.762
  976   2HB   LEU  32           HB1      LEU  32  13.458  -3.954   2.619
  977    HG   LEU  32           HG       LEU  32  12.202  -1.844   2.469
  978   1HD1  LEU  32          HD11      LEU  32  10.600  -3.477   0.619
  979   2HD1  LEU  32          HD13      LEU  32   9.637  -2.524   1.746
  980   3HD1  LEU  32          HD12      LEU  32  10.800  -1.725   0.687
  981   1HD2  LEU  32          HD23      LEU  32  11.350  -4.218   3.897
  982   2HD2  LEU  32          HD22      LEU  32  11.356  -2.541   4.441
  983   3HD2  LEU  32          HD21      LEU  32   9.967  -3.177   3.561
  984    H    LYS  33           HN       LYS  33  15.349  -2.464   1.645
  985    HA   LYS  33           HA       LYS  33  14.650   0.289   1.858
  986   1HB   LYS  33           HB2      LYS  33  16.608  -1.027   2.937
  987   2HB   LYS  33           HB1      LYS  33  17.472  -0.703   1.438
  988   1HG   LYS  33           HG2      LYS  33  16.659   1.776   1.869
  989   2HG   LYS  33           HG1      LYS  33  16.543   1.223   3.539
  990   1HD   LYS  33           HD2      LYS  33  18.865   0.605   3.583
  991   2HD   LYS  33           HD1      LYS  33  19.022   0.850   1.843
  992   1HE   LYS  33           HE2      LYS  33  18.032   3.283   2.720
  993   2HE   LYS  33           HE1      LYS  33  19.136   2.814   4.014
  994   1HZ   LYS  33           HZ3      LYS  33  19.970   2.554   1.205
  995   2HZ   LYS  33           HZ2      LYS  33  20.040   4.072   1.966
  996   3HZ   LYS  33           HZ1      LYS  33  20.924   2.762   2.592
  997    H    GLU  34           HN       GLU  34  16.424  -1.519  -0.608
  998    HA   GLU  34           HA       GLU  34  16.882   0.775  -2.317
  999   1HB   GLU  34           HB2      GLU  34  17.879  -0.766  -3.792
 1000   2HB   GLU  34           HB1      GLU  34  18.087  -1.551  -2.228
 1001   1HG   GLU  34           HG2      GLU  34  16.243  -3.023  -2.604
 1002   2HG   GLU  34           HG1      GLU  34  15.737  -2.128  -4.034
 1003    H    LEU  35           HN       LEU  35  14.459  -1.738  -2.064
 1004    HA   LEU  35           HA       LEU  35  13.019  -1.397  -4.445
 1005   1HB   LEU  35           HB2      LEU  35  12.620  -2.765  -2.070
 1006   2HB   LEU  35           HB1      LEU  35  11.289  -1.607  -2.081
 1007    HG   LEU  35           HG       LEU  35  10.596  -3.654  -3.223
 1008   1HD1  LEU  35          HD13      LEU  35  11.071  -1.199  -4.913
 1009   2HD1  LEU  35          HD12      LEU  35  10.234  -2.605  -5.569
 1010   3HD1  LEU  35          HD11      LEU  35   9.568  -1.753  -4.176
 1011   1HD2  LEU  35          HD22      LEU  35  13.139  -4.020  -3.917
 1012   2HD2  LEU  35          HD21      LEU  35  11.831  -4.697  -4.886
 1013   3HD2  LEU  35          HD23      LEU  35  12.615  -3.198  -5.387
 1014    H    ILE  36           HN       ILE  36  12.811   0.524  -1.451
 1015    HA   ILE  36           HA       ILE  36  10.773   2.291  -2.586
 1016    HB   ILE  36           HB       ILE  36  12.314   3.148  -0.198
 1017   1HG1  ILE  36          HG12      ILE  36  10.770   0.557  -0.362
 1018   2HG1  ILE  36          HG11      ILE  36  12.342   0.853   0.374
 1019   1HG2  ILE  36          HG21      ILE  36  10.269   4.296  -1.024
 1020   2HG2  ILE  36          HG23      ILE  36   9.354   2.808  -0.770
 1021   3HG2  ILE  36          HG22      ILE  36  10.055   3.658   0.607
 1022   1HD1  ILE  36          HD13      ILE  36  11.233   2.269   2.101
 1023   2HD1  ILE  36          HD12      ILE  36   9.670   1.858   1.396
 1024   3HD1  ILE  36          HD11      ILE  36  10.664   0.599   2.130
 1025    H    ASN  37           HN       ASN  37  14.132   2.825  -1.461
 1026    HA   ASN  37           HA       ASN  37  14.324   5.449  -2.624
 1027   1HB   ASN  37           HB2      ASN  37  15.771   4.229  -0.784
 1028   2HB   ASN  37           HB1      ASN  37  16.743   3.748  -2.175
 1029   1HD2  ASN  37          HD22      ASN  37  18.097   7.011  -1.021
 1030   2HD2  ASN  37          HD21      ASN  37  17.989   5.439  -0.386
 1031    H    ASN  38           HN       ASN  38  14.118   2.546  -4.233
 1032    HA   ASN  38           HA       ASN  38  15.898   3.509  -6.430
 1033   1HB   ASN  38           HB2      ASN  38  16.376   1.220  -5.479
 1034   2HB   ASN  38           HB1      ASN  38  14.792   0.709  -6.060
 1035   1HD2  ASN  38          HD22      ASN  38  15.762   0.808  -9.523
 1036   2HD2  ASN  38          HD21      ASN  38  14.426   0.976  -8.492
 1037    H    GLU  39           HN       GLU  39  13.090   1.301  -6.477
 1038    HA   GLU  39           HA       GLU  39  12.081   2.138  -8.950
 1039   1HB   GLU  39           HB2      GLU  39  10.433   1.300  -6.543
 1040   2HB   GLU  39           HB1      GLU  39   9.924   1.228  -8.231
 1041   1HG   GLU  39           HG2      GLU  39  12.452  -0.105  -7.978
 1042   2HG   GLU  39           HG1      GLU  39  11.350  -0.747  -6.760
 1043    H    LEU  40           HN       LEU  40  11.204   3.407  -5.718
 1044    HA   LEU  40           HA       LEU  40   9.741   5.636  -6.988
 1045   1HB   LEU  40           HB2      LEU  40  10.056   4.575  -4.202
 1046   2HB   LEU  40           HB1      LEU  40   9.605   6.268  -4.408
 1047    HG   LEU  40           HG       LEU  40   8.161   4.004  -5.798
 1048   1HD1  LEU  40          HD13      LEU  40   7.447   5.421  -3.209
 1049   2HD1  LEU  40          HD12      LEU  40   6.426   4.259  -4.055
 1050   3HD1  LEU  40          HD11      LEU  40   7.956   3.739  -3.350
 1051   1HD2  LEU  40          HD22      LEU  40   7.727   6.965  -5.424
 1052   2HD2  LEU  40          HD21      LEU  40   7.693   6.026  -6.915
 1053   3HD2  LEU  40          HD23      LEU  40   6.367   5.896  -5.761
 1054    H    SER  41           HN       SER  41  11.425   6.421  -4.075
 1055    HA   SER  41           HA       SER  41  13.382   7.667  -3.676
 1056   1HB   SER  41           HB2      SER  41  15.081   7.421  -5.143
 1057   2HB   SER  41           HB1      SER  41  13.975   6.411  -6.066
 1058    HG   SER  41           HG       SER  41  15.069   8.435  -7.026
 1059    H    HIS  42           HN       HIS  42  11.441   8.645  -6.510
 1060    HA   HIS  42           HA       HIS  42  12.063  11.440  -6.299
 1061   1HB   HIS  42           HB2      HIS  42   9.798   9.910  -7.585
 1062   2HB   HIS  42           HB1      HIS  42   9.882  11.672  -7.638
 1063    HD1  HIS  42           HD1      HIS  42  12.140  12.682  -8.735
 1064    HD2  HIS  42           HD2      HIS  42  11.420   8.637  -9.456
 1065    HE1  HIS  42           HE1      HIS  42  13.631  12.022 -10.673
 1066    H    PHE  43           HN       PHE  43  10.100   9.386  -4.388
 1067    HA   PHE  43           HA       PHE  43   8.592  11.737  -3.327
 1068   1HB   PHE  43           HB2      PHE  43   8.039   8.777  -3.360
 1069   2HB   PHE  43           HB1      PHE  43   7.254   9.820  -2.174
 1070    HD1  PHE  43           HD2      PHE  43   7.863   9.438  -5.841
 1071    HD2  PHE  43           HD1      PHE  43   5.378  11.117  -2.768
 1072    HE1  PHE  43           HE2      PHE  43   6.235  10.174  -7.561
 1073    HE2  PHE  43           HE1      PHE  43   3.750  11.853  -4.488
 1074    HZ   PHE  43           HZ       PHE  43   4.178  11.381  -6.885
 1075    H    LEU  44           HN       LEU  44  11.258  11.560  -2.563
 1076    HA   LEU  44           HA       LEU  44  10.990  10.720   0.294
 1077   1HB   LEU  44           HB2      LEU  44  12.487   9.211  -1.084
 1078   2HB   LEU  44           HB1      LEU  44  13.538  10.599  -1.346
 1079    HG   LEU  44           HG       LEU  44  14.047   8.934   0.622
 1080   1HD1  LEU  44          HD13      LEU  44  14.622  11.629   0.105
 1081   2HD1  LEU  44          HD12      LEU  44  14.185  11.575   1.813
 1082   3HD1  LEU  44          HD11      LEU  44  15.488  10.555   1.203
 1083   1HD2  LEU  44          HD21      LEU  44  11.673   9.166   1.513
 1084   2HD2  LEU  44          HD23      LEU  44  12.952   9.420   2.700
 1085   3HD2  LEU  44          HD22      LEU  44  12.107  10.804   2.006
 1086    H    GLU  45           HN       GLU  45  11.470  13.252  -1.849
 1087    HA   GLU  45           HA       GLU  45  13.080  14.819   0.107
 1088   1HB   GLU  45           HB2      GLU  45  13.398  16.426  -1.736
 1089   2HB   GLU  45           HB1      GLU  45  13.898  14.806  -2.225
 1090   1HG   GLU  45           HG2      GLU  45  11.621  14.485  -3.242
 1091   2HG   GLU  45           HG1      GLU  45  11.285  16.181  -2.895
 1092    H    GLU  46           HN       GLU  46  10.045  14.121   0.039
 1093    HA   GLU  46           HA       GLU  46   9.198  16.833   0.846
 1094   1HB   GLU  46           HB2      GLU  46   7.149  16.730  -0.541
 1095   2HB   GLU  46           HB1      GLU  46   8.602  16.754  -1.539
 1096   1HG   GLU  46           HG2      GLU  46   7.886  14.031  -0.824
 1097   2HG   GLU  46           HG1      GLU  46   6.544  14.848  -1.625
 1098    H    ILE  47           HN       ILE  47   9.195  15.731   2.935
 1099    HA   ILE  47           HA       ILE  47   6.630  14.371   3.433
 1100    HB   ILE  47           HB       ILE  47   9.329  13.080   3.816
 1101   1HG1  ILE  47          HG12      ILE  47   7.570  11.145   3.087
 1102   2HG1  ILE  47          HG11      ILE  47   6.810  12.553   2.342
 1103   1HG2  ILE  47          HG22      ILE  47   6.775  12.600   5.364
 1104   2HG2  ILE  47          HG21      ILE  47   7.998  11.343   5.176
 1105   3HG2  ILE  47          HG23      ILE  47   8.401  12.851   5.999
 1106   1HD1  ILE  47          HD12      ILE  47   9.301  13.058   1.567
 1107   2HD1  ILE  47          HD11      ILE  47   9.473  11.314   1.778
 1108   3HD1  ILE  47          HD13      ILE  47   8.276  11.953   0.653
 1109    H    LYS  48           HN       LYS  48   5.857  14.864   5.477
 1110    HA   LYS  48           HA       LYS  48   7.587  16.637   7.128
 1111   1HB   LYS  48           HB2      LYS  48   5.222  17.320   6.397
 1112   2HB   LYS  48           HB1      LYS  48   4.639  16.104   7.535
 1113   1HG   LYS  48           HG2      LYS  48   5.432  17.265   9.392
 1114   2HG   LYS  48           HG1      LYS  48   6.657  18.124   8.458
 1115   1HD   LYS  48           HD2      LYS  48   5.072  19.803   8.808
 1116   2HD   LYS  48           HD1      LYS  48   4.587  19.178   7.232
 1117   1HE   LYS  48           HE2      LYS  48   3.263  17.508   9.009
 1118   2HE   LYS  48           HE1      LYS  48   3.156  19.090   9.782
 1119   1HZ   LYS  48           HZ1      LYS  48   2.525  19.870   7.417
 1120   2HZ   LYS  48           HZ3      LYS  48   2.145  18.238   7.155
 1121   3HZ   LYS  48           HZ2      LYS  48   1.353  19.106   8.381
 1122    H    GLU  49           HN       GLU  49   6.157  13.490   7.048
 1123    HA   GLU  49           HA       GLU  49   6.393  13.070   9.948
 1124   1HB   GLU  49           HB2      GLU  49   5.383  11.517   7.622
 1125   2HB   GLU  49           HB1      GLU  49   6.066  10.576   8.946
 1126   1HG   GLU  49           HG2      GLU  49   4.046  12.766   9.433
 1127   2HG   GLU  49           HG1      GLU  49   3.558  11.104   9.095
 1128    H    GLN  50           HN       GLN  50   8.787  13.776   9.691
 1129    HA   GLN  50           HA       GLN  50  10.724  12.208   8.386
 1130   1HB   GLN  50           HB2      GLN  50  11.350  14.287   9.472
 1131   2HB   GLN  50           HB1      GLN  50  10.889  13.646  11.049
 1132   1HG   GLN  50           HG2      GLN  50  12.688  12.092  11.067
 1133   2HG   GLN  50           HG1      GLN  50  12.993  12.311   9.343
 1134   1HE2  GLN  50          HE22      GLN  50  15.501  14.640  10.198
 1135   2HE2  GLN  50          HE21      GLN  50  15.100  13.208   9.379
 1136    H    GLU  51           HN       GLU  51   8.771  11.455  11.152
 1137    HA   GLU  51           HA       GLU  51  10.517   9.312  12.107
 1138   1HB   GLU  51           HB2      GLU  51   8.157  10.668  13.034
 1139   2HB   GLU  51           HB1      GLU  51   7.868   8.928  13.051
 1140   1HG   GLU  51           HG2      GLU  51   9.923   8.571  14.340
 1141   2HG   GLU  51           HG1      GLU  51  10.273  10.300  14.286
 1142    H    VAL  52           HN       VAL  52   7.660   9.559  10.022
 1143    HA   VAL  52           HA       VAL  52   7.207   6.715   9.874
 1144    HB   VAL  52           HB       VAL  52   6.474   8.887   7.881
 1145   1HG1  VAL  52          HG12      VAL  52   6.409   6.356   7.228
 1146   2HG1  VAL  52          HG11      VAL  52   5.015   6.289   8.307
 1147   3HG1  VAL  52          HG13      VAL  52   4.993   7.356   6.903
 1148   1HG2  VAL  52          HG22      VAL  52   5.681   8.972  10.384
 1149   2HG2  VAL  52          HG21      VAL  52   4.511   9.228   9.089
 1150   3HG2  VAL  52          HG23      VAL  52   4.614   7.659   9.889
 1151    H    VAL  53           HN       VAL  53   8.909   8.995   7.700
 1152    HA   VAL  53           HA       VAL  53   9.799   6.821   5.977
 1153    HB   VAL  53           HB       VAL  53  10.555   9.747   6.176
 1154   1HG1  VAL  53          HG13      VAL  53  11.949   7.527   4.881
 1155   2HG1  VAL  53          HG12      VAL  53  11.470   8.776   3.730
 1156   3HG1  VAL  53          HG11      VAL  53  12.475   9.194   5.118
 1157   1HG2  VAL  53          HG23      VAL  53   8.303   9.007   5.236
 1158   2HG2  VAL  53          HG22      VAL  53   9.301   9.965   4.142
 1159   3HG2  VAL  53          HG21      VAL  53   9.203   8.215   3.941
 1160    H    ASP  54           HN       ASP  54  11.144   8.628   8.692
 1161    HA   ASP  54           HA       ASP  54  13.784   7.410   8.375
 1162   1HB   ASP  54           HB2      ASP  54  13.390   9.675   9.437
 1163   2HB   ASP  54           HB1      ASP  54  12.680   8.827  10.813
 1164    H    LYS  55           HN       LYS  55  10.778   6.448   9.722
 1165    HA   LYS  55           HA       LYS  55  11.967   4.687  11.745
 1166   1HB   LYS  55           HB2      LYS  55   9.719   5.516  12.164
 1167   2HB   LYS  55           HB1      LYS  55   9.151   4.876  10.621
 1168   1HG   LYS  55           HG2      LYS  55  10.463   2.896  12.379
 1169   2HG   LYS  55           HG1      LYS  55   8.942   3.541  12.994
 1170   1HD   LYS  55           HD2      LYS  55   8.141   3.098  10.500
 1171   2HD   LYS  55           HD1      LYS  55   9.456   1.923  10.531
 1172   1HE   LYS  55           HE2      LYS  55   7.168   2.069  12.516
 1173   2HE   LYS  55           HE1      LYS  55   7.352   0.867  11.240
 1174   1HZ   LYS  55           HZ1      LYS  55   9.563   0.345  12.307
 1175   2HZ   LYS  55           HZ3      LYS  55   9.041   1.259  13.637
 1176   3HZ   LYS  55           HZ2      LYS  55   8.181  -0.132  13.171
 1177    H    VAL  56           HN       VAL  56  10.693   4.396   8.446
 1178    HA   VAL  56           HA       VAL  56  11.202   1.502   8.408
 1179    HB   VAL  56           HB       VAL  56  10.784   1.910   5.881
 1180   1HG1  VAL  56          HG12      VAL  56   8.781   2.351   8.087
 1181   2HG1  VAL  56          HG11      VAL  56   8.277   2.338   6.397
 1182   3HG1  VAL  56          HG13      VAL  56   9.030   0.908   7.103
 1183   1HG2  VAL  56          HG23      VAL  56  11.097   4.538   6.596
 1184   2HG2  VAL  56          HG22      VAL  56  10.269   3.994   5.139
 1185   3HG2  VAL  56          HG21      VAL  56   9.341   4.379   6.589
 1186    H    MET  57           HN       MET  57  12.728   4.481   7.459
 1187    HA   MET  57           HA       MET  57  14.900   3.228   5.969
 1188   1HB   MET  57           HB2      MET  57  14.047   5.591   5.613
 1189   2HB   MET  57           HB1      MET  57  14.781   6.011   7.163
 1190   1HG   MET  57           HG2      MET  57  16.746   6.309   6.117
 1191   2HG   MET  57           HG1      MET  57  16.747   4.598   5.690
 1192   1HE   MET  57           HE2      MET  57  14.701   3.943   4.249
 1193   2HE   MET  57           HE1      MET  57  13.687   5.221   3.581
 1194   3HE   MET  57           HE3      MET  57  14.808   4.338   2.535
 1195    H    GLU  58           HN       GLU  58  14.247   4.032   9.303
 1196    HA   GLU  58           HA       GLU  58  17.067   3.910  10.090
 1197   1HB   GLU  58           HB2      GLU  58  16.234   4.069  12.392
 1198   2HB   GLU  58           HB1      GLU  58  15.419   5.267  11.392
 1199   1HG   GLU  58           HG2      GLU  58  13.491   3.778  11.167
 1200   2HG   GLU  58           HG1      GLU  58  14.303   2.550  12.135
 1201    H    THR  59           HN       THR  59  14.223   1.754  10.318
 1202    HA   THR  59           HA       THR  59  15.738  -0.385  11.578
 1203    HB   THR  59           HB       THR  59  13.349  -1.040   9.923
 1204    HG1  THR  59           HG1      THR  59  11.997  -0.059  11.469
 1205   1HG2  THR  59          HG21      THR  59  14.610  -1.808  12.503
 1206   2HG2  THR  59          HG23      THR  59  12.853  -1.928  12.419
 1207   3HG2  THR  59          HG22      THR  59  13.853  -2.822  11.274
 1208    H    LEU  60           HN       LEU  60  15.104   0.713   8.351
 1209    HA   LEU  60           HA       LEU  60  15.943  -1.653   6.934
 1210   1HB   LEU  60           HB2      LEU  60  15.412   1.217   6.300
 1211   2HB   LEU  60           HB1      LEU  60  16.391   0.311   5.152
 1212    HG   LEU  60           HG       LEU  60  13.706  -0.633   6.187
 1213   1HD1  LEU  60          HD11      LEU  60  14.447   1.229   4.006
 1214   2HD1  LEU  60          HD13      LEU  60  13.318  -0.050   3.553
 1215   3HD1  LEU  60          HD12      LEU  60  12.919   1.055   4.868
 1216   1HD2  LEU  60          HD22      LEU  60  15.768  -2.007   4.922
 1217   2HD2  LEU  60          HD21      LEU  60  14.081  -2.515   4.985
 1218   3HD2  LEU  60          HD23      LEU  60  14.675  -1.598   3.600
 1219    H    ASP  61           HN       ASP  61  17.582   1.456   7.577
 1220    HA   ASP  61           HA       ASP  61  20.163   0.402   6.699
 1221   1HB   ASP  61           HB2      ASP  61  19.200   2.882   6.673
 1222   2HB   ASP  61           HB1      ASP  61  19.914   2.930   8.285
 1223    H    GLU  62           HN       GLU  62  18.378   0.194   9.559
 1224    HA   GLU  62           HA       GLU  62  20.536   0.389  11.472
 1225   1HB   GLU  62           HB2      GLU  62  18.331   0.649  12.337
 1226   2HB   GLU  62           HB1      GLU  62  17.783  -0.850  11.584
 1227   1HG   GLU  62           HG2      GLU  62  18.747  -2.176  13.199
 1228   2HG   GLU  62           HG1      GLU  62  20.070  -1.044  13.486
 1229    H    ASP  63           HN       ASP  63  18.701  -2.514  10.492
 1230    HA   ASP  63           HA       ASP  63  20.970  -4.204  11.269
 1231   1HB   ASP  63           HB2      ASP  63  18.373  -4.689  11.446
 1232   2HB   ASP  63           HB1      ASP  63  18.596  -5.273   9.796
 1233    H    GLY  64           HN       GLY  64  19.090  -3.818   8.260
 1234   1HA   GLY  64           HA2      GLY  64  19.944  -3.644   6.044
 1235   2HA   GLY  64           HA1      GLY  64  21.569  -3.890   6.683
 1236    H    ASP  65           HN       ASP  65  20.261  -6.294   8.212
 1237    HA   ASP  65           HA       ASP  65  20.141  -8.167   5.895
 1238   1HB   ASP  65           HB2      ASP  65  22.395  -8.035   7.212
 1239   2HB   ASP  65           HB1      ASP  65  21.520  -8.922   8.459
 1240    H    GLY  66           HN       GLY  66  17.770  -7.871   6.460
 1241   1HA   GLY  66           HA2      GLY  66  17.025  -9.880   8.513
 1242   2HA   GLY  66           HA1      GLY  66  16.248  -8.298   8.562
 1243    H    GLU  67           HN       GLU  67  14.780 -10.690   8.169
 1244    HA   GLU  67           HA       GLU  67  14.163 -10.724   5.265
 1245   1HB   GLU  67           HB2      GLU  67  13.388 -12.514   7.574
 1246   2HB   GLU  67           HB1      GLU  67  12.623 -12.641   5.990
 1247   1HG   GLU  67           HG2      GLU  67  14.346 -13.914   5.309
 1248   2HG   GLU  67           HG1      GLU  67  15.407 -12.520   5.513
 1249    H    CYS  68           HN       CYS  68  12.065 -10.264   4.484
 1250    HA   CYS  68           HA       CYS  68  10.218  -8.966   6.453
 1251   1HB   CYS  68           HB2      CYS  68  10.393  -7.984   3.624
 1252   2HB   CYS  68           HB1      CYS  68   9.865  -7.123   5.068
 1253    HG   CYS  68           HG       CYS  68  12.861  -7.887   4.986
 1254    H    ASP  69           HN       ASP  69   7.950  -8.706   5.297
 1255    HA   ASP  69           HA       ASP  69   7.451 -11.244   3.786
 1256   1HB   ASP  69           HB2      ASP  69   5.479  -9.890   5.641
 1257   2HB   ASP  69           HB1      ASP  69   5.371 -11.507   4.945
 1258    H    PHE  70           HN       PHE  70   4.622 -10.517   3.470
 1259    HA   PHE  70           HA       PHE  70   4.967  -8.705   1.157
 1260   1HB   PHE  70           HB2      PHE  70   2.734 -10.519   2.083
 1261   2HB   PHE  70           HB1      PHE  70   2.537  -9.392   0.740
 1262    HD1  PHE  70           HD1      PHE  70   4.386 -12.364   1.948
 1263    HD2  PHE  70           HD2      PHE  70   3.615  -9.761  -1.383
 1264    HE1  PHE  70           HE1      PHE  70   5.500 -13.977   0.430
 1265    HE2  PHE  70           HE2      PHE  70   4.733 -11.373  -2.899
 1266    HZ   PHE  70           HZ       PHE  70   5.674 -13.478  -1.994
 1267    H    GLN  71           HN       GLN  71   2.800  -8.973   4.001
 1268    HA   GLN  71           HA       GLN  71   1.589  -6.395   3.542
 1269   1HB   GLN  71           HB2      GLN  71   1.845  -7.824   6.207
 1270   2HB   GLN  71           HB1      GLN  71   0.605  -6.665   5.722
 1271   1HG   GLN  71           HG2      GLN  71   0.015  -8.323   3.852
 1272   2HG   GLN  71           HG1      GLN  71   1.003  -9.493   4.730
 1273   1HE2  GLN  71          HE22      GLN  71  -2.339  -8.078   6.681
 1274   2HE2  GLN  71          HE21      GLN  71  -1.456  -7.020   5.690
 1275    H    GLU  72           HN       GLU  72   4.639  -7.365   4.761
 1276    HA   GLU  72           HA       GLU  72   5.059  -4.955   6.374
 1277   1HB   GLU  72           HB2      GLU  72   6.676  -7.357   5.599
 1278   2HB   GLU  72           HB1      GLU  72   7.538  -5.909   6.112
 1279   1HG   GLU  72           HG2      GLU  72   5.382  -6.283   7.926
 1280   2HG   GLU  72           HG1      GLU  72   6.179  -7.846   7.738
 1281    H    PHE  73           HN       PHE  73   6.570  -6.252   3.401
 1282    HA   PHE  73           HA       PHE  73   7.832  -3.787   2.671
 1283   1HB   PHE  73           HB2      PHE  73   8.772  -5.429   1.387
 1284   2HB   PHE  73           HB1      PHE  73   7.332  -6.432   1.454
 1285    HD1  PHE  73           HD1      PHE  73   5.406  -5.939  -0.103
 1286    HD2  PHE  73           HD2      PHE  73   9.230  -4.028  -0.497
 1287    HE1  PHE  73           HE1      PHE  73   4.839  -5.280  -2.425
 1288    HE2  PHE  73           HE2      PHE  73   8.663  -3.370  -2.819
 1289    HZ   PHE  73           HZ       PHE  73   6.468  -3.994  -3.784
 1290    H    MET  74           HN       MET  74   4.583  -4.915   2.450
 1291    HA   MET  74           HA       MET  74   3.769  -3.045   0.353
 1292   1HB   MET  74           HB2      MET  74   2.431  -5.060   2.113
 1293   2HB   MET  74           HB1      MET  74   1.432  -3.785   1.428
 1294   1HG   MET  74           HG2      MET  74   3.203  -5.702  -0.120
 1295   2HG   MET  74           HG1      MET  74   1.444  -5.732  -0.063
 1296   1HE   MET  74           HE1      MET  74   0.188  -3.239  -0.396
 1297   2HE   MET  74           HE3      MET  74   1.557  -2.315   0.234
 1298   3HE   MET  74           HE2      MET  74   0.895  -1.941  -1.356
 1299    H    ALA  75           HN       ALA  75   3.058  -3.338   3.846
 1300    HA   ALA  75           HA       ALA  75   1.841  -0.730   4.001
 1301   1HB   ALA  75           HB2      ALA  75   3.064  -2.436   6.198
 1302   2HB   ALA  75           HB1      ALA  75   2.009  -1.046   6.449
 1303   3HB   ALA  75           HB3      ALA  75   1.384  -2.498   5.669
 1304    H    PHE  76           HN       PHE  76   5.056  -1.768   3.713
 1305    HA   PHE  76           HA       PHE  76   6.285   0.466   5.146
 1306   1HB   PHE  76           HB2      PHE  76   7.164  -1.949   3.740
 1307   2HB   PHE  76           HB1      PHE  76   8.185  -0.556   3.388
 1308    HD1  PHE  76           HD2      PHE  76   6.281  -1.443   6.489
 1309    HD2  PHE  76           HD1      PHE  76  10.128  -0.825   4.682
 1310    HE1  PHE  76           HE2      PHE  76   7.362  -1.677   8.710
 1311    HE2  PHE  76           HE1      PHE  76  11.206  -1.060   6.902
 1312    HZ   PHE  76           HZ       PHE  76   9.824  -1.485   8.916
 1313    H    VAL  77           HN       VAL  77   5.693  -0.424   1.741
 1314    HA   VAL  77           HA       VAL  77   6.882   1.912   0.575
 1315    HB   VAL  77           HB       VAL  77   4.680   0.060  -0.378
 1316   1HG1  VAL  77          HG11      VAL  77   5.411   2.646  -1.374
 1317   2HG1  VAL  77          HG13      VAL  77   5.962   1.434  -2.528
 1318   3HG1  VAL  77          HG12      VAL  77   4.264   1.497  -2.060
 1319   1HG2  VAL  77          HG21      VAL  77   7.235  -0.577  -0.050
 1320   2HG2  VAL  77          HG23      VAL  77   6.360  -1.106  -1.485
 1321   3HG2  VAL  77          HG22      VAL  77   7.421   0.299  -1.569
 1322    H    SER  78           HN       SER  78   3.786   1.332   2.096
 1323    HA   SER  78           HA       SER  78   2.527   3.737   1.031
 1324   1HB   SER  78           HB2      SER  78   1.348   2.852   3.509
 1325   2HB   SER  78           HB1      SER  78   0.680   2.784   1.881
 1326    HG   SER  78           HG       SER  78   1.571   0.808   1.595
 1327    H    MET  79           HN       MET  79   3.883   2.870   4.234
 1328    HA   MET  79           HA       MET  79   3.412   5.265   5.576
 1329   1HB   MET  79           HB2      MET  79   6.009   3.729   5.762
 1330   2HB   MET  79           HB1      MET  79   5.219   4.668   7.025
 1331   1HG   MET  79           HG2      MET  79   3.367   2.714   6.025
 1332   2HG   MET  79           HG1      MET  79   4.874   1.909   6.458
 1333   1HE   MET  79           HE1      MET  79   6.180   2.411   8.442
 1334   2HE   MET  79           HE3      MET  79   5.459   2.421  10.057
 1335   3HE   MET  79           HE2      MET  79   5.196   1.052   8.980
 1336    H    VAL  80           HN       VAL  80   6.099   4.547   3.338
 1337    HA   VAL  80           HA       VAL  80   7.257   7.196   3.728
 1338    HB   VAL  80           HB       VAL  80   8.648   6.433   1.676
 1339   1HG1  VAL  80          HG13      VAL  80   9.070   6.272   4.292
 1340   2HG1  VAL  80          HG12      VAL  80   8.914   4.542   3.982
 1341   3HG1  VAL  80          HG11      VAL  80  10.159   5.479   3.154
 1342   1HG2  VAL  80          HG21      VAL  80   6.696   4.463   1.583
 1343   2HG2  VAL  80          HG23      VAL  80   8.261   4.389   0.776
 1344   3HG2  VAL  80          HG22      VAL  80   8.049   3.646   2.362
 1345    H    THR  81           HN       THR  81   5.367   5.640   1.112
 1346    HA   THR  81           HA       THR  81   5.473   7.999  -0.575
 1347    HB   THR  81           HB       THR  81   3.293   5.937  -0.771
 1348    HG1  THR  81           HG1      THR  81   5.098   4.918  -2.140
 1349   1HG2  THR  81          HG23      THR  81   3.860   8.065  -2.315
 1350   2HG2  THR  81          HG22      THR  81   4.940   6.886  -3.062
 1351   3HG2  THR  81          HG21      THR  81   3.208   6.566  -2.978
 1352    H    THR  82           HN       THR  82   3.857   7.400   2.296
 1353    HA   THR  82           HA       THR  82   1.984   9.635   1.696
 1354    HB   THR  82           HB       THR  82   0.187   8.472   2.949
 1355    HG1  THR  82           HG1      THR  82   0.755   6.049   3.008
 1356   1HG2  THR  82          HG21      THR  82   1.049   7.989   0.340
 1357   2HG2  THR  82          HG23      THR  82   0.731   6.381   0.995
 1358   3HG2  THR  82          HG22      THR  82  -0.540   7.604   1.000
 1359    H    ALA  83           HN       ALA  83   4.569   9.038   3.300
 1360    HA   ALA  83           HA       ALA  83   4.133   9.134   6.061
 1361   1HB   ALA  83           HB3      ALA  83   6.246  10.157   4.238
 1362   2HB   ALA  83           HB2      ALA  83   6.203  10.865   5.852
 1363   3HB   ALA  83           HB1      ALA  83   6.389   9.123   5.659
 1364    H    CYS  84           HN       CYS  84   4.314  11.963   3.842
 1365    HA   CYS  84           HA       CYS  84   2.135  13.394   4.738
 1366   1HB   CYS  84           HB2      CYS  84   4.191  13.265   6.810
 1367   2HB   CYS  84           HB1      CYS  84   3.754  14.922   6.393
 1368    HG   CYS  84           HG       CYS  84   2.114  13.676   8.237
 1369    H    HIS  85           HN       HIS  85   2.801  15.980   4.896
 1370    HA   HIS  85           HA       HIS  85   3.811  17.810   3.796
 1371   1HB   HIS  85           HB2      HIS  85   5.864  16.013   3.903
 1372   2HB   HIS  85           HB1      HIS  85   5.647  16.164   2.161
 1373    HD1  HIS  85           HD1      HIS  85   8.169  17.332   3.519
 1374    HD2  HIS  85           HD2      HIS  85   4.709  19.536   2.776
 1375    HE1  HIS  85           HE1      HIS  85   8.867  19.767   3.457
 1376    H    GLU  86           HN       GLU  86   4.775  17.814   1.098
 1377    HA   GLU  86           HA       GLU  86   2.206  17.514  -0.296
 1378   1HB   GLU  86           HB2      GLU  86   3.953  19.439  -0.572
 1379   2HB   GLU  86           HB1      GLU  86   4.791  18.298  -1.624
 1380   1HG   GLU  86           HG2      GLU  86   3.270  18.544  -3.281
 1381   2HG   GLU  86           HG1      GLU  86   1.914  18.444  -2.159
 1382    H    PHE  87           HN       PHE  87   2.054  15.178  -0.248
 1383    HA   PHE  87           HA       PHE  87   4.016  13.801  -2.034
 1384   1HB   PHE  87           HB2      PHE  87   3.460  11.737  -0.886
 1385   2HB   PHE  87           HB1      PHE  87   3.854  12.953   0.328
 1386    HD1  PHE  87           HD2      PHE  87   1.893  14.286   1.364
 1387    HD2  PHE  87           HD1      PHE  87   1.382  10.630  -0.835
 1388    HE1  PHE  87           HE2      PHE  87  -0.340  13.978   2.392
 1389    HE2  PHE  87           HE1      PHE  87  -0.849  10.323   0.199
 1390    HZ   PHE  87           HZ       PHE  87  -1.707  11.999   1.811
 1391    H    PHE  88           HN       PHE  88   1.403  15.352  -2.565
 1392    HA   PHE  88           HA       PHE  88   0.163  13.212  -4.241
 1393   1HB   PHE  88           HB2      PHE  88  -1.047  14.818  -2.149
 1394   2HB   PHE  88           HB1      PHE  88  -1.841  15.106  -3.697
 1395    HD1  PHE  88           HD1      PHE  88  -0.503  12.260  -1.649
 1396    HD2  PHE  88           HD2      PHE  88  -3.525  13.645  -4.364
 1397    HE1  PHE  88           HE1      PHE  88  -1.673  10.080  -1.452
 1398    HE2  PHE  88           HE2      PHE  88  -4.695  11.470  -4.169
 1399    HZ   PHE  88           HZ       PHE  88  -3.770   9.687  -2.710
 1400    H    GLU  89           HN       GLU  89   1.730  16.175  -4.164
 1401    HA   GLU  89           HA       GLU  89   1.856  17.985  -5.672
 1402   1HB   GLU  89           HB2      GLU  89   2.836  15.893  -6.841
 1403   2HB   GLU  89           HB1      GLU  89   1.340  15.887  -7.776
 1404   1HG   GLU  89           HG2      GLU  89   1.763  18.153  -8.561
 1405   2HG   GLU  89           HG1      GLU  89   3.191  18.276  -7.535
 1406    H    HIS  90           HN       HIS  90  -0.629  18.096  -4.644
 1407    HA   HIS  90           HA       HIS  90  -2.700  17.857  -6.677
 1408   1HB   HIS  90           HB2      HIS  90  -4.121  19.023  -5.013
 1409   2HB   HIS  90           HB1      HIS  90  -3.256  17.663  -4.291
 1410    HD1  HIS  90           HD1      HIS  90  -3.123  21.445  -4.528
 1411    HD2  HIS  90           HD2      HIS  90  -1.478  18.365  -2.248
 1412    HE1  HIS  90           HE1      HIS  90  -1.881  22.553  -2.620
 1413    H    GLU  91           HN       GLU  91  -0.526  20.378  -5.573
 1414    HA   GLU  91           HA       GLU  91  -1.761  22.711  -6.453
 1415   1HB   GLU  91           HB2      GLU  91   0.796  22.044  -5.670
 1416   2HB   GLU  91           HB1      GLU  91   1.033  22.517  -7.353
 1417   1HG   GLU  91           HG2      GLU  91  -0.512  24.547  -6.700
 1418   2HG   GLU  91           HG1      GLU  91  -0.007  24.150  -5.057
   
  No H/Q in entry =        1418
  Start of MODEL   12
    1   1H    MET   0           HT3      MET   0   8.653   5.328 -14.140
    2   2H    MET   0           HT2      MET   0   7.732   6.461 -15.007
    3   3H    MET   0           HT1      MET   0   7.003   5.517 -13.799
    4    HA   MET   0           HA       MET   0   6.327   4.479 -15.742
    5   1HB   MET   0           HB2      MET   0   7.949   3.996 -17.577
    6   2HB   MET   0           HB1      MET   0   7.762   5.724 -17.273
    7   1HG   MET   0           HG2      MET   0   9.793   5.632 -15.811
    8   2HG   MET   0           HG1      MET   0  10.011   3.948 -16.288
    9   1HE   MET   0           HE1      MET   0  11.756   6.413 -16.325
   10   2HE   MET   0           HE3      MET   0  12.433   6.808 -17.911
   11   3HE   MET   0           HE2      MET   0  11.000   7.651 -17.325
   12    H    SER   1           HN       SER   1   7.971   3.775 -13.180
   13    HA   SER   1           HA       SER   1   8.970   1.101 -13.984
   14   1HB   SER   1           HB2      SER   1   9.670   0.992 -11.551
   15   2HB   SER   1           HB1      SER   1  10.425   2.285 -12.478
   16    HG   SER   1           HG       SER   1   9.390   2.750 -10.316
   17    H    GLU   2           HN       GLU   2   8.406  -0.484 -11.868
   18    HA   GLU   2           HA       GLU   2   5.539  -0.957 -12.194
   19   1HB   GLU   2           HB2      GLU   2   7.360  -2.410 -10.276
   20   2HB   GLU   2           HB1      GLU   2   5.922  -3.021 -11.093
   21   1HG   GLU   2           HG2      GLU   2   8.556  -2.291 -12.405
   22   2HG   GLU   2           HG1      GLU   2   7.917  -3.920 -12.181
   23    H    LEU   3           HN       LEU   3   7.701  -0.014  -9.532
   24    HA   LEU   3           HA       LEU   3   5.498   0.184  -7.622
   25   1HB   LEU   3           HB2      LEU   3   8.030  -0.283  -7.178
   26   2HB   LEU   3           HB1      LEU   3   8.185   1.470  -7.243
   27    HG   LEU   3           HG       LEU   3   6.144   1.439  -5.596
   28   1HD1  LEU   3          HD11      LEU   3   7.091  -1.384  -5.660
   29   2HD1  LEU   3          HD13      LEU   3   6.711  -0.706  -4.076
   30   3HD1  LEU   3          HD12      LEU   3   5.480  -0.745  -5.338
   31   1HD2  LEU   3          HD22      LEU   3   8.546   2.157  -5.163
   32   2HD2  LEU   3          HD21      LEU   3   7.680   1.554  -3.751
   33   3HD2  LEU   3          HD23      LEU   3   8.845   0.521  -4.579
   34    H    GLU   4           HN       GLU   4   7.605   2.527  -9.301
   35    HA   GLU   4           HA       GLU   4   6.336   4.844  -8.215
   36   1HB   GLU   4           HB2      GLU   4   8.536   4.890  -9.363
   37   2HB   GLU   4           HB1      GLU   4   7.728   4.553 -10.894
   38   1HG   GLU   4           HG2      GLU   4   6.262   6.667 -10.077
   39   2HG   GLU   4           HG1      GLU   4   7.795   7.062  -9.301
   40    H    LYS   5           HN       LYS   5   5.630   2.936 -11.137
   41    HA   LYS   5           HA       LYS   5   3.518   4.788 -11.961
   42   1HB   LYS   5           HB2      LYS   5   4.978   3.119 -13.408
   43   2HB   LYS   5           HB1      LYS   5   3.705   1.974 -12.987
   44   1HG   LYS   5           HG2      LYS   5   2.916   2.931 -14.984
   45   2HG   LYS   5           HG1      LYS   5   2.075   3.858 -13.740
   46   1HD   LYS   5           HD2      LYS   5   3.482   5.728 -14.006
   47   2HD   LYS   5           HD1      LYS   5   4.734   4.782 -14.813
   48   1HE   LYS   5           HE2      LYS   5   3.283   4.483 -16.767
   49   2HE   LYS   5           HE1      LYS   5   1.990   5.369 -15.960
   50   1HZ   LYS   5           HZ1      LYS   5   3.569   7.272 -15.801
   51   2HZ   LYS   5           HZ3      LYS   5   4.632   6.414 -16.806
   52   3HZ   LYS   5           HZ2      LYS   5   3.103   6.876 -17.385
   53    H    ALA   6           HN       ALA   6   3.696   1.650 -10.318
   54    HA   ALA   6           HA       ALA   6   0.788   1.382 -10.187
   55   1HB   ALA   6           HB2      ALA   6   2.594  -0.496 -10.167
   56   2HB   ALA   6           HB1      ALA   6   2.734  -0.122  -8.449
   57   3HB   ALA   6           HB3      ALA   6   1.194  -0.668  -9.109
   58    H    MET   7           HN       MET   7   3.223   1.558  -7.589
   59    HA   MET   7           HA       MET   7   1.572   2.144  -5.446
   60   1HB   MET   7           HB2      MET   7   4.049   1.802  -5.334
   61   2HB   MET   7           HB1      MET   7   4.269   3.438  -5.961
   62   1HG   MET   7           HG2      MET   7   4.411   3.362  -3.480
   63   2HG   MET   7           HG1      MET   7   3.072   4.364  -4.036
   64   1HE   MET   7           HE3      MET   7   2.990   4.037  -1.529
   65   2HE   MET   7           HE2      MET   7   1.738   3.017  -0.827
   66   3HE   MET   7           HE1      MET   7   3.393   2.425  -0.927
   67    H    VAL   8           HN       VAL   8   3.127   4.562  -7.563
   68    HA   VAL   8           HA       VAL   8   1.830   6.812  -6.368
   69    HB   VAL   8           HB       VAL   8   2.763   6.570  -9.242
   70   1HG1  VAL   8          HG11      VAL   8   1.918   8.778  -7.434
   71   2HG1  VAL   8          HG13      VAL   8   3.326   9.088  -8.449
   72   3HG1  VAL   8          HG12      VAL   8   1.786   8.647  -9.187
   73   1HG2  VAL   8          HG22      VAL   8   4.464   5.863  -7.497
   74   2HG2  VAL   8          HG21      VAL   8   4.941   7.263  -8.456
   75   3HG2  VAL   8          HG23      VAL   8   4.337   7.485  -6.815
   76    H    ALA   9           HN       ALA   9   0.814   4.573  -8.903
   77    HA   ALA   9           HA       ALA   9  -1.397   6.062  -9.908
   78   1HB   ALA   9           HB3      ALA   9  -0.624   3.189  -9.811
   79   2HB   ALA   9           HB2      ALA   9  -2.334   3.531 -10.070
   80   3HB   ALA   9           HB1      ALA   9  -1.128   4.169 -11.186
   81    H    LEU  10           HN       LEU  10  -1.140   3.826  -7.146
   82    HA   LEU  10           HA       LEU  10  -3.824   3.796  -6.326
   83   1HB   LEU  10           HB2      LEU  10  -1.320   3.094  -5.193
   84   2HB   LEU  10           HB1      LEU  10  -2.127   4.135  -4.019
   85    HG   LEU  10           HG       LEU  10  -3.658   1.924  -5.364
   86   1HD1  LEU  10          HD11      LEU  10  -1.733   1.689  -3.043
   87   2HD1  LEU  10          HD13      LEU  10  -3.050   0.544  -3.299
   88   3HD1  LEU  10          HD12      LEU  10  -1.783   0.715  -4.513
   89   1HD2  LEU  10          HD21      LEU  10  -3.813   3.423  -2.735
   90   2HD2  LEU  10          HD23      LEU  10  -4.964   3.475  -4.069
   91   3HD2  LEU  10          HD22      LEU  10  -4.806   2.012  -3.098
   92    H    ILE  11           HN       ILE  11  -1.297   6.206  -5.610
   93    HA   ILE  11           HA       ILE  11  -2.798   7.940  -3.971
   94    HB   ILE  11           HB       ILE  11  -0.406   8.131  -5.680
   95   1HG1  ILE  11          HG12      ILE  11  -0.278   9.873  -3.475
   96   2HG1  ILE  11          HG11      ILE  11  -1.248   8.502  -2.937
   97   1HG2  ILE  11          HG21      ILE  11  -2.260  10.468  -5.423
   98   2HG2  ILE  11          HG23      ILE  11  -0.527  10.755  -5.290
   99   3HG2  ILE  11          HG22      ILE  11  -1.191  10.028  -6.752
  100   1HD1  ILE  11          HD11      ILE  11   0.638   7.092  -4.132
  101   2HD1  ILE  11          HD13      ILE  11   1.595   8.553  -3.888
  102   3HD1  ILE  11          HD12      ILE  11   0.897   7.716  -2.503
  103    H    ASP  12           HN       ASP  12  -2.646   7.713  -7.508
  104    HA   ASP  12           HA       ASP  12  -4.267   9.903  -8.204
  105   1HB   ASP  12           HB2      ASP  12  -3.060   8.191  -9.720
  106   2HB   ASP  12           HB1      ASP  12  -4.512   7.212  -9.554
  107    H    VAL  13           HN       VAL  13  -5.286   6.563  -7.461
  108    HA   VAL  13           HA       VAL  13  -8.046   6.822  -7.754
  109    HB   VAL  13           HB       VAL  13  -6.552   5.339  -5.570
  110   1HG1  VAL  13          HG11      VAL  13  -9.160   5.873  -5.416
  111   2HG1  VAL  13          HG13      VAL  13  -9.253   4.538  -6.565
  112   3HG1  VAL  13          HG12      VAL  13  -8.525   4.286  -4.980
  113   1HG2  VAL  13          HG23      VAL  13  -6.756   4.943  -8.386
  114   2HG2  VAL  13          HG22      VAL  13  -6.015   3.875  -7.196
  115   3HG2  VAL  13          HG21      VAL  13  -7.720   3.690  -7.606
  116    H    PHE  14           HN       PHE  14  -6.027   7.999  -5.091
  117    HA   PHE  14           HA       PHE  14  -8.114   8.687  -3.284
  118   1HB   PHE  14           HB2      PHE  14  -5.387   8.898  -3.225
  119   2HB   PHE  14           HB1      PHE  14  -5.856  10.587  -3.421
  120    HD1  PHE  14           HD2      PHE  14  -6.948   7.564  -1.477
  121    HD2  PHE  14           HD1      PHE  14  -6.277  11.807  -1.489
  122    HE1  PHE  14           HE2      PHE  14  -7.582   7.673   0.919
  123    HE2  PHE  14           HE1      PHE  14  -6.910  11.917   0.905
  124    HZ   PHE  14           HZ       PHE  14  -7.563   9.849   2.110
  125    H    HIS  15           HN       HIS  15  -6.621  10.585  -5.910
  126    HA   HIS  15           HA       HIS  15  -8.176  12.953  -5.458
  127   1HB   HIS  15           HB2      HIS  15  -6.225  13.171  -6.810
  128   2HB   HIS  15           HB1      HIS  15  -6.734  11.868  -7.885
  129    HD1  HIS  15           HD1      HIS  15  -8.265  12.470  -9.816
  130    HD2  HIS  15           HD2      HIS  15  -7.788  15.620  -7.126
  131    HE1  HIS  15           HE1      HIS  15  -9.343  14.495 -10.885
  132    H    GLN  16           HN       GLN  16  -9.038   9.894  -6.729
  133    HA   GLN  16           HA       GLN  16 -11.277  10.960  -8.329
  134   1HB   GLN  16           HB2      GLN  16  -9.846   8.869  -8.890
  135   2HB   GLN  16           HB1      GLN  16 -10.825   8.052  -7.672
  136   1HG   GLN  16           HG2      GLN  16 -11.914   7.688  -9.779
  137   2HG   GLN  16           HG1      GLN  16 -12.873   8.896  -8.920
  138   1HE2  GLN  16          HE22      GLN  16 -12.459  10.326 -12.278
  139   2HE2  GLN  16          HE21      GLN  16 -13.340   9.081 -11.532
  140    H    TYR  17           HN       TYR  17 -11.044   8.566  -5.673
  141    HA   TYR  17           HA       TYR  17 -13.838   8.783  -5.019
  142   1HB   TYR  17           HB2      TYR  17 -11.456   7.652  -3.540
  143   2HB   TYR  17           HB1      TYR  17 -13.095   7.586  -2.892
  144    HD1  TYR  17           HD2      TYR  17 -11.076   6.707  -5.915
  145    HD2  TYR  17           HD1      TYR  17 -14.575   5.881  -3.565
  146    HE1  TYR  17           HE2      TYR  17 -11.549   4.719  -7.320
  147    HE2  TYR  17           HE1      TYR  17 -15.048   3.893  -4.970
  148    HH   TYR  17           HH       TYR  17 -13.971   3.374  -7.843
  149    H    SER  18           HN       SER  18 -10.958   9.895  -3.184
  150    HA   SER  18           HA       SER  18 -12.495  11.424  -1.307
  151   1HB   SER  18           HB2      SER  18 -10.024  10.640  -1.167
  152   2HB   SER  18           HB1      SER  18  -9.661  12.100  -2.081
  153    HG   SER  18           HG       SER  18 -10.025  13.238  -0.352
  154    H    GLY  19           HN       GLY  19 -11.022  12.243  -4.422
  155   1HA   GLY  19           HA2      GLY  19 -11.480  15.084  -4.213
  156   2HA   GLY  19           HA1      GLY  19 -11.169  14.204  -5.709
  157    H    ARG  20           HN       ARG  20 -13.661  12.551  -4.449
  158    HA   ARG  20           HA       ARG  20 -15.588  13.315  -6.313
  159   1HB   ARG  20           HB2      ARG  20 -15.612  11.879  -3.741
  160   2HB   ARG  20           HB1      ARG  20 -17.156  12.606  -4.180
  161   1HG   ARG  20           HG2      ARG  20 -17.268  11.398  -6.222
  162   2HG   ARG  20           HG1      ARG  20 -15.564  10.951  -6.143
  163   1HD   ARG  20           HD2      ARG  20 -15.930   9.392  -4.409
  164   2HD   ARG  20           HD1      ARG  20 -17.497  10.085  -3.999
  165    HE   ARG  20           HE       ARG  20 -16.955   8.372  -6.376
  166   1HH1  ARG  20          HH11      ARG  20 -18.852   8.526  -3.705
  167   2HH1  ARG  20          HH12      ARG  20 -20.376   8.429  -4.520
  168   1HH2  ARG  20          HH21      ARG  20 -19.019   8.903  -7.674
  169   2HH2  ARG  20          HH22      ARG  20 -20.471   8.641  -6.769
  170    H    GLU  21           HN       GLU  21 -15.011  14.690  -3.096
  171    HA   GLU  21           HA       GLU  21 -16.679  17.025  -3.913
  172   1HB   GLU  21           HB2      GLU  21 -17.403  15.134  -1.939
  173   2HB   GLU  21           HB1      GLU  21 -16.879  16.576  -1.070
  174   1HG   GLU  21           HG2      GLU  21 -18.359  17.891  -2.722
  175   2HG   GLU  21           HG1      GLU  21 -19.074  16.329  -3.126
  176    H    GLY  22           HN       GLY  22 -16.352  18.428  -1.466
  177   1HA   GLY  22           HA2      GLY  22 -13.880  19.729  -1.850
  178   2HA   GLY  22           HA1      GLY  22 -14.814  19.810  -0.358
  179    H    ASP  23           HN       ASP  23 -14.686  16.948   0.161
  180    HA   ASP  23           HA       ASP  23 -12.474  16.750   1.824
  181   1HB   ASP  23           HB2      ASP  23 -13.625  14.430   0.251
  182   2HB   ASP  23           HB1      ASP  23 -12.831  14.366   1.821
  183    H    LYS  24           HN       LYS  24 -10.567  17.562   0.869
  184    HA   LYS  24           HA       LYS  24  -9.527  16.050  -1.484
  185   1HB   LYS  24           HB2      LYS  24  -8.674  18.721  -0.321
  186   2HB   LYS  24           HB1      LYS  24  -7.958  17.955  -1.741
  187   1HG   LYS  24           HG2      LYS  24 -10.601  17.868  -2.400
  188   2HG   LYS  24           HG1      LYS  24 -10.545  19.360  -1.461
  189   1HD   LYS  24           HD2      LYS  24  -8.573  20.068  -2.869
  190   2HD   LYS  24           HD1      LYS  24  -8.882  18.667  -3.895
  191   1HE   LYS  24           HE2      LYS  24 -10.749  20.993  -3.363
  192   2HE   LYS  24           HE1      LYS  24  -9.997  20.560  -4.896
  193   1HZ   LYS  24           HZ3      LYS  24 -11.201  18.333  -4.548
  194   2HZ   LYS  24           HZ2      LYS  24 -12.169  19.195  -3.450
  195   3HZ   LYS  24           HZ1      LYS  24 -12.102  19.669  -5.079
  196    H    HIS  25           HN       HIS  25  -9.464  15.593   1.647
  197    HA   HIS  25           HA       HIS  25  -6.808  14.371   1.612
  198   1HB   HIS  25           HB2      HIS  25  -7.291  16.958   2.933
  199   2HB   HIS  25           HB1      HIS  25  -6.577  15.741   3.990
  200    HD1  HIS  25           HD1      HIS  25  -4.687  17.923   3.388
  201    HD2  HIS  25           HD2      HIS  25  -5.161  14.719   0.762
  202    HE1  HIS  25           HE1      HIS  25  -2.586  17.836   1.977
  203    H    LYS  26           HN       LYS  26  -9.758  13.773   2.077
  204    HA   LYS  26           HA       LYS  26  -9.312  12.077   4.454
  205   1HB   LYS  26           HB2      LYS  26 -11.962  13.087   4.738
  206   2HB   LYS  26           HB1      LYS  26 -10.614  13.265   5.855
  207   1HG   LYS  26           HG2      LYS  26 -10.723  15.081   3.474
  208   2HG   LYS  26           HG1      LYS  26 -11.816  15.393   4.818
  209   1HD   LYS  26           HD2      LYS  26  -9.065  14.800   5.661
  210   2HD   LYS  26           HD1      LYS  26  -9.209  16.265   4.689
  211   1HE   LYS  26           HE2      LYS  26 -11.311  16.663   6.296
  212   2HE   LYS  26           HE1      LYS  26 -10.351  15.655   7.376
  213   1HZ   LYS  26           HZ2      LYS  26  -8.974  17.814   5.978
  214   2HZ   LYS  26           HZ1      LYS  26 -10.029  18.256   7.234
  215   3HZ   LYS  26           HZ3      LYS  26  -8.732  17.209   7.545
  216    H    LEU  27           HN       LEU  27 -11.049  10.421   4.648
  217    HA   LEU  27           HA       LEU  27 -12.592  10.020   2.132
  218   1HB   LEU  27           HB2      LEU  27 -10.290   8.642   2.532
  219   2HB   LEU  27           HB1      LEU  27 -11.424   7.588   3.378
  220    HG   LEU  27           HG       LEU  27 -12.871   8.031   1.168
  221   1HD1  LEU  27          HD11      LEU  27 -10.556   9.346   0.494
  222   2HD1  LEU  27          HD13      LEU  27 -10.285   7.754  -0.214
  223   3HD1  LEU  27          HD12      LEU  27 -11.708   8.690  -0.667
  224   1HD2  LEU  27          HD23      LEU  27 -12.158   5.833   2.068
  225   2HD2  LEU  27          HD22      LEU  27 -11.994   5.893   0.313
  226   3HD2  LEU  27          HD21      LEU  27 -10.568   6.060   1.337
  227    H    LYS  28           HN       LYS  28 -13.489   7.397   3.037
  228    HA   LYS  28           HA       LYS  28 -14.775   7.918   5.642
  229   1HB   LYS  28           HB2      LYS  28 -16.115   8.323   3.108
  230   2HB   LYS  28           HB1      LYS  28 -16.894   7.028   4.017
  231   1HG   LYS  28           HG2      LYS  28 -16.907   8.558   6.024
  232   2HG   LYS  28           HG1      LYS  28 -16.349   9.854   4.966
  233   1HD   LYS  28           HD2      LYS  28 -18.807   8.251   4.280
  234   2HD   LYS  28           HD1      LYS  28 -18.902   9.635   5.370
  235   1HE   LYS  28           HE2      LYS  28 -17.345  10.505   3.192
  236   2HE   LYS  28           HE1      LYS  28 -18.687   9.607   2.483
  237   1HZ   LYS  28           HZ1      LYS  28 -18.939  11.784   4.489
  238   2HZ   LYS  28           HZ3      LYS  28 -19.242  11.939   2.829
  239   3HZ   LYS  28           HZ2      LYS  28 -20.226  10.930   3.779
  240    H    LYS  29           HN       LYS  29 -15.528   5.966   6.618
  241    HA   LYS  29           HA       LYS  29 -14.114   3.602   5.926
  242   1HB   LYS  29           HB2      LYS  29 -15.558   2.457   7.528
  243   2HB   LYS  29           HB1      LYS  29 -15.114   4.041   8.166
  244   1HG   LYS  29           HG2      LYS  29 -17.607   3.842   6.533
  245   2HG   LYS  29           HG1      LYS  29 -17.644   3.217   8.178
  246   1HD   LYS  29           HD2      LYS  29 -17.869   5.311   8.942
  247   2HD   LYS  29           HD1      LYS  29 -16.290   5.706   8.279
  248   1HE   LYS  29           HE2      LYS  29 -18.110   7.198   7.421
  249   2HE   LYS  29           HE1      LYS  29 -17.288   6.308   6.140
  250   1HZ   LYS  29           HZ1      LYS  29 -19.406   4.750   7.119
  251   2HZ   LYS  29           HZ3      LYS  29 -20.002   6.297   6.765
  252   3HZ   LYS  29           HZ2      LYS  29 -19.201   5.399   5.563
  253    H    SER  30           HN       SER  30 -17.190   4.844   4.807
  254    HA   SER  30           HA       SER  30 -18.063   2.311   3.654
  255   1HB   SER  30           HB2      SER  30 -19.679   4.072   4.296
  256   2HB   SER  30           HB1      SER  30 -18.988   5.146   3.084
  257    HG   SER  30           HG       SER  30 -20.825   4.046   2.295
  258    H    GLU  31           HN       GLU  31 -16.407   5.210   2.422
  259    HA   GLU  31           HA       GLU  31 -16.404   4.190  -0.318
  260   1HB   GLU  31           HB2      GLU  31 -16.336   6.642   0.230
  261   2HB   GLU  31           HB1      GLU  31 -14.721   6.408   0.896
  262   1HG   GLU  31           HG2      GLU  31 -13.762   6.080  -1.171
  263   2HG   GLU  31           HG1      GLU  31 -15.225   5.372  -1.855
  264    H    LEU  32           HN       LEU  32 -14.532   3.739   2.513
  265    HA   LEU  32           HA       LEU  32 -12.090   2.920   1.111
  266   1HB   LEU  32           HB2      LEU  32 -11.872   3.841   3.362
  267   2HB   LEU  32           HB1      LEU  32 -12.981   2.627   4.000
  268    HG   LEU  32           HG       LEU  32 -11.409   0.841   3.360
  269   1HD1  LEU  32          HD12      LEU  32 -10.246   3.010   1.838
  270   2HD1  LEU  32          HD11      LEU  32  -9.031   2.274   2.882
  271   3HD1  LEU  32          HD13      LEU  32  -9.921   1.281   1.728
  272   1HD2  LEU  32          HD22      LEU  32 -10.737   3.038   5.222
  273   2HD2  LEU  32          HD21      LEU  32 -10.830   1.301   5.516
  274   3HD2  LEU  32          HD23      LEU  32  -9.381   1.996   4.791
  275    H    LYS  33           HN       LYS  33 -14.757   1.376   2.877
  276    HA   LYS  33           HA       LYS  33 -14.001  -1.329   2.556
  277   1HB   LYS  33           HB2      LYS  33 -16.041  -0.203   3.791
  278   2HB   LYS  33           HB1      LYS  33 -16.871  -0.482   2.264
  279   1HG   LYS  33           HG2      LYS  33 -15.339  -2.815   3.134
  280   2HG   LYS  33           HG1      LYS  33 -16.570  -2.341   4.306
  281   1HD   LYS  33           HD2      LYS  33 -17.540  -2.223   1.548
  282   2HD   LYS  33           HD1      LYS  33 -17.021  -3.843   2.017
  283   1HE   LYS  33           HE2      LYS  33 -18.459  -3.763   3.995
  284   2HE   LYS  33           HE1      LYS  33 -18.930  -2.107   3.612
  285   1HZ   LYS  33           HZ1      LYS  33 -19.753  -3.001   1.442
  286   2HZ   LYS  33           HZ3      LYS  33 -19.519  -4.563   2.061
  287   3HZ   LYS  33           HZ2      LYS  33 -20.626  -3.513   2.806
  288    H    GLU  34           HN       GLU  34 -15.809   0.835   0.402
  289    HA   GLU  34           HA       GLU  34 -16.191  -1.162  -1.660
  290   1HB   GLU  34           HB2      GLU  34 -17.196   0.565  -2.896
  291   2HB   GLU  34           HB1      GLU  34 -17.446   1.109  -1.240
  292   1HG   GLU  34           HG2      GLU  34 -15.644   2.665  -1.367
  293   2HG   GLU  34           HG1      GLU  34 -15.069   1.982  -2.884
  294    H    LEU  35           HN       LEU  35 -13.883   1.417  -1.046
  295    HA   LEU  35           HA       LEU  35 -12.339   1.431  -3.360
  296   1HB   LEU  35           HB2      LEU  35 -12.068   2.470  -0.827
  297   2HB   LEU  35           HB1      LEU  35 -10.740   1.308  -0.884
  298    HG   LEU  35           HG       LEU  35 -10.087   3.580  -1.703
  299   1HD1  LEU  35          HD13      LEU  35  -9.419   1.117  -2.709
  300   2HD1  LEU  35          HD12      LEU  35  -9.927   1.967  -4.168
  301   3HD1  LEU  35          HD11      LEU  35  -8.634   2.627  -3.168
  302   1HD2  LEU  35          HD21      LEU  35 -12.552   3.305  -3.118
  303   2HD2  LEU  35          HD23      LEU  35 -11.456   4.686  -3.107
  304   3HD2  LEU  35          HD22      LEU  35 -11.258   3.412  -4.311
  305    H    ILE  36           HN       ILE  36 -12.194  -0.907  -0.675
  306    HA   ILE  36           HA       ILE  36 -10.084  -2.463  -1.966
  307    HB   ILE  36           HB       ILE  36 -11.783  -3.672   0.161
  308   1HG1  ILE  36          HG12      ILE  36 -10.123  -1.169   0.505
  309   2HG1  ILE  36          HG11      ILE  36 -11.763  -1.478   1.065
  310   1HG2  ILE  36          HG23      ILE  36  -9.574  -4.541  -0.913
  311   2HG2  ILE  36          HG22      ILE  36  -8.791  -3.341   0.116
  312   3HG2  ILE  36          HG21      ILE  36  -9.750  -4.632   0.839
  313   1HD1  ILE  36          HD13      ILE  36 -10.408  -3.490   2.317
  314   2HD1  ILE  36          HD12      ILE  36  -9.186  -2.218   2.302
  315   3HD1  ILE  36          HD11      ILE  36 -10.754  -1.926   3.054
  316    H    ASN  37           HN       ASN  37 -13.454  -3.283  -1.066
  317    HA   ASN  37           HA       ASN  37 -13.533  -5.602  -2.758
  318   1HB   ASN  37           HB2      ASN  37 -15.043  -5.186  -0.796
  319   2HB   ASN  37           HB1      ASN  37 -15.874  -3.961  -1.754
  320   1HD2  ASN  37          HD22      ASN  37 -17.100  -7.690  -2.155
  321   2HD2  ASN  37          HD21      ASN  37 -16.305  -7.050  -0.798
  322    H    ASN  38           HN       ASN  38 -15.362  -2.547  -3.137
  323    HA   ASN  38           HA       ASN  38 -16.357  -2.876  -5.675
  324   1HB   ASN  38           HB2      ASN  38 -16.539  -0.817  -4.173
  325   2HB   ASN  38           HB1      ASN  38 -15.007  -0.295  -4.872
  326   1HD2  ASN  38          HD22      ASN  38 -16.442   0.712  -7.928
  327   2HD2  ASN  38          HD21      ASN  38 -15.030   0.558  -7.003
  328    H    GLU  39           HN       GLU  39 -13.066  -1.600  -5.010
  329    HA   GLU  39           HA       GLU  39 -12.408  -1.715  -7.855
  330   1HB   GLU  39           HB2      GLU  39 -10.597  -1.227  -5.476
  331   2HB   GLU  39           HB1      GLU  39 -10.205  -0.914  -7.166
  332   1HG   GLU  39           HG2      GLU  39 -12.706   0.315  -6.120
  333   2HG   GLU  39           HG1      GLU  39 -11.185   0.994  -5.543
  334    H    LEU  40           HN       LEU  40 -10.285  -3.035  -5.325
  335    HA   LEU  40           HA       LEU  40  -9.140  -5.036  -6.853
  336   1HB   LEU  40           HB2      LEU  40  -9.825  -5.154  -3.902
  337   2HB   LEU  40           HB1      LEU  40  -8.659  -6.190  -4.717
  338    HG   LEU  40           HG       LEU  40  -8.516  -3.201  -4.314
  339   1HD1  LEU  40          HD11      LEU  40  -7.095  -5.610  -3.303
  340   2HD1  LEU  40          HD13      LEU  40  -6.098  -4.198  -3.650
  341   3HD1  LEU  40          HD12      LEU  40  -7.427  -4.076  -2.497
  342   1HD2  LEU  40          HD21      LEU  40  -7.062  -4.987  -6.264
  343   2HD2  LEU  40          HD23      LEU  40  -7.813  -3.418  -6.558
  344   3HD2  LEU  40          HD22      LEU  40  -6.308  -3.517  -5.646
  345    H    SER  41           HN       SER  41 -11.241  -6.274  -4.305
  346    HA   SER  41           HA       SER  41 -12.656  -8.162  -4.388
  347   1HB   SER  41           HB2      SER  41 -13.597  -6.146  -6.330
  348   2HB   SER  41           HB1      SER  41 -14.238  -7.766  -6.577
  349    HG   SER  41           HG       SER  41 -14.172  -6.899  -3.954
  350    H    HIS  42           HN       HIS  42 -10.356  -9.107  -5.267
  351    HA   HIS  42           HA       HIS  42 -11.116 -10.740  -7.634
  352   1HB   HIS  42           HB2      HIS  42  -9.381  -8.648  -7.927
  353   2HB   HIS  42           HB1      HIS  42  -8.268  -9.959  -7.539
  354    HD1  HIS  42           HD1      HIS  42  -7.610  -9.503 -10.187
  355    HD2  HIS  42           HD2      HIS  42 -11.254 -11.377  -9.432
  356    HE1  HIS  42           HE1      HIS  42  -8.311 -10.606 -12.356
  357    H    PHE  43           HN       PHE  43  -8.236 -10.339  -5.538
  358    HA   PHE  43           HA       PHE  43  -7.700 -13.143  -5.395
  359   1HB   PHE  43           HB2      PHE  43  -6.958 -11.043  -3.337
  360   2HB   PHE  43           HB1      PHE  43  -6.147 -12.583  -3.621
  361    HD1  PHE  43           HD2      PHE  43  -5.193 -12.993  -6.003
  362    HD2  PHE  43           HD1      PHE  43  -6.257  -9.119  -4.483
  363    HE1  PHE  43           HE2      PHE  43  -3.759 -11.925  -7.721
  364    HE2  PHE  43           HE1      PHE  43  -4.823  -8.050  -6.199
  365    HZ   PHE  43           HZ       PHE  43  -3.574  -9.453  -7.819
  366    H    LEU  44           HN       LEU  44 -10.136 -11.266  -3.936
  367    HA   LEU  44           HA       LEU  44 -10.441 -12.601  -1.431
  368   1HB   LEU  44           HB2      LEU  44 -11.919 -10.702  -3.014
  369   2HB   LEU  44           HB1      LEU  44 -13.018 -11.932  -2.389
  370    HG   LEU  44           HG       LEU  44 -12.726 -10.019  -0.811
  371   1HD1  LEU  44          HD11      LEU  44 -11.636 -12.709   0.066
  372   2HD1  LEU  44          HD13      LEU  44 -12.147 -11.436   1.176
  373   3HD1  LEU  44          HD12      LEU  44 -13.321 -12.193   0.099
  374   1HD2  LEU  44          HD21      LEU  44 -10.315  -9.624  -1.480
  375   2HD2  LEU  44          HD23      LEU  44 -10.596  -9.644   0.261
  376   3HD2  LEU  44          HD22      LEU  44  -9.889 -11.050  -0.535
  377    H    GLU  45           HN       GLU  45 -10.110 -14.857  -1.856
  378    HA   GLU  45           HA       GLU  45 -12.510 -16.179  -3.031
  379   1HB   GLU  45           HB2      GLU  45  -9.640 -17.061  -3.455
  380   2HB   GLU  45           HB1      GLU  45 -11.077 -17.871  -4.078
  381   1HG   GLU  45           HG2      GLU  45 -11.380 -15.225  -4.908
  382   2HG   GLU  45           HG1      GLU  45  -9.662 -15.555  -5.138
  383    H    GLU  46           HN       GLU  46  -9.487 -16.926  -1.297
  384    HA   GLU  46           HA       GLU  46 -11.112 -18.610   0.566
  385   1HB   GLU  46           HB2      GLU  46  -8.250 -18.893  -0.383
  386   2HB   GLU  46           HB1      GLU  46  -8.890 -19.781   0.999
  387   1HG   GLU  46           HG2      GLU  46 -10.530 -20.888  -0.364
  388   2HG   GLU  46           HG1      GLU  46 -10.178 -19.841  -1.739
  389    H    ILE  47           HN       ILE  47  -8.489 -16.261   0.267
  390    HA   ILE  47           HA       ILE  47  -7.561 -14.799   1.831
  391    HB   ILE  47           HB       ILE  47 -10.329 -14.802   2.211
  392   1HG1  ILE  47          HG12      ILE  47  -9.021 -12.813   3.846
  393   2HG1  ILE  47          HG11      ILE  47  -8.134 -13.044   2.338
  394   1HG2  ILE  47          HG23      ILE  47 -10.064 -16.132   4.279
  395   2HG2  ILE  47          HG22      ILE  47  -8.942 -14.924   4.905
  396   3HG2  ILE  47          HG21      ILE  47 -10.632 -14.499   4.633
  397   1HD1  ILE  47          HD13      ILE  47 -11.113 -12.870   2.190
  398   2HD1  ILE  47          HD12      ILE  47 -10.214 -11.379   2.475
  399   3HD1  ILE  47          HD11      ILE  47  -9.899 -12.336   1.028
  400    H    LYS  48           HN       LYS  48  -5.878 -15.356   3.110
  401    HA   LYS  48           HA       LYS  48  -6.193 -17.733   4.881
  402   1HB   LYS  48           HB2      LYS  48  -4.290 -17.438   3.087
  403   2HB   LYS  48           HB1      LYS  48  -3.554 -16.413   4.320
  404   1HG   LYS  48           HG2      LYS  48  -4.611 -19.035   5.241
  405   2HG   LYS  48           HG1      LYS  48  -3.167 -19.084   4.230
  406   1HD   LYS  48           HD2      LYS  48  -3.361 -17.198   6.576
  407   2HD   LYS  48           HD1      LYS  48  -2.828 -18.867   6.786
  408   1HE   LYS  48           HE2      LYS  48  -1.587 -16.987   4.767
  409   2HE   LYS  48           HE1      LYS  48  -0.967 -17.179   6.407
  410   1HZ   LYS  48           HZ3      LYS  48  -1.399 -19.714   5.264
  411   2HZ   LYS  48           HZ2      LYS  48  -0.461 -18.785   4.196
  412   3HZ   LYS  48           HZ1      LYS  48   0.056 -19.027   5.796
  413    H    GLU  49           HN       GLU  49  -5.740 -14.302   4.894
  414    HA   GLU  49           HA       GLU  49  -5.050 -14.362   7.793
  415   1HB   GLU  49           HB2      GLU  49  -4.591 -12.434   5.574
  416   2HB   GLU  49           HB1      GLU  49  -4.917 -11.743   7.163
  417   1HG   GLU  49           HG2      GLU  49  -2.859 -13.914   6.718
  418   2HG   GLU  49           HG1      GLU  49  -2.463 -12.196   6.654
  419    H    GLN  50           HN       GLN  50  -7.483 -15.118   7.826
  420    HA   GLN  50           HA       GLN  50  -9.628 -13.393   7.282
  421   1HB   GLN  50           HB2      GLN  50 -10.108 -15.622   8.015
  422   2HB   GLN  50           HB1      GLN  50  -9.223 -15.387   9.522
  423   1HG   GLN  50           HG2      GLN  50 -11.327 -13.390   9.133
  424   2HG   GLN  50           HG1      GLN  50 -11.954 -15.037   9.187
  425   1HE2  GLN  50          HE22      GLN  50 -11.133 -15.529  12.613
  426   2HE2  GLN  50          HE21      GLN  50 -11.583 -16.294  11.166
  427    H    GLU  51           HN       GLU  51  -7.161 -13.113   9.705
  428    HA   GLU  51           HA       GLU  51  -8.676 -11.268  11.393
  429   1HB   GLU  51           HB2      GLU  51  -6.167 -12.671  11.535
  430   2HB   GLU  51           HB1      GLU  51  -5.895 -10.957  11.850
  431   1HG   GLU  51           HG2      GLU  51  -8.244 -11.553  13.245
  432   2HG   GLU  51           HG1      GLU  51  -7.199 -12.947  13.524
  433    H    VAL  52           HN       VAL  52  -6.248 -11.007   8.822
  434    HA   VAL  52           HA       VAL  52  -5.866  -8.166   9.086
  435    HB   VAL  52           HB       VAL  52  -5.480 -10.011   6.708
  436   1HG1  VAL  52          HG11      VAL  52  -5.182  -7.093   7.058
  437   2HG1  VAL  52          HG13      VAL  52  -3.782  -7.900   6.351
  438   3HG1  VAL  52          HG12      VAL  52  -5.362  -8.037   5.580
  439   1HG2  VAL  52          HG21      VAL  52  -4.139 -10.123   9.021
  440   2HG2  VAL  52          HG23      VAL  52  -3.330 -10.357   7.472
  441   3HG2  VAL  52          HG22      VAL  52  -3.254  -8.791   8.280
  442    H    VAL  53           HN       VAL  53  -7.937 -10.117   6.922
  443    HA   VAL  53           HA       VAL  53  -9.164  -7.761   5.747
  444    HB   VAL  53           HB       VAL  53 -10.059 -10.663   5.763
  445   1HG1  VAL  53          HG12      VAL  53 -11.858  -8.963   5.283
  446   2HG1  VAL  53          HG11      VAL  53 -10.891  -8.407   3.919
  447   3HG1  VAL  53          HG13      VAL  53 -11.524 -10.053   3.936
  448   1HG2  VAL  53          HG21      VAL  53  -7.915  -9.312   4.436
  449   2HG2  VAL  53          HG23      VAL  53  -8.431 -10.986   4.240
  450   3HG2  VAL  53          HG22      VAL  53  -9.131  -9.723   3.229
  451    H    ASP  54           HN       ASP  54  -9.939  -9.948   8.399
  452    HA   ASP  54           HA       ASP  54 -12.578  -8.814   8.848
  453   1HB   ASP  54           HB2      ASP  54 -11.973 -11.109   9.594
  454   2HB   ASP  54           HB1      ASP  54 -10.816 -10.414  10.730
  455    H    LYS  55           HN       LYS  55  -9.354  -7.876   9.588
  456    HA   LYS  55           HA       LYS  55 -10.046  -6.289  11.945
  457   1HB   LYS  55           HB2      LYS  55  -7.617  -6.941  10.424
  458   2HB   LYS  55           HB1      LYS  55  -7.653  -5.277  11.008
  459   1HG   LYS  55           HG2      LYS  55  -7.755  -5.920  13.249
  460   2HG   LYS  55           HG1      LYS  55  -8.414  -7.511  12.865
  461   1HD   LYS  55           HD2      LYS  55  -6.209  -8.049  13.388
  462   2HD   LYS  55           HD1      LYS  55  -6.110  -7.850  11.637
  463   1HE   LYS  55           HE2      LYS  55  -4.861  -5.953  11.796
  464   2HE   LYS  55           HE1      LYS  55  -5.759  -5.360  13.192
  465   1HZ   LYS  55           HZ2      LYS  55  -4.151  -7.725  13.657
  466   2HZ   LYS  55           HZ1      LYS  55  -3.272  -6.312  13.317
  467   3HZ   LYS  55           HZ3      LYS  55  -4.357  -6.340  14.621
  468    H    VAL  56           HN       VAL  56  -9.221  -5.546   8.536
  469    HA   VAL  56           HA       VAL  56  -9.783  -2.721   8.871
  470    HB   VAL  56           HB       VAL  56  -9.846  -2.840   6.290
  471   1HG1  VAL  56          HG13      VAL  56  -7.789  -2.652   8.112
  472   2HG1  VAL  56          HG12      VAL  56  -7.248  -3.965   7.067
  473   3HG1  VAL  56          HG11      VAL  56  -7.627  -2.388   6.377
  474   1HG2  VAL  56          HG21      VAL  56 -10.016  -5.581   6.855
  475   2HG2  VAL  56          HG23      VAL  56  -9.735  -4.850   5.277
  476   3HG2  VAL  56          HG22      VAL  56  -8.370  -5.339   6.280
  477    H    MET  57           HN       MET  57 -11.600  -5.533   7.781
  478    HA   MET  57           HA       MET  57 -13.914  -4.033   6.894
  479   1HB   MET  57           HB2      MET  57 -13.257  -6.435   6.252
  480   2HB   MET  57           HB1      MET  57 -13.890  -6.912   7.826
  481   1HG   MET  57           HG2      MET  57 -15.602  -7.141   6.055
  482   2HG   MET  57           HG1      MET  57 -16.074  -5.943   7.260
  483   1HE   MET  57           HE3      MET  57 -14.339  -6.768   4.187
  484   2HE   MET  57           HE2      MET  57 -14.832  -5.595   2.971
  485   3HE   MET  57           HE1      MET  57 -13.441  -5.255   3.996
  486    H    GLU  58           HN       GLU  58 -12.766  -5.255   9.963
  487    HA   GLU  58           HA       GLU  58 -15.344  -5.055  11.305
  488   1HB   GLU  58           HB2      GLU  58 -12.535  -5.610  12.093
  489   2HB   GLU  58           HB1      GLU  58 -13.547  -4.873  13.334
  490   1HG   GLU  58           HG2      GLU  58 -15.283  -6.716  12.499
  491   2HG   GLU  58           HG1      GLU  58 -13.803  -7.547  12.026
  492    H    THR  59           HN       THR  59 -12.388  -3.025  11.255
  493    HA   THR  59           HA       THR  59 -13.540  -0.904  12.825
  494    HB   THR  59           HB       THR  59 -11.441  -0.471  10.699
  495    HG1  THR  59           HG1      THR  59  -9.962  -1.155  12.378
  496   1HG2  THR  59          HG23      THR  59 -12.223   0.758  13.323
  497   2HG2  THR  59          HG22      THR  59 -10.560   0.904  12.756
  498   3HG2  THR  59          HG21      THR  59 -11.884   1.545  11.783
  499    H    LEU  60           HN       LEU  60 -13.736  -1.848   9.497
  500    HA   LEU  60           HA       LEU  60 -14.682   0.636   8.398
  501   1HB   LEU  60           HB2      LEU  60 -14.579  -2.226   7.577
  502   2HB   LEU  60           HB1      LEU  60 -15.760  -1.214   6.753
  503    HG   LEU  60           HG       LEU  60 -12.810  -0.580   7.027
  504   1HD1  LEU  60          HD12      LEU  60 -14.467  -1.769   4.801
  505   2HD1  LEU  60          HD11      LEU  60 -12.953  -0.929   4.473
  506   3HD1  LEU  60          HD13      LEU  60 -12.960  -2.373   5.483
  507   1HD2  LEU  60          HD22      LEU  60 -15.135   0.994   6.310
  508   2HD2  LEU  60          HD21      LEU  60 -13.462   1.515   6.497
  509   3HD2  LEU  60          HD23      LEU  60 -14.021   0.887   4.948
  510    H    ASP  61           HN       ASP  61 -16.402  -2.334   9.376
  511    HA   ASP  61           HA       ASP  61 -19.007  -1.030   9.183
  512   1HB   ASP  61           HB2      ASP  61 -18.175  -3.633   9.052
  513   2HB   ASP  61           HB1      ASP  61 -18.791  -3.554  10.702
  514    H    GLU  62           HN       GLU  62 -16.557  -1.012  11.491
  515    HA   GLU  62           HA       GLU  62 -18.281  -0.987  13.851
  516   1HB   GLU  62           HB2      GLU  62 -15.889  -1.740  13.913
  517   2HB   GLU  62           HB1      GLU  62 -15.406  -0.072  13.603
  518   1HG   GLU  62           HG2      GLU  62 -16.763   0.586  15.646
  519   2HG   GLU  62           HG1      GLU  62 -16.911  -1.135  16.002
  520    H    ASP  63           HN       ASP  63 -16.501   1.431  11.955
  521    HA   ASP  63           HA       ASP  63 -17.573   3.639  13.554
  522   1HB   ASP  63           HB2      ASP  63 -15.578   3.284  11.446
  523   2HB   ASP  63           HB1      ASP  63 -16.561   4.729  11.208
  524    H    GLY  64           HN       GLY  64 -17.698   3.206  10.028
  525   1HA   GLY  64           HA2      GLY  64 -19.460   3.534   8.514
  526   2HA   GLY  64           HA1      GLY  64 -20.549   3.103   9.831
  527    H    ASP  65           HN       ASP  65 -18.512   5.670  10.681
  528    HA   ASP  65           HA       ASP  65 -20.409   7.738   9.733
  529   1HB   ASP  65           HB2      ASP  65 -20.908   6.716  12.101
  530   2HB   ASP  65           HB1      ASP  65 -19.563   7.736  12.599
  531    H    GLY  66           HN       GLY  66 -17.275   6.893  11.125
  532   1HA   GLY  66           HA2      GLY  66 -16.348   9.674  10.957
  533   2HA   GLY  66           HA1      GLY  66 -15.407   8.307  11.546
  534    H    GLU  67           HN       GLU  67 -14.192  10.049   9.863
  535    HA   GLU  67           HA       GLU  67 -14.291   8.839   7.152
  536   1HB   GLU  67           HB2      GLU  67 -12.839  10.799   6.542
  537   2HB   GLU  67           HB1      GLU  67 -14.422  11.257   7.172
  538   1HG   GLU  67           HG2      GLU  67 -13.465  11.673   9.379
  539   2HG   GLU  67           HG1      GLU  67 -11.885  11.114   8.827
  540    H    CYS  68           HN       CYS  68 -12.079   8.587   6.088
  541    HA   CYS  68           HA       CYS  68 -10.164   7.420   8.072
  542   1HB   CYS  68           HB2      CYS  68 -10.899   6.629   5.255
  543   2HB   CYS  68           HB1      CYS  68  -9.382   6.105   5.985
  544    HG   CYS  68           HG       CYS  68 -10.945   4.264   6.749
  545    H    ASP  69           HN       ASP  69  -7.842   7.527   7.331
  546    HA   ASP  69           HA       ASP  69  -7.337  10.209   6.156
  547   1HB   ASP  69           HB2      ASP  69  -5.489   8.300   7.623
  548   2HB   ASP  69           HB1      ASP  69  -5.049   9.915   7.064
  549    H    PHE  70           HN       PHE  70  -5.059  10.134   4.905
  550    HA   PHE  70           HA       PHE  70  -5.543   8.350   2.621
  551   1HB   PHE  70           HB2      PHE  70  -3.095   9.533   2.113
  552   2HB   PHE  70           HB1      PHE  70  -4.651  10.168   1.597
  553    HD1  PHE  70           HD2      PHE  70  -5.844  11.854   3.046
  554    HD2  PHE  70           HD1      PHE  70  -1.790  10.639   3.775
  555    HE1  PHE  70           HE2      PHE  70  -5.500  13.858   4.465
  556    HE2  PHE  70           HE1      PHE  70  -1.446  12.644   5.195
  557    HZ   PHE  70           HZ       PHE  70  -3.300  14.253   5.540
  558    H    GLN  71           HN       GLN  71  -3.276   8.616   5.296
  559    HA   GLN  71           HA       GLN  71  -1.581   6.446   4.293
  560   1HB   GLN  71           HB2      GLN  71  -1.724   7.661   7.075
  561   2HB   GLN  71           HB1      GLN  71  -0.420   6.659   6.434
  562   1HG   GLN  71           HG2      GLN  71  -0.261   8.453   4.562
  563   2HG   GLN  71           HG1      GLN  71  -1.180   9.473   5.670
  564   1HE2  GLN  71          HE22      GLN  71   2.450   8.176   7.113
  565   2HE2  GLN  71          HE21      GLN  71   1.447   7.078   6.295
  566    H    GLU  72           HN       GLU  72  -4.403   6.815   6.327
  567    HA   GLU  72           HA       GLU  72  -4.228   4.178   7.538
  568   1HB   GLU  72           HB2      GLU  72  -6.185   6.413   7.460
  569   2HB   GLU  72           HB1      GLU  72  -6.863   4.807   7.721
  570   1HG   GLU  72           HG2      GLU  72  -4.507   5.063   9.328
  571   2HG   GLU  72           HG1      GLU  72  -5.530   6.472   9.611
  572    H    PHE  73           HN       PHE  73  -6.301   5.566   4.971
  573    HA   PHE  73           HA       PHE  73  -7.441   3.060   4.190
  574   1HB   PHE  73           HB2      PHE  73  -8.674   4.430   2.878
  575   2HB   PHE  73           HB1      PHE  73  -7.698   5.774   3.452
  576    HD1  PHE  73           HD1      PHE  73  -5.644   6.456   2.174
  577    HD2  PHE  73           HD2      PHE  73  -8.443   3.576   0.654
  578    HE1  PHE  73           HE1      PHE  73  -4.710   6.750  -0.103
  579    HE2  PHE  73           HE2      PHE  73  -7.510   3.871  -1.624
  580    HZ   PHE  73           HZ       PHE  73  -5.644   5.458  -2.003
  581    H    MET  74           HN       MET  74  -4.393   4.575   3.559
  582    HA   MET  74           HA       MET  74  -3.697   3.052   1.196
  583   1HB   MET  74           HB2      MET  74  -2.391   4.953   3.030
  584   2HB   MET  74           HB1      MET  74  -1.299   3.735   2.374
  585   1HG   MET  74           HG2      MET  74  -3.141   4.883   0.385
  586   2HG   MET  74           HG1      MET  74  -2.016   6.051   1.079
  587   1HE   MET  74           HE3      MET  74  -2.900   3.243  -0.780
  588   2HE   MET  74           HE2      MET  74  -1.977   3.770  -2.185
  589   3HE   MET  74           HE1      MET  74  -1.477   2.331  -1.302
  590    H    ALA  75           HN       ALA  75  -2.803   2.734   4.649
  591    HA   ALA  75           HA       ALA  75  -1.417   0.225   4.217
  592   1HB   ALA  75           HB2      ALA  75  -2.271   1.835   6.589
  593   2HB   ALA  75           HB1      ALA  75  -1.887   0.132   6.841
  594   3HB   ALA  75           HB3      ALA  75  -0.673   1.220   6.170
  595    H    PHE  76           HN       PHE  76  -4.707   1.131   4.509
  596    HA   PHE  76           HA       PHE  76  -5.656  -1.433   5.541
  597   1HB   PHE  76           HB2      PHE  76  -6.820   1.151   4.782
  598   2HB   PHE  76           HB1      PHE  76  -7.816  -0.221   4.302
  599    HD1  PHE  76           HD1      PHE  76  -5.545   0.330   7.232
  600    HD2  PHE  76           HD2      PHE  76  -9.534  -0.486   5.867
  601    HE1  PHE  76           HE1      PHE  76  -6.291   0.046   9.580
  602    HE2  PHE  76           HE2      PHE  76 -10.280  -0.770   8.214
  603    HZ   PHE  76           HZ       PHE  76  -8.658  -0.504  10.071
  604    H    VAL  77           HN       VAL  77  -5.203   0.073   2.382
  605    HA   VAL  77           HA       VAL  77  -6.600  -1.992   0.897
  606    HB   VAL  77           HB       VAL  77  -4.517   0.048   0.065
  607   1HG1  VAL  77          HG13      VAL  77  -5.470  -2.252  -1.323
  608   2HG1  VAL  77          HG12      VAL  77  -6.205  -0.838  -2.076
  609   3HG1  VAL  77          HG11      VAL  77  -4.452  -0.955  -1.948
  610   1HG2  VAL  77          HG22      VAL  77  -6.869   0.728   0.945
  611   2HG2  VAL  77          HG21      VAL  77  -6.331   1.405  -0.592
  612   3HG2  VAL  77          HG23      VAL  77  -7.465   0.054  -0.572
  613    H    SER  78           HN       SER  78  -3.374  -1.618   2.180
  614    HA   SER  78           HA       SER  78  -2.184  -3.685   0.506
  615   1HB   SER  78           HB2      SER  78  -1.020  -2.926   3.153
  616   2HB   SER  78           HB1      SER  78  -0.209  -3.222   1.618
  617    HG   SER  78           HG       SER  78  -0.647  -1.221   0.988
  618    H    MET  79           HN       MET  79  -3.294  -3.567   3.897
  619    HA   MET  79           HA       MET  79  -2.597  -6.210   4.614
  620   1HB   MET  79           HB2      MET  79  -5.229  -5.489   5.670
  621   2HB   MET  79           HB1      MET  79  -3.729  -5.811   6.531
  622   1HG   MET  79           HG2      MET  79  -2.961  -3.505   5.997
  623   2HG   MET  79           HG1      MET  79  -4.512  -3.194   5.218
  624   1HE   MET  79           HE1      MET  79  -2.768  -4.388   8.473
  625   2HE   MET  79           HE3      MET  79  -2.524  -2.659   8.190
  626   3HE   MET  79           HE2      MET  79  -3.432  -3.205   9.597
  627    H    VAL  80           HN       VAL  80  -5.712  -5.076   3.278
  628    HA   VAL  80           HA       VAL  80  -6.835  -7.688   3.019
  629    HB   VAL  80           HB       VAL  80  -8.399  -6.543   1.410
  630   1HG1  VAL  80          HG13      VAL  80  -7.795  -5.594   4.182
  631   2HG1  VAL  80          HG12      VAL  80  -9.029  -4.741   3.255
  632   3HG1  VAL  80          HG11      VAL  80  -9.206  -6.465   3.581
  633   1HG2  VAL  80          HG23      VAL  80  -6.254  -4.531   1.597
  634   2HG2  VAL  80          HG22      VAL  80  -7.467  -4.768   0.340
  635   3HG2  VAL  80          HG21      VAL  80  -7.877  -3.872   1.804
  636    H    THR  81           HN       THR  81  -5.090  -5.647   0.656
  637    HA   THR  81           HA       THR  81  -5.374  -7.555  -1.491
  638    HB   THR  81           HB       THR  81  -3.181  -5.492  -1.217
  639    HG1  THR  81           HG1      THR  81  -4.755  -4.165  -2.349
  640   1HG2  THR  81          HG22      THR  81  -3.278  -7.281  -3.096
  641   2HG2  THR  81          HG21      THR  81  -4.643  -6.348  -3.704
  642   3HG2  THR  81          HG23      THR  81  -3.055  -5.596  -3.564
  643    H    THR  82           HN       THR  82  -3.621  -7.762   1.346
  644    HA   THR  82           HA       THR  82  -1.739  -9.699   0.063
  645    HB   THR  82           HB       THR  82  -0.031  -9.067   1.707
  646    HG1  THR  82           HG1      THR  82  -0.485  -7.199   3.004
  647   1HG2  THR  82          HG21      THR  82  -0.424  -7.788  -0.505
  648   2HG2  THR  82          HG23      THR  82  -1.070  -6.501   0.515
  649   3HG2  THR  82          HG22      THR  82   0.602  -7.025   0.710
  650    H    ALA  83           HN       ALA  83  -4.402  -9.581   1.840
  651    HA   ALA  83           HA       ALA  83  -3.618 -11.260   4.107
  652   1HB   ALA  83           HB2      ALA  83  -6.157 -10.087   3.059
  653   2HB   ALA  83           HB1      ALA  83  -6.284 -11.524   4.074
  654   3HB   ALA  83           HB3      ALA  83  -5.505 -10.070   4.698
  655    H    CYS  84           HN       CYS  84  -4.379 -11.747   0.805
  656    HA   CYS  84           HA       CYS  84  -5.283 -14.530   1.194
  657   1HB   CYS  84           HB2      CYS  84  -4.779 -12.861  -1.285
  658   2HB   CYS  84           HB1      CYS  84  -5.335 -14.534  -1.325
  659    HG   CYS  84           HG       CYS  84  -7.614 -13.652  -0.968
  660    H    HIS  85           HN       HIS  85  -4.066 -16.010  -0.664
  661    HA   HIS  85           HA       HIS  85  -1.137 -15.667  -0.167
  662   1HB   HIS  85           HB2      HIS  85  -0.880 -17.962   0.300
  663   2HB   HIS  85           HB1      HIS  85  -2.366 -17.541   1.144
  664    HD1  HIS  85           HD1      HIS  85  -4.568 -17.790  -0.723
  665    HD2  HIS  85           HD2      HIS  85  -1.264 -20.307  -1.078
  666    HE1  HIS  85           HE1      HIS  85  -5.337 -19.800  -2.057
  667    H    GLU  86           HN       GLU  86  -3.551 -15.809  -2.466
  668    HA   GLU  86           HA       GLU  86  -1.741 -16.987  -4.522
  669   1HB   GLU  86           HB2      GLU  86  -3.938 -16.799  -5.921
  670   2HB   GLU  86           HB1      GLU  86  -3.813 -18.069  -4.705
  671   1HG   GLU  86           HG2      GLU  86  -5.135 -16.851  -3.144
  672   2HG   GLU  86           HG1      GLU  86  -4.996 -15.360  -4.077
  673    H    PHE  87           HN       PHE  87  -0.611 -14.745  -4.123
  674    HA   PHE  87           HA       PHE  87  -1.884 -12.739  -5.939
  675   1HB   PHE  87           HB2      PHE  87  -0.184 -11.161  -4.704
  676   2HB   PHE  87           HB1      PHE  87  -1.705 -11.585  -3.922
  677    HD1  PHE  87           HD1      PHE  87   1.438 -13.584  -4.367
  678    HD2  PHE  87           HD2      PHE  87  -1.267 -11.686  -1.624
  679    HE1  PHE  87           HE1      PHE  87   2.686 -14.559  -2.464
  680    HE2  PHE  87           HE2      PHE  87  -0.013 -12.660   0.280
  681    HZ   PHE  87           HZ       PHE  87   1.963 -14.096  -0.141
  682    H    PHE  88           HN       PHE  88   0.513 -15.026  -5.805
  683    HA   PHE  88           HA       PHE  88   2.148 -13.527  -7.812
  684   1HB   PHE  88           HB2      PHE  88   3.105 -15.509  -5.726
  685   2HB   PHE  88           HB1      PHE  88   4.114 -14.830  -7.002
  686    HD1  PHE  88           HD1      PHE  88   3.068 -12.023  -7.065
  687    HD2  PHE  88           HD2      PHE  88   4.042 -14.584  -3.760
  688    HE1  PHE  88           HE1      PHE  88   3.510 -10.034  -5.648
  689    HE2  PHE  88           HE2      PHE  88   4.479 -12.594  -2.347
  690    HZ   PHE  88           HZ       PHE  88   4.211 -10.319  -3.292
  691    H    GLU  89           HN       GLU  89  -0.088 -15.166  -8.468
  692    HA   GLU  89           HA       GLU  89   1.330 -17.332  -9.942
  693   1HB   GLU  89           HB2      GLU  89  -0.794 -17.635  -7.923
  694   2HB   GLU  89           HB1      GLU  89  -1.109 -18.484  -9.437
  695   1HG   GLU  89           HG2      GLU  89   0.147 -20.099  -8.374
  696   2HG   GLU  89           HG1      GLU  89   1.450 -19.189  -9.138
  697    H    HIS  90           HN       HIS  90  -2.151 -16.953  -9.812
  698    HA   HIS  90           HA       HIS  90  -2.649 -15.110 -11.844
  699   1HB   HIS  90           HB2      HIS  90  -2.946 -16.814 -13.792
  700   2HB   HIS  90           HB1      HIS  90  -1.322 -16.221 -13.445
  701    HD1  HIS  90           HD1      HIS  90   0.412 -17.933 -12.829
  702    HD2  HIS  90           HD2      HIS  90  -3.452 -19.477 -12.606
  703    HE1  HIS  90           HE1      HIS  90   0.656 -20.415 -12.383
  704    H    GLU  91           HN       GLU  91  -4.524 -15.030 -10.465
  705    HA   GLU  91           HA       GLU  91  -6.808 -16.407 -11.404
  706   1HB   GLU  91           HB2      GLU  91  -5.276 -18.161  -9.965
  707   2HB   GLU  91           HB1      GLU  91  -6.341 -17.523  -8.711
  708   1HG   GLU  91           HG2      GLU  91  -8.215 -17.928 -10.521
  709   2HG   GLU  91           HG1      GLU  91  -7.042 -19.063 -11.188
  710   1H    MET   0           HT3      MET   0  -9.190  -3.536 -14.266
  711   2H    MET   0           HT2      MET   0  -8.314  -4.552 -15.308
  712   3H    MET   0           HT1      MET   0  -7.527  -3.760 -14.028
  713    HA   MET   0           HA       MET   0  -6.939  -2.491 -15.859
  714   1HB   MET   0           HB2      MET   0  -8.644  -1.794 -17.543
  715   2HB   MET   0           HB1      MET   0  -8.448  -3.545 -17.464
  716   1HG   MET   0           HG2      MET   0 -10.408  -3.639 -15.907
  717   2HG   MET   0           HG1      MET   0 -10.645  -1.911 -16.164
  718   1HE   MET   0           HE1      MET   0 -12.395  -4.359 -16.420
  719   2HE   MET   0           HE3      MET   0 -13.143  -4.561 -18.010
  720   3HE   MET   0           HE2      MET   0 -11.688  -5.463 -17.598
  721    H    SER   1           HN       SER   1  -8.463  -2.108 -13.156
  722    HA   SER   1           HA       SER   1  -9.492   0.640 -13.581
  723   1HB   SER   1           HB2      SER   1 -10.078   0.451 -11.123
  724   2HB   SER   1           HB1      SER   1 -10.878  -0.722 -12.164
  725    HG   SER   1           HG       SER   1  -9.745  -1.444 -10.125
  726    H    GLU   2           HN       GLU   2  -8.826   1.958 -11.314
  727    HA   GLU   2           HA       GLU   2  -5.976   2.477 -11.713
  728   1HB   GLU   2           HB2      GLU   2  -7.703   3.681  -9.548
  729   2HB   GLU   2           HB1      GLU   2  -6.303   4.391 -10.352
  730   1HG   GLU   2           HG2      GLU   2  -8.997   3.817 -11.620
  731   2HG   GLU   2           HG1      GLU   2  -8.346   5.408 -11.227
  732    H    LEU   3           HN       LEU   3  -8.015   1.212  -9.088
  733    HA   LEU   3           HA       LEU   3  -5.726   0.791  -7.323
  734   1HB   LEU   3           HB2      LEU   3  -8.236   1.190  -6.706
  735   2HB   LEU   3           HB1      LEU   3  -8.395  -0.543  -6.978
  736    HG   LEU   3           HG       LEU   3  -6.280  -0.703  -5.436
  737   1HD1  LEU   3          HD11      LEU   3  -7.223   2.104  -5.110
  738   2HD1  LEU   3          HD13      LEU   3  -6.772   1.240  -3.641
  739   3HD1  LEU   3          HD12      LEU   3  -5.600   1.437  -4.944
  740   1HD2  LEU   3          HD22      LEU   3  -8.663  -1.474  -4.983
  741   2HD2  LEU   3          HD21      LEU   3  -7.730  -1.046  -3.549
  742   3HD2  LEU   3          HD23      LEU   3  -8.928   0.078  -4.190
  743    H    GLU   4           HN       GLU   4  -7.914  -1.338  -9.176
  744    HA   GLU   4           HA       GLU   4  -6.600  -3.764  -8.439
  745   1HB   GLU   4           HB2      GLU   4  -8.852  -3.679  -9.480
  746   2HB   GLU   4           HB1      GLU   4  -8.115  -3.157 -10.995
  747   1HG   GLU   4           HG2      GLU   4  -6.616  -5.349 -10.512
  748   2HG   GLU   4           HG1      GLU   4  -8.114  -5.840  -9.720
  749    H    LYS   5           HN       LYS   5  -6.027  -1.516 -11.138
  750    HA   LYS   5           HA       LYS   5  -3.960  -3.246 -12.279
  751   1HB   LYS   5           HB2      LYS   5  -5.482  -1.420 -13.441
  752   2HB   LYS   5           HB1      LYS   5  -4.187  -0.330 -12.944
  753   1HG   LYS   5           HG2      LYS   5  -3.494  -1.035 -15.077
  754   2HG   LYS   5           HG1      LYS   5  -2.599  -2.103 -13.996
  755   1HD   LYS   5           HD2      LYS   5  -4.021  -3.931 -14.422
  756   2HD   LYS   5           HD1      LYS   5  -5.307  -2.899 -15.048
  757   1HE   LYS   5           HE2      LYS   5  -3.947  -2.361 -17.017
  758   2HE   LYS   5           HE1      LYS   5  -2.619  -3.332 -16.385
  759   1HZ   LYS   5           HZ1      LYS   5  -4.193  -5.246 -16.387
  760   2HZ   LYS   5           HZ3      LYS   5  -5.300  -4.277 -17.229
  761   3HZ   LYS   5           HZ2      LYS   5  -3.801  -4.658 -17.930
  762    H    ALA   6           HN       ALA   6  -4.055  -0.332 -10.259
  763    HA   ALA   6           HA       ALA   6  -1.142  -0.070 -10.231
  764   1HB   ALA   6           HB2      ALA   6  -2.944   1.784  -9.895
  765   2HB   ALA   6           HB1      ALA   6  -3.002   1.203  -8.232
  766   3HB   ALA   6           HB3      ALA   6  -1.495   1.832  -8.893
  767    H    MET   7           HN       MET   7  -3.455  -0.568  -7.564
  768    HA   MET   7           HA       MET   7  -1.710  -1.404  -5.587
  769   1HB   MET   7           HB2      MET   7  -4.177  -1.088  -5.318
  770   2HB   MET   7           HB1      MET   7  -4.429  -2.636  -6.130
  771   1HG   MET   7           HG2      MET   7  -4.457  -2.862  -3.654
  772   2HG   MET   7           HG1      MET   7  -3.147  -3.785  -4.391
  773   1HE   MET   7           HE3      MET   7  -2.946  -3.764  -1.867
  774   2HE   MET   7           HE2      MET   7  -1.660  -2.831  -1.105
  775   3HE   MET   7           HE1      MET   7  -3.317  -2.237  -1.055
  776    H    VAL   8           HN       VAL   8  -3.364  -3.553  -7.911
  777    HA   VAL   8           HA       VAL   8  -2.019  -5.927  -7.060
  778    HB   VAL   8           HB       VAL   8  -3.083  -5.342  -9.837
  779   1HG1  VAL   8          HG11      VAL   8  -2.161  -7.750  -8.354
  780   2HG1  VAL   8          HG13      VAL   8  -3.616  -7.939  -9.332
  781   3HG1  VAL   8          HG12      VAL   8  -2.110  -7.406 -10.082
  782   1HG2  VAL   8          HG22      VAL   8  -4.699  -4.857  -7.941
  783   2HG2  VAL   8          HG21      VAL   8  -5.225  -6.131  -9.040
  784   3HG2  VAL   8          HG23      VAL   8  -4.545  -6.548  -7.468
  785    H    ALA   9           HN       ALA   9  -1.117  -3.394  -9.346
  786    HA   ALA   9           HA       ALA   9   1.042  -4.743 -10.628
  787   1HB   ALA   9           HB3      ALA   9   0.279  -1.907 -10.144
  788   2HB   ALA   9           HB2      ALA   9   1.975  -2.206 -10.523
  789   3HB   ALA   9           HB1      ALA   9   0.718  -2.710 -11.651
  790    H    LEU  10           HN       LEU  10   0.919  -2.859  -7.603
  791    HA   LEU  10           HA       LEU  10   3.638  -2.919  -6.912
  792   1HB   LEU  10           HB2      LEU  10   1.191  -2.369  -5.586
  793   2HB   LEU  10           HB1      LEU  10   2.049  -3.541  -4.587
  794    HG   LEU  10           HG       LEU  10   3.520  -1.179  -5.721
  795   1HD1  LEU  10          HD11      LEU  10   1.706  -1.233  -3.302
  796   2HD1  LEU  10          HD13      LEU  10   3.012  -0.062  -3.477
  797   3HD1  LEU  10          HD12      LEU  10   1.689  -0.088  -4.642
  798   1HD2  LEU  10          HD21      LEU  10   3.795  -2.984  -3.305
  799   2HD2  LEU  10          HD23      LEU  10   4.882  -2.869  -4.688
  800   3HD2  LEU  10          HD22      LEU  10   4.773  -1.536  -3.539
  801    H    ILE  11           HN       ILE  11   1.141  -5.407  -6.379
  802    HA   ILE  11           HA       ILE  11   2.713  -7.321  -5.035
  803    HB   ILE  11           HB       ILE  11   0.244  -7.311  -6.642
  804   1HG1  ILE  11          HG12      ILE  11   0.215  -9.309  -4.663
  805   2HG1  ILE  11          HG11      ILE  11   1.210  -8.010  -4.007
  806   1HG2  ILE  11          HG21      ILE  11   2.102  -9.655  -6.761
  807   2HG2  ILE  11          HG23      ILE  11   0.377  -9.964  -6.582
  808   3HG2  ILE  11          HG22      ILE  11   0.973  -9.061  -7.974
  809   1HD1  ILE  11          HD11      ILE  11  -0.725  -6.472  -4.931
  810   2HD1  ILE  11          HD13      ILE  11  -1.673  -7.955  -4.824
  811   3HD1  ILE  11          HD12      ILE  11  -0.909  -7.289  -3.380
  812    H    ASP  12           HN       ASP  12   2.397  -6.668  -8.507
  813    HA   ASP  12           HA       ASP  12   3.979  -8.751  -9.541
  814   1HB   ASP  12           HB2      ASP  12   2.707  -6.874 -10.779
  815   2HB   ASP  12           HB1      ASP  12   4.168  -5.916 -10.562
  816    H    VAL  13           HN       VAL  13   5.039  -5.522  -8.444
  817    HA   VAL  13           HA       VAL  13   7.781  -5.735  -8.893
  818    HB   VAL  13           HB       VAL  13   6.394  -4.533  -6.477
  819   1HG1  VAL  13          HG11      VAL  13   9.006  -5.071  -6.513
  820   2HG1  VAL  13          HG13      VAL  13   9.049  -3.607  -7.494
  821   3HG1  VAL  13          HG12      VAL  13   8.395  -3.552  -5.857
  822   1HG2  VAL  13          HG23      VAL  13   6.469  -3.798  -9.229
  823   2HG2  VAL  13          HG22      VAL  13   5.787  -2.883  -7.885
  824   3HG2  VAL  13          HG21      VAL  13   7.470  -2.646  -8.348
  825    H    PHE  14           HN       PHE  14   5.887  -7.233  -6.303
  826    HA   PHE  14           HA       PHE  14   8.053  -8.128  -4.693
  827   1HB   PHE  14           HB2      PHE  14   5.330  -8.354  -4.534
  828   2HB   PHE  14           HB1      PHE  14   5.786 -10.005  -4.956
  829    HD1  PHE  14           HD2      PHE  14   6.975  -7.236  -2.710
  830    HD2  PHE  14           HD1      PHE  14   6.294 -11.447  -3.209
  831    HE1  PHE  14           HE2      PHE  14   7.718  -7.631  -0.378
  832    HE2  PHE  14           HE1      PHE  14   7.038 -11.844  -0.878
  833    HZ   PHE  14           HZ       PHE  14   7.750  -9.937   0.539
  834    H    HIS  15           HN       HIS  15   6.437  -9.699  -7.459
  835    HA   HIS  15           HA       HIS  15   8.006 -12.098  -7.373
  836   1HB   HIS  15           HB2      HIS  15   5.993 -12.157  -8.649
  837   2HB   HIS  15           HB1      HIS  15   6.454 -10.733  -9.580
  838    HD1  HIS  15           HD1      HIS  15   7.893 -11.090 -11.638
  839    HD2  HIS  15           HD2      HIS  15   7.534 -14.543  -9.335
  840    HE1  HIS  15           HE1      HIS  15   8.917 -12.967 -12.996
  841    H    GLN  16           HN       GLN  16   8.814  -8.905  -8.299
  842    HA   GLN  16           HA       GLN  16  10.974  -9.761 -10.121
  843   1HB   GLN  16           HB2      GLN  16   9.523  -7.621 -10.355
  844   2HB   GLN  16           HB1      GLN  16  10.559  -6.956  -9.094
  845   1HG   GLN  16           HG2      GLN  16  11.552  -6.336 -11.186
  846   2HG   GLN  16           HG1      GLN  16  12.545  -7.636 -10.526
  847   1HE2  GLN  16          HE22      GLN  16  11.972  -8.648 -14.012
  848   2HE2  GLN  16          HE21      GLN  16  12.889  -7.501 -13.162
  849    H    TYR  17           HN       TYR  17  10.870  -7.707  -7.182
  850    HA   TYR  17           HA       TYR  17  13.692  -7.991  -6.690
  851   1HB   TYR  17           HB2      TYR  17  11.382  -7.058  -4.975
  852   2HB   TYR  17           HB1      TYR  17  13.049  -7.063  -4.401
  853    HD1  TYR  17           HD2      TYR  17  10.895  -5.833  -7.197
  854    HD2  TYR  17           HD1      TYR  17  14.499  -5.286  -4.928
  855    HE1  TYR  17           HE2      TYR  17  11.308  -3.687  -8.369
  856    HE2  TYR  17           HE1      TYR  17  14.912  -3.140  -6.100
  857    HH   TYR  17           HH       TYR  17  13.704  -2.282  -8.836
  858    H    SER  18           HN       SER  18  10.896  -9.327  -4.875
  859    HA   SER  18           HA       SER  18  12.514 -11.068  -3.272
  860   1HB   SER  18           HB2      SER  18  10.054 -10.316  -2.924
  861   2HB   SER  18           HB1      SER  18   9.648 -11.657  -3.992
  862    HG   SER  18           HG       SER  18  10.087 -12.993  -2.431
  863    H    GLY  19           HN       GLY  19  10.898 -11.509  -6.392
  864   1HA   GLY  19           HA2      GLY  19  11.359 -14.352  -6.551
  865   2HA   GLY  19           HA1      GLY  19  10.979 -13.302  -7.913
  866    H    ARG  20           HN       ARG  20  13.531 -11.803  -6.578
  867    HA   ARG  20           HA       ARG  20  15.368 -12.329  -8.610
  868   1HB   ARG  20           HB2      ARG  20  15.514 -11.214  -5.886
  869   2HB   ARG  20           HB1      ARG  20  17.034 -11.878  -6.480
  870   1HG   ARG  20           HG2      ARG  20  17.055 -10.431  -8.363
  871   2HG   ARG  20           HG1      ARG  20  15.358 -10.003  -8.150
  872   1HD   ARG  20           HD2      ARG  20  15.806  -8.664  -6.257
  873   2HD   ARG  20           HD1      ARG  20  17.390  -9.396  -6.007
  874    HE   ARG  20           HE       ARG  20  16.742  -7.411  -8.132
  875   1HH1  ARG  20          HH11      ARG  20  18.762  -7.878  -5.589
  876   2HH1  ARG  20          HH12      ARG  20  20.246  -7.678  -6.457
  877   1HH2  ARG  20          HH21      ARG  20  18.741  -7.772  -9.579
  878   2HH2  ARG  20          HH22      ARG  20  20.235  -7.616  -8.716
  879    H    GLU  21           HN       GLU  21  14.937 -14.085  -5.561
  880    HA   GLU  21           HA       GLU  21  16.561 -16.296  -6.733
  881   1HB   GLU  21           HB2      GLU  21  17.379 -14.657  -4.578
  882   2HB   GLU  21           HB1      GLU  21  16.894 -16.196  -3.869
  883   1HG   GLU  21           HG2      GLU  21  18.292 -17.296  -5.737
  884   2HG   GLU  21           HG1      GLU  21  18.991 -15.694  -5.979
  885    H    GLY  22           HN       GLY  22  16.343 -17.985  -4.466
  886   1HA   GLY  22           HA2      GLY  22  13.856 -19.239  -4.891
  887   2HA   GLY  22           HA1      GLY  22  14.859 -19.498  -3.464
  888    H    ASP  23           HN       ASP  23  14.760 -16.719  -2.594
  889    HA   ASP  23           HA       ASP  23  12.628 -16.735  -0.817
  890   1HB   ASP  23           HB2      ASP  23  13.710 -14.238  -2.147
  891   2HB   ASP  23           HB1      ASP  23  12.989 -14.366  -0.545
  892    H    LYS  24           HN       LYS  24  10.677 -17.432  -1.775
  893    HA   LYS  24           HA       LYS  24   9.532 -15.648  -3.874
  894   1HB   LYS  24           HB2      LYS  24   8.728 -18.444  -3.009
  895   2HB   LYS  24           HB1      LYS  24   7.948 -17.514  -4.289
  896   1HG   LYS  24           HG2      LYS  24  10.558 -17.338  -5.055
  897   2HG   LYS  24           HG1      LYS  24  10.542 -18.933  -4.304
  898   1HD   LYS  24           HD2      LYS  24   8.505 -19.473  -5.694
  899   2HD   LYS  24           HD1      LYS  24   8.771 -17.957  -6.554
  900   1HE   LYS  24           HE2      LYS  24  10.656 -20.324  -6.398
  901   2HE   LYS  24           HE1      LYS  24   9.833 -19.710  -7.830
  902   1HZ   LYS  24           HZ3      LYS  24  11.057 -17.538  -7.269
  903   2HZ   LYS  24           HZ2      LYS  24  12.073 -18.522  -6.331
  904   3HZ   LYS  24           HZ1      LYS  24  11.929 -18.795  -8.000
  905    H    HIS  25           HN       HIS  25   9.615 -15.573  -0.710
  906    HA   HIS  25           HA       HIS  25   6.964 -14.368  -0.472
  907   1HB   HIS  25           HB2      HIS  25   7.501 -17.093   0.498
  908   2HB   HIS  25           HB1      HIS  25   6.840 -16.017   1.729
  909    HD1  HIS  25           HD1      HIS  25   4.918 -18.113   0.954
  910    HD2  HIS  25           HD2      HIS  25   5.276 -14.614  -1.281
  911    HE1  HIS  25           HE1      HIS  25   2.757 -17.867  -0.340
  912    H    LYS  26           HN       LYS  26   9.932 -13.820  -0.075
  913    HA   LYS  26           HA       LYS  26   9.602 -12.425   2.509
  914   1HB   LYS  26           HB2      LYS  26  12.258 -13.453   2.544
  915   2HB   LYS  26           HB1      LYS  26  10.964 -13.770   3.692
  916   1HG   LYS  26           HG2      LYS  26  10.959 -15.284   1.104
  917   2HG   LYS  26           HG1      LYS  26  12.112 -15.752   2.348
  918   1HD   LYS  26           HD2      LYS  26   9.405 -15.275   3.384
  919   2HD   LYS  26           HD1      LYS  26   9.500 -16.610   2.234
  920   1HE   LYS  26           HE2      LYS  26  11.673 -17.194   3.682
  921   2HE   LYS  26           HE1      LYS  26  10.766 -16.328   4.922
  922   1HZ   LYS  26           HZ2      LYS  26   9.322 -18.305   3.333
  923   2HZ   LYS  26           HZ1      LYS  26  10.432 -18.893   4.476
  924   3HZ   LYS  26           HZ3      LYS  26   9.154 -17.895   4.973
  925    H    LEU  27           HN       LEU  27  11.348 -10.800   2.823
  926    HA   LEU  27           HA       LEU  27  12.775 -10.091   0.306
  927   1HB   LEU  27           HB2      LEU  27  10.496  -8.780   0.977
  928   2HB   LEU  27           HB1      LEU  27  11.669  -7.832   1.893
  929    HG   LEU  27           HG       LEU  27  13.014  -7.998  -0.420
  930   1HD1  LEU  27          HD11      LEU  27  10.666  -9.231  -1.140
  931   2HD1  LEU  27          HD13      LEU  27  10.366  -7.566  -1.636
  932   3HD1  LEU  27          HD12      LEU  27  11.764  -8.435  -2.266
  933   1HD2  LEU  27          HD23      LEU  27  12.346  -5.929   0.775
  934   2HD2  LEU  27          HD22      LEU  27  12.102  -5.776  -0.964
  935   3HD2  LEU  27          HD21      LEU  27  10.725  -6.071   0.097
  936    H    LYS  28           HN       LYS  28  13.718  -7.594   1.481
  937    HA   LYS  28           HA       LYS  28  15.122  -8.422   3.941
  938   1HB   LYS  28           HB2      LYS  28  16.342  -8.512   1.316
  939   2HB   LYS  28           HB1      LYS  28  17.165  -7.334   2.340
  940   1HG   LYS  28           HG2      LYS  28  17.269  -9.096   4.142
  941   2HG   LYS  28           HG1      LYS  28  16.657 -10.256   2.962
  942   1HD   LYS  28           HD2      LYS  28  19.087  -8.575   2.363
  943   2HD   LYS  28           HD1      LYS  28  19.228 -10.080   3.270
  944   1HE   LYS  28           HE2      LYS  28  17.571 -10.685   1.076
  945   2HE   LYS  28           HE1      LYS  28  18.881  -9.703   0.420
  946   1HZ   LYS  28           HZ1      LYS  28  19.221 -12.105   2.132
  947   2HZ   LYS  28           HZ3      LYS  28  19.446 -12.059   0.453
  948   3HZ   LYS  28           HZ2      LYS  28  20.474 -11.168   1.471
  949    H    LYS  29           HN       LYS  29  15.924  -6.599   5.111
  950    HA   LYS  29           HA       LYS  29  14.485  -4.175   4.781
  951   1HB   LYS  29           HB2      LYS  29  16.004  -3.229   6.442
  952   2HB   LYS  29           HB1      LYS  29  15.586  -4.879   6.902
  953   1HG   LYS  29           HG2      LYS  29  18.002  -4.475   5.191
  954   2HG   LYS  29           HG1      LYS  29  18.116  -4.053   6.896
  955   1HD   LYS  29           HD2      LYS  29  18.372  -6.223   7.388
  956   2HD   LYS  29           HD1      LYS  29  16.764  -6.541   6.756
  957   1HE   LYS  29           HE2      LYS  29  18.538  -7.911   5.638
  958   2HE   LYS  29           HE1      LYS  29  17.659  -6.877   4.516
  959   1HZ   LYS  29           HZ1      LYS  29  19.822  -5.442   5.578
  960   2HZ   LYS  29           HZ3      LYS  29  20.398  -6.931   5.009
  961   3HZ   LYS  29           HZ2      LYS  29  19.545  -5.898   3.966
  962    H    SER  30           HN       SER  30  17.502  -5.262   3.378
  963    HA   SER  30           HA       SER  30  18.328  -2.605   2.503
  964   1HB   SER  30           HB2      SER  30  19.967  -4.425   2.850
  965   2HB   SER  30           HB1      SER  30  19.217  -5.346   1.549
  966    HG   SER  30           HG       SER  30  21.020  -4.152   0.816
  967    H    GLU  31           HN       GLU  31  16.610  -5.339   1.003
  968    HA   GLU  31           HA       GLU  31  16.482  -3.994  -1.588
  969   1HB   GLU  31           HB2      GLU  31  16.434  -6.494  -1.340
  970   2HB   GLU  31           HB1      GLU  31  14.851  -6.348  -0.577
  971   1HG   GLU  31           HG2      GLU  31  13.799  -5.775  -2.542
  972   2HG   GLU  31           HG1      GLU  31  15.231  -4.986  -3.201
  973    H    LEU  32           HN       LEU  32  14.744  -3.896   1.361
  974    HA   LEU  32           HA       LEU  32  12.241  -2.923   0.185
  975   1HB   LEU  32           HB2      LEU  32  12.124  -4.108   2.316
  976   2HB   LEU  32           HB1      LEU  32  13.265  -2.977   3.043
  977    HG   LEU  32           HG       LEU  32  11.669  -1.132   2.701
  978   1HD1  LEU  32          HD12      LEU  32  10.434  -3.107   0.981
  979   2HD1  LEU  32          HD11      LEU  32   9.268  -2.507   2.161
  980   3HD1  LEU  32          HD13      LEU  32  10.107  -1.377   1.097
  981   1HD2  LEU  32          HD22      LEU  32  11.079  -3.541   4.309
  982   2HD2  LEU  32          HD21      LEU  32  11.189  -1.854   4.810
  983   3HD2  LEU  32          HD23      LEU  32   9.707  -2.460   4.073
  984    H    LYS  33           HN       LYS  33  14.990  -1.594   2.002
  985    HA   LYS  33           HA       LYS  33  14.227   1.125   2.049
  986   1HB   LYS  33           HB2      LYS  33  16.320  -0.133   3.041
  987   2HB   LYS  33           HB1      LYS  33  17.078   0.331   1.522
  988   1HG   LYS  33           HG2      LYS  33  15.593   2.536   2.740
  989   2HG   LYS  33           HG1      LYS  33  16.876   1.930   3.788
  990   1HD   LYS  33           HD2      LYS  33  17.716   2.149   0.994
  991   2HD   LYS  33           HD1      LYS  33  17.224   3.699   1.682
  992   1HE   LYS  33           HE2      LYS  33  18.751   3.384   3.565
  993   2HE   LYS  33           HE1      LYS  33  19.200   1.789   2.961
  994   1HZ   LYS  33           HZ1      LYS  33  19.925   2.943   0.881
  995   2HZ   LYS  33           HZ3      LYS  33  19.723   4.417   1.696
  996   3HZ   LYS  33           HZ2      LYS  33  20.861   3.286   2.257
  997    H    GLU  34           HN       GLU  34  15.927  -0.754  -0.436
  998    HA   GLU  34           HA       GLU  34  16.218   1.479  -2.254
  999   1HB   GLU  34           HB2      GLU  34  17.162  -0.083  -3.738
 1000   2HB   GLU  34           HB1      GLU  34  17.486  -0.822  -2.174
 1001   1HG   GLU  34           HG2      GLU  34  15.676  -2.356  -2.406
 1002   2HG   GLU  34           HG1      GLU  34  15.034  -1.497  -3.801
 1003    H    LEU  35           HN       LEU  35  13.936  -1.164  -1.854
 1004    HA   LEU  35           HA       LEU  35  12.287  -0.901  -4.078
 1005   1HB   LEU  35           HB2      LEU  35  12.131  -2.240  -1.681
 1006   2HB   LEU  35           HB1      LEU  35  10.804  -1.085  -1.533
 1007    HG   LEU  35           HG       LEU  35  10.109  -3.243  -2.592
 1008   1HD1  LEU  35          HD13      LEU  35   9.400  -0.680  -3.258
 1009   2HD1  LEU  35          HD12      LEU  35   9.838  -1.345  -4.832
 1010   3HD1  LEU  35          HD11      LEU  35   8.591  -2.126  -3.862
 1011   1HD2  LEU  35          HD21      LEU  35  12.505  -2.789  -4.077
 1012   2HD2  LEU  35          HD23      LEU  35  11.409  -4.165  -4.183
 1013   3HD2  LEU  35          HD22      LEU  35  11.157  -2.756  -5.212
 1014    H    ILE  36           HN       ILE  36  12.271   1.094  -1.123
 1015    HA   ILE  36           HA       ILE  36  10.106   2.787  -2.115
 1016    HB   ILE  36           HB       ILE  36  11.905   3.735   0.063
 1017   1HG1  ILE  36          HG12      ILE  36  10.258   1.203   0.175
 1018   2HG1  ILE  36          HG11      ILE  36  11.922   1.449   0.692
 1019   1HG2  ILE  36          HG23      ILE  36   9.650   4.720  -0.791
 1020   2HG2  ILE  36          HG22      ILE  36   8.915   3.400   0.118
 1021   3HG2  ILE  36          HG21      ILE  36   9.908   4.598   0.949
 1022   1HD1  ILE  36          HD13      ILE  36  10.631   3.288   2.241
 1023   2HD1  ILE  36          HD12      ILE  36   9.407   2.024   2.129
 1024   3HD1  ILE  36          HD11      ILE  36  11.007   1.648   2.766
 1025    H    ASN  37           HN       ASN  37  13.517   3.502  -1.278
 1026    HA   ASN  37           HA       ASN  37  13.522   6.010  -2.676
 1027   1HB   ASN  37           HB2      ASN  37  15.119   5.364  -0.852
 1028   2HB   ASN  37           HB1      ASN  37  15.904   4.268  -1.990
 1029   1HD2  ASN  37          HD22      ASN  37  17.118   8.021  -1.988
 1030   2HD2  ASN  37          HD21      ASN  37  16.384   7.220  -0.684
 1031    H    ASN  38           HN       ASN  38  15.326   3.031  -3.511
 1032    HA   ASN  38           HA       ASN  38  16.202   3.668  -6.032
 1033   1HB   ASN  38           HB2      ASN  38  16.450   1.444  -4.804
 1034   2HB   ASN  38           HB1      ASN  38  14.885   1.004  -5.488
 1035   1HD2  ASN  38          HD22      ASN  38  16.174   0.379  -8.709
 1036   2HD2  ASN  38          HD21      ASN  38  14.807   0.416  -7.707
 1037    H    GLU  39           HN       GLU  39  12.943   2.310  -5.376
 1038    HA   GLU  39           HA       GLU  39  12.153   2.765  -8.153
 1039   1HB   GLU  39           HB2      GLU  39  10.454   1.988  -5.769
 1040   2HB   GLU  39           HB1      GLU  39   9.983   1.880  -7.464
 1041   1HG   GLU  39           HG2      GLU  39  12.527   0.542  -6.694
 1042   2HG   GLU  39           HG1      GLU  39  11.033  -0.207  -6.135
 1043    H    LEU  40           HN       LEU  40  10.153   3.763  -5.385
 1044    HA   LEU  40           HA       LEU  40   8.942   5.930  -6.601
 1045   1HB   LEU  40           HB2      LEU  40   9.764   5.692  -3.693
 1046   2HB   LEU  40           HB1      LEU  40   8.564   6.814  -4.320
 1047    HG   LEU  40           HG       LEU  40   8.434   3.798  -4.279
 1048   1HD1  LEU  40          HD11      LEU  40   7.067   6.061  -2.915
 1049   2HD1  LEU  40          HD13      LEU  40   6.051   4.698  -3.386
 1050   3HD1  LEU  40          HD12      LEU  40   7.432   4.442  -2.320
 1051   1HD2  LEU  40          HD21      LEU  40   6.896   5.803  -5.927
 1052   2HD2  LEU  40          HD23      LEU  40   7.628   4.284  -6.445
 1053   3HD2  LEU  40          HD22      LEU  40   6.167   4.266  -5.457
 1054    H    SER  41           HN       SER  41  11.161   6.857  -4.022
 1055    HA   SER  41           HA       SER  41  12.577   8.746  -3.938
 1056   1HB   SER  41           HB2      SER  41  13.420   6.982  -6.154
 1057   2HB   SER  41           HB1      SER  41  14.054   8.622  -6.232
 1058    HG   SER  41           HG       SER  41  14.108   7.444  -3.733
 1059    H    HIS  42           HN       HIS  42  10.240   9.783  -4.587
 1060    HA   HIS  42           HA       HIS  42  10.892  11.694  -6.770
 1061   1HB   HIS  42           HB2      HIS  42   9.143   9.645  -7.236
 1062   2HB   HIS  42           HB1      HIS  42   8.051  10.895  -6.639
 1063    HD1  HIS  42           HD1      HIS  42   7.269  10.763  -9.290
 1064    HD2  HIS  42           HD2      HIS  42  10.948  12.544  -8.480
 1065    HE1  HIS  42           HE1      HIS  42   7.873  12.123 -11.338
 1066    H    PHE  43           HN       PHE  43   8.111  11.031  -4.608
 1067    HA   PHE  43           HA       PHE  43   7.590  13.796  -4.096
 1068   1HB   PHE  43           HB2      PHE  43   6.939  11.459  -2.279
 1069   2HB   PHE  43           HB1      PHE  43   6.120  13.019  -2.334
 1070    HD1  PHE  43           HD2      PHE  43   5.057  13.710  -4.603
 1071    HD2  PHE  43           HD1      PHE  43   6.182   9.684  -3.618
 1072    HE1  PHE  43           HE2      PHE  43   3.543  12.854  -6.369
 1073    HE2  PHE  43           HE1      PHE  43   4.668   8.827  -5.383
 1074    HZ   PHE  43           HZ       PHE  43   3.347  10.412  -6.760
 1075    H    LEU  44           HN       LEU  44  10.087  11.763  -2.993
 1076    HA   LEU  44           HA       LEU  44  10.510  12.785  -0.361
 1077   1HB   LEU  44           HB2      LEU  44  11.909  11.097  -2.231
 1078   2HB   LEU  44           HB1      LEU  44  13.039  12.246  -1.512
 1079    HG   LEU  44           HG       LEU  44  12.816  10.156  -0.167
 1080   1HD1  LEU  44          HD11      LEU  44  11.773  12.716   1.081
 1081   2HD1  LEU  44          HD13      LEU  44  12.332  11.320   2.002
 1082   3HD1  LEU  44          HD12      LEU  44  13.458  12.205   0.973
 1083   1HD2  LEU  44          HD21      LEU  44  10.377   9.837  -0.769
 1084   2HD2  LEU  44          HD23      LEU  44  10.737   9.645   0.947
 1085   3HD2  LEU  44          HD22      LEU  44   9.998  11.135   0.364
 1086    H    GLU  45           HN       GLU  45  10.166  15.077  -0.492
 1087    HA   GLU  45           HA       GLU  45  12.511  16.539  -1.606
 1088   1HB   GLU  45           HB2      GLU  45   9.627  17.455  -1.784
 1089   2HB   GLU  45           HB1      GLU  45  11.035  18.341  -2.371
 1090   1HG   GLU  45           HG2      GLU  45  11.293  15.816  -3.531
 1091   2HG   GLU  45           HG1      GLU  45   9.567  16.165  -3.638
 1092    H    GLU  46           HN       GLU  46   9.573  17.059   0.345
 1093    HA   GLU  46           HA       GLU  46  11.287  18.510   2.322
 1094   1HB   GLU  46           HB2      GLU  46   8.383  18.896   1.550
 1095   2HB   GLU  46           HB1      GLU  46   9.089  19.612   2.999
 1096   1HG   GLU  46           HG2      GLU  46  10.667  20.881   1.707
 1097   2HG   GLU  46           HG1      GLU  46  10.249  20.008   0.232
 1098    H    ILE  47           HN       ILE  47   8.647  16.206   1.860
 1099    HA   ILE  47           HA       ILE  47   7.790  14.561   3.276
 1100    HB   ILE  47           HB       ILE  47  10.572  14.529   3.525
 1101   1HG1  ILE  47          HG12      ILE  47   9.337  12.352   4.963
 1102   2HG1  ILE  47          HG11      ILE  47   8.382  12.760   3.539
 1103   1HG2  ILE  47          HG23      ILE  47  10.406  15.596   5.750
 1104   2HG2  ILE  47          HG22      ILE  47   9.312  14.317   6.276
 1105   3HG2  ILE  47          HG21      ILE  47  10.986  13.935   5.876
 1106   1HD1  ILE  47          HD13      ILE  47  11.350  12.615   3.231
 1107   2HD1  ILE  47          HD12      ILE  47  10.462  11.099   3.373
 1108   3HD1  ILE  47          HD11      ILE  47  10.083  12.224   2.070
 1109    H    LYS  48           HN       LYS  48   6.168  14.953   4.692
 1110    HA   LYS  48           HA       LYS  48   6.570  17.100   6.721
 1111   1HB   LYS  48           HB2      LYS  48   4.584  17.017   4.996
 1112   2HB   LYS  48           HB1      LYS  48   3.906  15.849   6.129
 1113   1HG   LYS  48           HG2      LYS  48   5.009  18.342   7.313
 1114   2HG   LYS  48           HG1      LYS  48   3.520  18.509   6.383
 1115   1HD   LYS  48           HD2      LYS  48   3.820  16.354   8.470
 1116   2HD   LYS  48           HD1      LYS  48   3.300  17.983   8.907
 1117   1HE   LYS  48           HE2      LYS  48   1.963  16.358   6.732
 1118   2HE   LYS  48           HE1      LYS  48   1.420  16.348   8.409
 1119   1HZ   LYS  48           HZ3      LYS  48   1.805  19.005   7.567
 1120   2HZ   LYS  48           HZ2      LYS  48   0.816  18.208   6.439
 1121   3HZ   LYS  48           HZ1      LYS  48   0.374  18.252   8.078
 1122    H    GLU  49           HN       GLU  49   6.111  13.692   6.338
 1123    HA   GLU  49           HA       GLU  49   5.556  13.397   9.251
 1124   1HB   GLU  49           HB2      GLU  49   4.990  11.751   6.836
 1125   2HB   GLU  49           HB1      GLU  49   5.388  10.874   8.311
 1126   1HG   GLU  49           HG2      GLU  49   3.316  13.076   8.232
 1127   2HG   GLU  49           HG1      GLU  49   2.914  11.377   7.977
 1128    H    GLN  50           HN       GLN  50   7.990  14.153   9.261
 1129    HA   GLN  50           HA       GLN  50  10.104  12.513   8.413
 1130   1HB   GLN  50           HB2      GLN  50  10.623  14.640   9.389
 1131   2HB   GLN  50           HB1      GLN  50   9.807  14.220  10.895
 1132   1HG   GLN  50           HG2      GLN  50  11.885  12.292  10.169
 1133   2HG   GLN  50           HG1      GLN  50  12.521  13.922  10.394
 1134   1HE2  GLN  50          HE22      GLN  50  11.858  13.992  13.889
 1135   2HE2  GLN  50          HE21      GLN  50  12.242  14.928  12.528
 1136    H    GLU  51           HN       GLU  51   7.751  11.933  10.894
 1137    HA   GLU  51           HA       GLU  51   9.338   9.903  12.273
 1138   1HB   GLU  51           HB2      GLU  51   6.841  11.269  12.702
 1139   2HB   GLU  51           HB1      GLU  51   6.580   9.529  12.818
 1140   1HG   GLU  51           HG2      GLU  51   8.993   9.959  14.163
 1141   2HG   GLU  51           HG1      GLU  51   7.966  11.305  14.661
 1142    H    VAL  52           HN       VAL  52   6.794   9.947   9.804
 1143    HA   VAL  52           HA       VAL  52   6.417   7.094   9.737
 1144    HB   VAL  52           HB       VAL  52   5.927   9.212   7.622
 1145   1HG1  VAL  52          HG11      VAL  52   5.639   6.272   7.627
 1146   2HG1  VAL  52          HG13      VAL  52   4.209   7.153   7.090
 1147   3HG1  VAL  52          HG12      VAL  52   5.752   7.389   6.268
 1148   1HG2  VAL  52          HG21      VAL  52   4.694   9.038   9.992
 1149   2HG2  VAL  52          HG23      VAL  52   3.815   9.456   8.522
 1150   3HG2  VAL  52          HG22      VAL  52   3.773   7.802   9.134
 1151    H    VAL  53           HN       VAL  53   8.390   9.300   7.733
 1152    HA   VAL  53           HA       VAL  53   9.556   7.108   6.223
 1153    HB   VAL  53           HB       VAL  53  10.457   9.988   6.553
 1154   1HG1  VAL  53          HG12      VAL  53  12.230   8.367   5.786
 1155   2HG1  VAL  53          HG11      VAL  53  11.199   7.977   4.410
 1156   3HG1  VAL  53          HG13      VAL  53  11.834   9.611   4.600
 1157   1HG2  VAL  53          HG21      VAL  53   8.252   8.801   5.172
 1158   2HG2  VAL  53          HG23      VAL  53   8.762  10.488   5.159
 1159   3HG2  VAL  53          HG22      VAL  53   9.412   9.361   3.968
 1160    H    ASP  54           HN       ASP  54  10.459   8.960   9.083
 1161    HA   ASP  54           HA       ASP  54  13.113   7.789   9.268
 1162   1HB   ASP  54           HB2      ASP  54  12.549   9.975  10.316
 1163   2HB   ASP  54           HB1      ASP  54  11.443   9.144  11.411
 1164    H    LYS  55           HN       LYS  55   9.925   6.756  10.037
 1165    HA   LYS  55           HA       LYS  55  10.722   4.898  12.148
 1166   1HB   LYS  55           HB2      LYS  55   8.226   5.721  10.833
 1167   2HB   LYS  55           HB1      LYS  55   8.287   4.000  11.208
 1168   1HG   LYS  55           HG2      LYS  55   8.493   4.367  13.503
 1169   2HG   LYS  55           HG1      LYS  55   9.137   5.993  13.287
 1170   1HD   LYS  55           HD2      LYS  55   6.958   6.456  13.972
 1171   2HD   LYS  55           HD1      LYS  55   6.779   6.472  12.218
 1172   1HE   LYS  55           HE2      LYS  55   5.533   4.566  12.200
 1173   2HE   LYS  55           HE1      LYS  55   6.495   3.810  13.470
 1174   1HZ   LYS  55           HZ2      LYS  55   4.915   6.096  14.295
 1175   2HZ   LYS  55           HZ1      LYS  55   4.018   4.731  13.826
 1176   3HZ   LYS  55           HZ3      LYS  55   5.162   4.605  15.071
 1177    H    VAL  56           HN       VAL  56   9.736   4.571   8.715
 1178    HA   VAL  56           HA       VAL  56  10.309   1.728   8.675
 1179    HB   VAL  56           HB       VAL  56  10.253   2.160   6.128
 1180   1HG1  VAL  56          HG13      VAL  56   8.282   1.745   8.008
 1181   2HG1  VAL  56          HG12      VAL  56   7.696   3.173   7.158
 1182   3HG1  VAL  56          HG11      VAL  56   8.038   1.694   6.263
 1183   1HG2  VAL  56          HG21      VAL  56  10.453   4.813   7.016
 1184   2HG2  VAL  56          HG23      VAL  56  10.099   4.278   5.375
 1185   3HG2  VAL  56          HG22      VAL  56   8.781   4.635   6.492
 1186    H    MET  57           HN       MET  57  12.079   4.658   7.856
 1187    HA   MET  57           HA       MET  57  14.346   3.285   6.684
 1188   1HB   MET  57           HB2      MET  57  13.665   5.745   6.371
 1189   2HB   MET  57           HB1      MET  57  14.372   6.029   7.962
 1190   1HG   MET  57           HG2      MET  57  16.001   6.477   6.155
 1191   2HG   MET  57           HG1      MET  57  16.525   5.144   7.180
 1192   1HE   MET  57           HE3      MET  57  14.651   6.328   4.316
 1193   2HE   MET  57           HE2      MET  57  15.085   5.314   2.943
 1194   3HE   MET  57           HE1      MET  57  13.743   4.848   3.981
 1195    H    GLU  58           HN       GLU  58  13.344   4.123   9.930
 1196    HA   GLU  58           HA       GLU  58  15.981   3.770  11.116
 1197   1HB   GLU  58           HB2      GLU  58  13.213   4.215  12.096
 1198   2HB   GLU  58           HB1      GLU  58  14.279   3.337  13.190
 1199   1HG   GLU  58           HG2      GLU  58  15.980   5.273  12.506
 1200   2HG   GLU  58           HG1      GLU  58  14.480   6.151  12.207
 1201    H    THR  59           HN       THR  59  13.021   1.751  10.956
 1202    HA   THR  59           HA       THR  59  14.240  -0.540  12.200
 1203    HB   THR  59           HB       THR  59  12.045  -0.720  10.136
 1204    HG1  THR  59           HG1      THR  59  10.647  -0.250  11.953
 1205   1HG2  THR  59          HG23      THR  59  12.945  -2.255  12.551
 1206   2HG2  THR  59          HG22      THR  59  11.257  -2.337  12.048
 1207   3HG2  THR  59          HG21      THR  59  12.531  -2.851  10.944
 1208    H    LEU  60           HN       LEU  60  14.284   0.800   9.006
 1209    HA   LEU  60           HA       LEU  60  15.173  -1.529   7.569
 1210   1HB   LEU  60           HB2      LEU  60  15.038   1.412   7.109
 1211   2HB   LEU  60           HB1      LEU  60  16.177   0.511   6.113
 1212    HG   LEU  60           HG       LEU  60  13.242  -0.163   6.445
 1213   1HD1  LEU  60          HD12      LEU  60  14.798   1.292   4.306
 1214   2HD1  LEU  60          HD11      LEU  60  13.267   0.494   3.949
 1215   3HD1  LEU  60          HD13      LEU  60  13.324   1.805   5.127
 1216   1HD2  LEU  60          HD22      LEU  60  15.528  -1.631   5.434
 1217   2HD2  LEU  60          HD21      LEU  60  13.863  -2.175   5.635
 1218   3HD2  LEU  60          HD23      LEU  60  14.353  -1.362   4.148
 1219    H    ASP  61           HN       ASP  61  16.944   1.306   8.821
 1220    HA   ASP  61           HA       ASP  61  19.534   0.044   8.349
 1221   1HB   ASP  61           HB2      ASP  61  18.703   2.641   8.577
 1222   2HB   ASP  61           HB1      ASP  61  19.395   2.365  10.174
 1223    H    GLU  62           HN       GLU  62  17.193  -0.262  10.749
 1224    HA   GLU  62           HA       GLU  62  19.025  -0.566  13.007
 1225   1HB   GLU  62           HB2      GLU  62  16.640   0.165  13.271
 1226   2HB   GLU  62           HB1      GLU  62  16.138  -1.454  12.783
 1227   1HG   GLU  62           HG2      GLU  62  17.588  -2.351  14.665
 1228   2HG   GLU  62           HG1      GLU  62  17.755  -0.684  15.220
 1229    H    ASP  63           HN       ASP  63  17.153  -2.744  10.915
 1230    HA   ASP  63           HA       ASP  63  18.292  -5.124  12.179
 1231   1HB   ASP  63           HB2      ASP  63  16.203  -4.524  10.226
 1232   2HB   ASP  63           HB1      ASP  63  17.171  -5.925   9.767
 1233    H    GLY  64           HN       GLY  64  18.255  -4.267   8.731
 1234   1HA   GLY  64           HA2      GLY  64  19.944  -4.404   7.107
 1235   2HA   GLY  64           HA1      GLY  64  21.094  -4.131   8.414
 1236    H    ASP  65           HN       ASP  65  19.094  -6.790   9.040
 1237    HA   ASP  65           HA       ASP  65  20.940  -8.721   7.758
 1238   1HB   ASP  65           HB2      ASP  65  21.551  -7.991  10.206
 1239   2HB   ASP  65           HB1      ASP  65  20.228  -9.069  10.640
 1240    H    GLY  66           HN       GLY  66  17.875  -8.061   9.389
 1241   1HA   GLY  66           HA2      GLY  66  16.936 -10.804   8.924
 1242   2HA   GLY  66           HA1      GLY  66  16.026  -9.523   9.718
 1243    H    GLU  67           HN       GLU  67  14.729 -11.050   7.894
 1244    HA   GLU  67           HA       GLU  67  14.706  -9.521   5.349
 1245   1HB   GLU  67           HB2      GLU  67  13.222 -11.398   4.571
 1246   2HB   GLU  67           HB1      GLU  67  14.832 -11.923   5.066
 1247   1HG   GLU  67           HG2      GLU  67  13.978 -12.608   7.248
 1248   2HG   GLU  67           HG1      GLU  67  12.377 -11.992   6.843
 1249    H    CYS  68           HN       CYS  68  12.447  -9.151   4.427
 1250    HA   CYS  68           HA       CYS  68  10.629  -8.240   6.626
 1251   1HB   CYS  68           HB2      CYS  68  11.236  -7.110   3.895
 1252   2HB   CYS  68           HB1      CYS  68   9.755  -6.683   4.754
 1253    HG   CYS  68           HG       CYS  68  11.356  -4.945   5.664
 1254    H    ASP  69           HN       ASP  69   8.275  -8.263   5.986
 1255    HA   ASP  69           HA       ASP  69   7.711 -10.785   4.517
 1256   1HB   ASP  69           HB2      ASP  69   5.938  -9.074   6.290
 1257   2HB   ASP  69           HB1      ASP  69   5.468 -10.609   5.560
 1258    H    PHE  70           HN       PHE  70   5.378 -10.567   3.391
 1259    HA   PHE  70           HA       PHE  70   5.759  -8.518   1.322
 1260   1HB   PHE  70           HB2      PHE  70   3.286  -9.638   0.788
 1261   2HB   PHE  70           HB1      PHE  70   4.817 -10.201   0.127
 1262    HD1  PHE  70           HD2      PHE  70   6.072 -12.046   1.302
 1263    HD2  PHE  70           HD1      PHE  70   2.059 -10.942   2.360
 1264    HE1  PHE  70           HE2      PHE  70   5.790 -14.209   2.481
 1265    HE2  PHE  70           HE1      PHE  70   1.776 -13.105   3.539
 1266    HZ   PHE  70           HZ       PHE  70   3.641 -14.738   3.598
 1267    H    GLN  71           HN       GLN  71   3.617  -9.115   4.047
 1268    HA   GLN  71           HA       GLN  71   1.884  -6.844   3.398
 1269   1HB   GLN  71           HB2      GLN  71   2.152  -8.385   6.000
 1270   2HB   GLN  71           HB1      GLN  71   0.822  -7.319   5.547
 1271   1HG   GLN  71           HG2      GLN  71   0.574  -8.875   3.479
 1272   2HG   GLN  71           HG1      GLN  71   1.540 -10.016   4.413
 1273   1HE2  GLN  71          HE22      GLN  71  -2.016  -8.916   6.169
 1274   2HE2  GLN  71          HE21      GLN  71  -1.050  -7.723   5.447
 1275    H    GLU  72           HN       GLU  72   4.797  -7.448   5.239
 1276    HA   GLU  72           HA       GLU  72   4.682  -4.977   6.768
 1277   1HB   GLU  72           HB2      GLU  72   6.629  -7.177   6.327
 1278   2HB   GLU  72           HB1      GLU  72   7.322  -5.613   6.752
 1279   1HG   GLU  72           HG2      GLU  72   5.042  -6.071   8.424
 1280   2HG   GLU  72           HG1      GLU  72   6.074  -7.500   8.483
 1281    H    PHE  73           HN       PHE  73   6.630  -6.036   3.958
 1282    HA   PHE  73           HA       PHE  73   7.738  -3.449   3.436
 1283   1HB   PHE  73           HB2      PHE  73   8.906  -4.646   1.911
 1284   2HB   PHE  73           HB1      PHE  73   7.955  -6.053   2.361
 1285    HD1  PHE  73           HD1      PHE  73   5.842  -6.583   1.107
 1286    HD2  PHE  73           HD2      PHE  73   8.575  -3.531  -0.179
 1287    HE1  PHE  73           HE1      PHE  73   4.804  -6.602  -1.144
 1288    HE2  PHE  73           HE2      PHE  73   7.538  -3.550  -2.430
 1289    HZ   PHE  73           HZ       PHE  73   5.652  -5.086  -2.912
 1290    H    MET  74           HN       MET  74   4.661  -4.888   2.768
 1291    HA   MET  74           HA       MET  74   3.861  -3.093   0.644
 1292   1HB   MET  74           HB2      MET  74   2.637  -5.206   2.290
 1293   2HB   MET  74           HB1      MET  74   1.520  -3.921   1.839
 1294   1HG   MET  74           HG2      MET  74   3.264  -4.817  -0.358
 1295   2HG   MET  74           HG1      MET  74   2.168  -6.061   0.240
 1296   1HE   MET  74           HE3      MET  74   2.973  -3.044  -1.303
 1297   2HE   MET  74           HE2      MET  74   1.984  -3.400  -2.718
 1298   3HE   MET  74           HE1      MET  74   1.528  -2.081  -1.642
 1299    H    ALA  75           HN       ALA  75   3.128  -3.198   4.147
 1300    HA   ALA  75           HA       ALA  75   1.730  -0.661   4.090
 1301   1HB   ALA  75           HB2      ALA  75   2.688  -2.543   6.206
 1302   2HB   ALA  75           HB1      ALA  75   2.320  -0.885   6.681
 1303   3HB   ALA  75           HB3      ALA  75   1.074  -1.887   5.939
 1304    H    PHE  76           HN       PHE  76   5.028  -1.583   4.116
 1305    HA   PHE  76           HA       PHE  76   6.029   0.839   5.409
 1306   1HB   PHE  76           HB2      PHE  76   7.150  -1.630   4.286
 1307   2HB   PHE  76           HB1      PHE  76   8.126  -0.205   3.931
 1308    HD1  PHE  76           HD1      PHE  76   5.994  -1.116   6.875
 1309    HD2  PHE  76           HD2      PHE  76   9.917  -0.127   5.435
 1310    HE1  PHE  76           HE1      PHE  76   6.847  -1.114   9.202
 1311    HE2  PHE  76           HE2      PHE  76  10.771  -0.127   7.763
 1312    HZ   PHE  76           HZ       PHE  76   9.236  -0.621   9.646
 1313    H    VAL  77           HN       VAL  77   5.426  -0.274   2.114
 1314    HA   VAL  77           HA       VAL  77   6.757   1.960   0.828
 1315    HB   VAL  77           HB       VAL  77   4.634   0.029  -0.148
 1316   1HG1  VAL  77          HG13      VAL  77   5.527   2.484  -1.289
 1317   2HG1  VAL  77          HG12      VAL  77   6.224   1.173  -2.242
 1318   3HG1  VAL  77          HG11      VAL  77   4.477   1.268  -2.018
 1319   1HG2  VAL  77          HG22      VAL  77   7.023  -0.744   0.531
 1320   2HG2  VAL  77          HG21      VAL  77   6.412  -1.231  -1.049
 1321   3HG2  VAL  77          HG23      VAL  77   7.549   0.111  -0.918
 1322    H    SER  78           HN       SER  78   3.595   1.422   2.205
 1323    HA   SER  78           HA       SER  78   2.334   3.672   0.854
 1324   1HB   SER  78           HB2      SER  78   1.291   2.594   3.438
 1325   2HB   SER  78           HB1      SER  78   0.411   3.071   1.990
 1326    HG   SER  78           HG       SER  78   0.815   1.163   1.100
 1327    H    MET  79           HN       MET  79   3.598   3.148   4.150
 1328    HA   MET  79           HA       MET  79   2.941   5.683   5.215
 1329   1HB   MET  79           HB2      MET  79   5.618   4.848   6.052
 1330   2HB   MET  79           HB1      MET  79   4.161   5.059   7.014
 1331   1HG   MET  79           HG2      MET  79   3.363   2.833   6.239
 1332   2HG   MET  79           HG1      MET  79   4.876   2.622   5.358
 1333   1HE   MET  79           HE1      MET  79   3.286   3.406   8.813
 1334   2HE   MET  79           HE3      MET  79   3.027   1.724   8.332
 1335   3HE   MET  79           HE2      MET  79   3.999   2.099   9.752
 1336    H    VAL  80           HN       VAL  80   5.989   4.731   3.608
 1337    HA   VAL  80           HA       VAL  80   7.103   7.358   3.618
 1338    HB   VAL  80           HB       VAL  80   8.588   6.423   1.811
 1339   1HG1  VAL  80          HG13      VAL  80   8.113   5.141   4.470
 1340   2HG1  VAL  80          HG12      VAL  80   9.300   4.411   3.389
 1341   3HG1  VAL  80          HG11      VAL  80   9.496   6.083   3.917
 1342   1HG2  VAL  80          HG23      VAL  80   6.451   4.397   1.848
 1343   2HG2  VAL  80          HG22      VAL  80   7.605   4.787   0.575
 1344   3HG2  VAL  80          HG21      VAL  80   8.079   3.722   1.898
 1345    H    THR  81           HN       THR  81   5.246   5.612   1.108
 1346    HA   THR  81           HA       THR  81   5.434   7.767  -0.801
 1347    HB   THR  81           HB       THR  81   3.253   5.677  -0.683
 1348    HG1  THR  81           HG1      THR  81   4.770   4.503  -2.038
 1349   1HG2  THR  81          HG22      THR  81   3.267   7.683  -2.328
 1350   2HG2  THR  81          HG21      THR  81   4.600   6.836  -3.111
 1351   3HG2  THR  81          HG23      THR  81   3.018   6.067  -2.990
 1352    H    THR  82           HN       THR  82   3.815   7.621   2.118
 1353    HA   THR  82           HA       THR  82   1.882   9.694   1.171
 1354    HB   THR  82           HB       THR  82   0.250   8.862   2.803
 1355    HG1  THR  82           HG1      THR  82   0.759   6.851   3.839
 1356   1HG2  THR  82          HG21      THR  82   0.537   7.863   0.435
 1357   2HG2  THR  82          HG23      THR  82   1.227   6.465   1.257
 1358   3HG2  THR  82          HG22      THR  82  -0.433   6.955   1.593
 1359    H    ALA  83           HN       ALA  83   4.623   9.371   2.795
 1360    HA   ALA  83           HA       ALA  83   3.948  10.761   5.283
 1361   1HB   ALA  83           HB2      ALA  83   6.434   9.734   3.982
 1362   2HB   ALA  83           HB1      ALA  83   6.610  11.036   5.158
 1363   3HB   ALA  83           HB3      ALA  83   5.860   9.515   5.635
 1364    H    CYS  84           HN       CYS  84   4.555  11.644   2.033
 1365    HA   CYS  84           HA       CYS  84   5.483  14.362   2.718
 1366   1HB   CYS  84           HB2      CYS  84   4.861  13.008   0.078
 1367   2HB   CYS  84           HB1      CYS  84   5.419  14.675   0.219
 1368    HG   CYS  84           HG       CYS  84   7.710  13.763   0.358
 1369    H    HIS  85           HN       HIS  85   4.187  16.054   1.112
 1370    HA   HIS  85           HA       HIS  85   1.284  15.643   1.700
 1371   1HB   HIS  85           HB2      HIS  85   1.050  17.863   2.454
 1372   2HB   HIS  85           HB1      HIS  85   2.574  17.349   3.173
 1373    HD1  HIS  85           HD1      HIS  85   4.687  17.830   1.250
 1374    HD2  HIS  85           HD2      HIS  85   1.377  20.362   1.358
 1375    HE1  HIS  85           HE1      HIS  85   5.399  19.990   0.135
 1376    H    GLU  86           HN       GLU  86   3.588  16.072  -0.674
 1377    HA   GLU  86           HA       GLU  86   1.685  17.483  -2.486
 1378   1HB   GLU  86           HB2      GLU  86   3.815  17.474  -3.997
 1379   2HB   GLU  86           HB1      GLU  86   3.749  18.587  -2.630
 1380   1HG   GLU  86           HG2      GLU  86   5.141  17.194  -1.293
 1381   2HG   GLU  86           HG1      GLU  86   4.956  15.825  -2.394
 1382    H    PHE  87           HN       PHE  87   0.571  15.206  -2.312
 1383    HA   PHE  87           HA       PHE  87   1.754  13.439  -4.416
 1384   1HB   PHE  87           HB2      PHE  87   0.109  11.718  -3.305
 1385   2HB   PHE  87           HB1      PHE  87   1.665  12.050  -2.550
 1386    HD1  PHE  87           HD1      PHE  87  -1.491  14.079  -2.598
 1387    HD2  PHE  87           HD2      PHE  87   1.335  11.868  -0.239
 1388    HE1  PHE  87           HE1      PHE  87  -2.647  14.809  -0.532
 1389    HE2  PHE  87           HE2      PHE  87   0.173  12.599   1.827
 1390    HZ   PHE  87           HZ       PHE  87  -1.817  14.071   1.678
 1391    H    PHE  88           HN       PHE  88  -0.628  15.685  -3.894
 1392    HA   PHE  88           HA       PHE  88  -2.359  14.435  -5.990
 1393   1HB   PHE  88           HB2      PHE  88  -3.212  16.146  -3.634
 1394   2HB   PHE  88           HB1      PHE  88  -4.280  15.623  -4.934
 1395    HD1  PHE  88           HD1      PHE  88  -3.246  12.847  -5.390
 1396    HD2  PHE  88           HD2      PHE  88  -4.061  14.985  -1.754
 1397    HE1  PHE  88           HE1      PHE  88  -3.625  10.699  -4.207
 1398    HE2  PHE  88           HE2      PHE  88  -4.437  12.837  -0.577
 1399    HZ   PHE  88           HZ       PHE  88  -4.218  10.695  -1.805
 1400    H    GLU  89           HN       GLU  89  -0.152  16.150  -6.543
 1401    HA   GLU  89           HA       GLU  89  -1.631  18.474  -7.673
 1402   1HB   GLU  89           HB2      GLU  89   0.586  18.537  -5.733
 1403   2HB   GLU  89           HB1      GLU  89   0.831  19.563  -7.146
 1404   1HG   GLU  89           HG2      GLU  89  -0.372  21.033  -5.836
 1405   2HG   GLU  89           HG1      GLU  89  -1.710  20.217  -6.644
 1406    H    HIS  90           HN       HIS  90   1.851  18.094  -7.753
 1407    HA   HIS  90           HA       HIS  90   2.250  16.510 -10.014
 1408   1HB   HIS  90           HB2      HIS  90   2.460  18.438 -11.754
 1409   2HB   HIS  90           HB1      HIS  90   0.852  17.801 -11.405
 1410    HD1  HIS  90           HD1      HIS  90  -0.849  19.422 -10.504
 1411    HD2  HIS  90           HD2      HIS  90   3.026  20.938 -10.274
 1412    HE1  HIS  90           HE1      HIS  90  -1.065  21.832  -9.750
 1413    H    GLU  91           HN       GLU  91   4.187  16.271  -8.747
 1414    HA   GLU  91           HA       GLU  91   6.428  17.759  -9.615
 1415   1HB   GLU  91           HB2      GLU  91   4.968  19.320  -7.904
 1416   2HB   GLU  91           HB1      GLU  91   6.087  18.540  -6.786
 1417   1HG   GLU  91           HG2      GLU  91   7.877  19.166  -8.618
 1418   2HG   GLU  91           HG1      GLU  91   6.676  20.370  -9.086
   
  No H/Q in entry =        1418
  Start of MODEL   13
    1   1H    MET   0           HT3      MET   0   6.612   4.687 -14.628
    2   2H    MET   0           HT2      MET   0   6.536   5.470 -16.134
    3   3H    MET   0           HT1      MET   0   6.715   3.781 -16.059
    4    HA   MET   0           HA       MET   0   8.818   4.810 -16.613
    5   1HB   MET   0           HB2      MET   0   8.054   6.918 -15.208
    6   2HB   MET   0           HB1      MET   0   8.876   6.076 -13.893
    7   1HG   MET   0           HG2      MET   0  10.960   6.123 -15.004
    8   2HG   MET   0           HG1      MET   0  10.217   6.458 -16.568
    9   1HE   MET   0           HE3      MET   0  12.697   7.981 -15.413
   10   2HE   MET   0           HE2      MET   0  12.392   9.385 -14.392
   11   3HE   MET   0           HE1      MET   0  12.130   7.765 -13.751
   12    H    SER   1           HN       SER   1   7.879   4.039 -13.241
   13    HA   SER   1           HA       SER   1   9.957   1.883 -13.314
   14   1HB   SER   1           HB2      SER   1  10.827   3.247 -11.660
   15   2HB   SER   1           HB1      SER   1   9.248   3.887 -11.209
   16    HG   SER   1           HG       SER   1  10.549   1.551 -10.415
   17    H    GLU   2           HN       GLU   2   9.405   0.090 -11.689
   18    HA   GLU   2           HA       GLU   2   6.653  -0.772 -12.192
   19   1HB   GLU   2           HB2      GLU   2   9.033  -2.101 -11.844
   20   2HB   GLU   2           HB1      GLU   2   8.258  -2.333 -10.276
   21   1HG   GLU   2           HG2      GLU   2   7.435  -4.141 -11.529
   22   2HG   GLU   2           HG1      GLU   2   6.145  -2.945 -11.675
   23    H    LEU   3           HN       LEU   3   8.562   0.323  -9.418
   24    HA   LEU   3           HA       LEU   3   6.416  -0.165  -7.502
   25   1HB   LEU   3           HB2      LEU   3   8.956  -0.036  -7.035
   26   2HB   LEU   3           HB1      LEU   3   8.746   1.712  -7.096
   27    HG   LEU   3           HG       LEU   3   7.014   1.567  -5.339
   28   1HD1  LEU   3          HD13      LEU   3   7.159  -1.227  -6.027
   29   2HD1  LEU   3          HD12      LEU   3   7.486  -1.025  -4.305
   30   3HD1  LEU   3          HD11      LEU   3   5.988  -0.402  -4.998
   31   1HD2  LEU   3          HD23      LEU   3   9.678   1.521  -4.978
   32   2HD2  LEU   3          HD22      LEU   3   8.552   1.495  -3.621
   33   3HD2  LEU   3          HD21      LEU   3   9.277  -0.007  -4.193
   34    H    GLU   4           HN       GLU   4   7.867   2.766  -8.930
   35    HA   GLU   4           HA       GLU   4   6.180   4.684  -7.760
   36   1HB   GLU   4           HB2      GLU   4   8.076   5.396  -9.062
   37   2HB   GLU   4           HB1      GLU   4   7.461   4.598 -10.507
   38   1HG   GLU   4           HG2      GLU   4   5.399   6.173 -10.212
   39   2HG   GLU   4           HG1      GLU   4   6.471   7.111  -9.172
   40    H    LYS   5           HN       LYS   5   5.681   2.995 -10.874
   41    HA   LYS   5           HA       LYS   5   3.192   4.181 -11.507
   42   1HB   LYS   5           HB2      LYS   5   4.795   2.028 -12.494
   43   2HB   LYS   5           HB1      LYS   5   3.134   1.452 -12.350
   44   1HG   LYS   5           HG2      LYS   5   2.332   2.945 -13.911
   45   2HG   LYS   5           HG1      LYS   5   3.552   4.161 -13.529
   46   1HD   LYS   5           HD2      LYS   5   4.666   3.478 -15.368
   47   2HD   LYS   5           HD1      LYS   5   5.016   1.982 -14.500
   48   1HE   LYS   5           HE2      LYS   5   3.975   1.211 -16.461
   49   2HE   LYS   5           HE1      LYS   5   2.648   1.239 -15.299
   50   1HZ   LYS   5           HZ2      LYS   5   3.291   3.397 -17.238
   51   2HZ   LYS   5           HZ1      LYS   5   2.024   2.275 -17.393
   52   3HZ   LYS   5           HZ3      LYS   5   2.003   3.407 -16.129
   53    H    ALA   6           HN       ALA   6   3.913   1.435  -9.391
   54    HA   ALA   6           HA       ALA   6   1.084   0.782  -9.051
   55   1HB   ALA   6           HB3      ALA   6   3.265  -0.718  -8.773
   56   2HB   ALA   6           HB2      ALA   6   3.156  -0.144  -7.109
   57   3HB   ALA   6           HB1      ALA   6   1.810  -1.029  -7.826
   58    H    MET   7           HN       MET   7   3.478   1.625  -6.541
   59    HA   MET   7           HA       MET   7   1.676   2.405  -4.557
   60   1HB   MET   7           HB2      MET   7   3.976   2.247  -3.961
   61   2HB   MET   7           HB1      MET   7   4.460   3.387  -5.218
   62   1HG   MET   7           HG2      MET   7   4.488   4.470  -3.005
   63   2HG   MET   7           HG1      MET   7   3.257   5.195  -4.038
   64   1HE   MET   7           HE1      MET   7   4.078   2.760  -1.179
   65   2HE   MET   7           HE3      MET   7   2.509   2.060  -0.755
   66   3HE   MET   7           HE2      MET   7   3.246   1.702  -2.315
   67    H    VAL   8           HN       VAL   8   3.267   4.559  -6.915
   68    HA   VAL   8           HA       VAL   8   1.831   6.904  -6.157
   69    HB   VAL   8           HB       VAL   8   2.831   6.334  -8.953
   70   1HG1  VAL   8          HG11      VAL   8   2.623   8.824  -7.228
   71   2HG1  VAL   8          HG13      VAL   8   3.368   8.774  -8.826
   72   3HG1  VAL   8          HG12      VAL   8   1.643   8.448  -8.647
   73   1HG2  VAL   8          HG22      VAL   8   4.319   6.065  -6.576
   74   2HG2  VAL   8          HG21      VAL   8   4.964   6.229  -8.206
   75   3HG2  VAL   8          HG23      VAL   8   4.736   7.660  -7.203
   76    H    ALA   9           HN       ALA   9   0.960   4.210  -8.236
   77    HA   ALA   9           HA       ALA   9  -1.226   5.504  -9.600
   78   1HB   ALA   9           HB2      ALA   9  -0.444   2.655  -9.059
   79   2HB   ALA   9           HB1      ALA   9  -2.059   2.998  -9.680
   80   3HB   ALA   9           HB3      ALA   9  -0.637   3.483 -10.604
   81    H    LEU  10           HN       LEU  10  -1.042   3.594  -6.593
   82    HA   LEU  10           HA       LEU  10  -3.774   3.482  -5.957
   83   1HB   LEU  10           HB2      LEU  10  -1.268   3.212  -4.532
   84   2HB   LEU  10           HB1      LEU  10  -2.445   4.069  -3.536
   85    HG   LEU  10           HG       LEU  10  -3.519   1.732  -4.995
   86   1HD1  LEU  10          HD12      LEU  10  -1.050   1.491  -3.552
   87   2HD1  LEU  10          HD11      LEU  10  -2.322   0.681  -2.635
   88   3HD1  LEU  10          HD13      LEU  10  -2.007   0.215  -4.306
   89   1HD2  LEU  10          HD22      LEU  10  -4.116   3.348  -2.727
   90   2HD2  LEU  10          HD21      LEU  10  -5.068   2.018  -3.383
   91   3HD2  LEU  10          HD23      LEU  10  -3.858   1.704  -2.141
   92    H    ILE  11           HN       ILE  11  -1.447   6.116  -5.364
   93    HA   ILE  11           HA       ILE  11  -3.132   7.884  -3.956
   94    HB   ILE  11           HB       ILE  11  -1.029   8.507  -6.056
   95   1HG1  ILE  11          HG12      ILE  11  -0.855   8.589  -3.030
   96   2HG1  ILE  11          HG11      ILE  11  -0.324   7.213  -3.998
   97   1HG2  ILE  11          HG22      ILE  11  -2.789  10.322  -5.441
   98   2HG2  ILE  11          HG21      ILE  11  -1.962  10.376  -3.883
   99   3HG2  ILE  11          HG23      ILE  11  -1.080  10.756  -5.364
  100   1HD1  ILE  11          HD12      ILE  11   0.769   9.618  -5.124
  101   2HD1  ILE  11          HD11      ILE  11   1.131   9.580  -3.398
  102   3HD1  ILE  11          HD13      ILE  11   1.628   8.241  -4.434
  103    H    ASP  12           HN       ASP  12  -2.825   7.340  -7.454
  104    HA   ASP  12           HA       ASP  12  -4.544   9.369  -8.389
  105   1HB   ASP  12           HB2      ASP  12  -3.153   7.762  -9.774
  106   2HB   ASP  12           HB1      ASP  12  -4.408   6.555  -9.509
  107    H    VAL  13           HN       VAL  13  -5.408   5.982  -7.639
  108    HA   VAL  13           HA       VAL  13  -8.147   6.044  -8.022
  109    HB   VAL  13           HB       VAL  13  -6.540   4.749  -5.812
  110   1HG1  VAL  13          HG11      VAL  13  -9.508   4.514  -6.397
  111   2HG1  VAL  13          HG13      VAL  13  -8.609   3.378  -5.391
  112   3HG1  VAL  13          HG12      VAL  13  -8.764   5.064  -4.895
  113   1HG2  VAL  13          HG21      VAL  13  -7.072   4.169  -8.545
  114   2HG2  VAL  13          HG23      VAL  13  -6.212   3.165  -7.376
  115   3HG2  VAL  13          HG22      VAL  13  -7.955   2.983  -7.583
  116    H    PHE  14           HN       PHE  14  -6.342   7.569  -5.408
  117    HA   PHE  14           HA       PHE  14  -8.570   8.188  -3.724
  118   1HB   PHE  14           HB2      PHE  14  -5.862   8.554  -3.541
  119   2HB   PHE  14           HB1      PHE  14  -6.418  10.205  -3.818
  120    HD1  PHE  14           HD2      PHE  14  -6.879   7.211  -1.652
  121    HD2  PHE  14           HD1      PHE  14  -7.566  11.426  -2.124
  122    HE1  PHE  14           HE2      PHE  14  -7.643   7.351   0.704
  123    HE2  PHE  14           HE1      PHE  14  -8.334  11.565   0.231
  124    HZ   PHE  14           HZ       PHE  14  -8.372   9.528   1.645
  125    H    HIS  15           HN       HIS  15  -6.793  10.564  -5.731
  126    HA   HIS  15           HA       HIS  15  -8.666  12.610  -5.691
  127   1HB   HIS  15           HB2      HIS  15  -6.341  12.306  -6.983
  128   2HB   HIS  15           HB1      HIS  15  -7.429  12.023  -8.344
  129    HD1  HIS  15           HD1      HIS  15  -6.118  14.477  -8.928
  130    HD2  HIS  15           HD2      HIS  15  -9.206  14.482  -6.126
  131    HE1  HIS  15           HE1      HIS  15  -6.913  16.874  -8.743
  132    H    GLN  16           HN       GLN  16  -8.930   9.552  -7.346
  133    HA   GLN  16           HA       GLN  16 -11.041  10.378  -9.162
  134   1HB   GLN  16           HB2      GLN  16  -9.459   8.296  -9.281
  135   2HB   GLN  16           HB1      GLN  16 -10.657   7.544  -8.227
  136   1HG   GLN  16           HG2      GLN  16 -11.906   7.107 -10.047
  137   2HG   GLN  16           HG1      GLN  16 -12.124   8.844 -10.260
  138   1HE2  GLN  16          HE22      GLN  16 -10.216   7.017 -13.139
  139   2HE2  GLN  16          HE21      GLN  16 -11.449   6.383 -12.160
  140    H    TYR  17           HN       TYR  17 -11.039   8.447  -6.147
  141    HA   TYR  17           HA       TYR  17 -13.976   8.727  -5.982
  142   1HB   TYR  17           HB2      TYR  17 -11.932   7.209  -4.344
  143   2HB   TYR  17           HB1      TYR  17 -13.636   7.299  -3.895
  144    HD1  TYR  17           HD1      TYR  17 -11.459   6.514  -6.849
  145    HD2  TYR  17           HD2      TYR  17 -15.118   5.707  -4.747
  146    HE1  TYR  17           HE1      TYR  17 -11.980   4.697  -8.455
  147    HE2  TYR  17           HE2      TYR  17 -15.640   3.890  -6.352
  148    HH   TYR  17           HH       TYR  17 -13.836   2.337  -8.020
  149    H    SER  18           HN       SER  18 -11.893  10.971  -5.506
  150    HA   SER  18           HA       SER  18 -12.670  11.654  -2.706
  151   1HB   SER  18           HB2      SER  18 -10.211  11.713  -3.537
  152   2HB   SER  18           HB1      SER  18 -10.683  13.181  -4.389
  153    HG   SER  18           HG       SER  18 -10.156  13.987  -2.480
  154    H    GLY  19           HN       GLY  19 -12.918  12.705  -6.052
  155   1HA   GLY  19           HA2      GLY  19 -14.082  15.291  -5.415
  156   2HA   GLY  19           HA1      GLY  19 -14.071  14.527  -7.006
  157    H    ARG  20           HN       ARG  20 -15.321  12.048  -6.029
  158    HA   ARG  20           HA       ARG  20 -18.042  12.656  -6.491
  159   1HB   ARG  20           HB2      ARG  20 -16.924  10.315  -4.919
  160   2HB   ARG  20           HB1      ARG  20 -18.522  10.396  -5.663
  161   1HG   ARG  20           HG2      ARG  20 -16.860  11.052  -7.766
  162   2HG   ARG  20           HG1      ARG  20 -15.914   9.842  -6.898
  163   1HD   ARG  20           HD2      ARG  20 -17.542   8.180  -7.172
  164   2HD   ARG  20           HD1      ARG  20 -18.830   9.353  -7.449
  165    HE   ARG  20           HE       ARG  20 -18.058   9.609  -9.722
  166   1HH1  ARG  20          HH21      ARG  20 -15.187   9.420  -9.634
  167   2HH1  ARG  20          HH22      ARG  20 -14.843   7.813 -10.181
  168   1HH2  ARG  20          HH11      ARG  20 -18.070   6.659  -9.651
  169   2HH2  ARG  20          HH12      ARG  20 -16.477   6.249 -10.191
  170    H    GLU  21           HN       GLU  21 -16.796  11.510  -3.351
  171    HA   GLU  21           HA       GLU  21 -18.683  13.434  -2.048
  172   1HB   GLU  21           HB2      GLU  21 -18.453  10.550  -1.786
  173   2HB   GLU  21           HB1      GLU  21 -18.197  11.347  -0.232
  174   1HG   GLU  21           HG2      GLU  21 -20.294  12.705  -0.714
  175   2HG   GLU  21           HG1      GLU  21 -20.590  11.612  -2.067
  176    H    GLY  22           HN       GLY  22 -17.819  13.045   0.586
  177   1HA   GLY  22           HA2      GLY  22 -16.205  13.945   2.040
  178   2HA   GLY  22           HA1      GLY  22 -15.062  12.994   1.088
  179    H    ASP  23           HN       ASP  23 -13.939  15.218   1.932
  180    HA   ASP  23           HA       ASP  23 -14.443  17.575   0.360
  181   1HB   ASP  23           HB2      ASP  23 -11.900  16.740   1.786
  182   2HB   ASP  23           HB1      ASP  23 -12.331  18.371   1.285
  183    H    LYS  24           HN       LYS  24 -11.771  18.180  -0.515
  184    HA   LYS  24           HA       LYS  24 -11.736  16.535  -2.983
  185   1HB   LYS  24           HB2      LYS  24 -10.299  19.105  -2.249
  186   2HB   LYS  24           HB1      LYS  24 -10.175  18.299  -3.813
  187   1HG   LYS  24           HG2      LYS  24 -12.954  18.625  -3.034
  188   2HG   LYS  24           HG1      LYS  24 -12.116  20.178  -3.053
  189   1HD   LYS  24           HD2      LYS  24 -11.174  18.964  -5.348
  190   2HD   LYS  24           HD1      LYS  24 -12.853  18.426  -5.292
  191   1HE   LYS  24           HE2      LYS  24 -13.628  20.485  -5.807
  192   2HE   LYS  24           HE1      LYS  24 -12.586  21.252  -4.609
  193   1HZ   LYS  24           HZ1      LYS  24 -10.725  20.869  -6.246
  194   2HZ   LYS  24           HZ3      LYS  24 -11.919  20.501  -7.394
  195   3HZ   LYS  24           HZ2      LYS  24 -11.873  22.044  -6.683
  196    H    HIS  25           HN       HIS  25 -10.409  16.202  -0.036
  197    HA   HIS  25           HA       HIS  25  -8.117  14.690  -1.117
  198   1HB   HIS  25           HB2      HIS  25  -7.698  16.803   1.019
  199   2HB   HIS  25           HB1      HIS  25  -6.463  15.783   0.279
  200    HD1  HIS  25           HD1      HIS  25  -8.391  18.902  -0.230
  201    HD2  HIS  25           HD2      HIS  25  -5.936  16.425  -2.516
  202    HE1  HIS  25           HE1      HIS  25  -7.790  20.215  -2.312
  203    H    LYS  26           HN       LYS  26 -10.679  14.175   0.338
  204    HA   LYS  26           HA       LYS  26  -9.494  12.547   2.530
  205   1HB   LYS  26           HB2      LYS  26 -12.053  14.102   2.962
  206   2HB   LYS  26           HB1      LYS  26 -11.052  13.289   4.165
  207   1HG   LYS  26           HG2      LYS  26  -9.978  15.576   2.512
  208   2HG   LYS  26           HG1      LYS  26 -10.858  15.858   4.016
  209   1HD   LYS  26           HD2      LYS  26  -8.703  13.815   4.125
  210   2HD   LYS  26           HD1      LYS  26  -8.180  15.489   3.936
  211   1HE   LYS  26           HE2      LYS  26  -9.935  14.359   6.133
  212   2HE   LYS  26           HE1      LYS  26  -8.316  15.036   6.304
  213   1HZ   LYS  26           HZ1      LYS  26  -9.661  17.026   5.081
  214   2HZ   LYS  26           HZ3      LYS  26 -10.856  16.377   6.095
  215   3HZ   LYS  26           HZ2      LYS  26  -9.389  16.924   6.756
  216    H    LEU  27           HN       LEU  27 -10.470  10.541   2.678
  217    HA   LEU  27           HA       LEU  27 -12.561   9.947   0.659
  218   1HB   LEU  27           HB2      LEU  27 -10.323   8.533   1.740
  219   2HB   LEU  27           HB1      LEU  27 -11.780   7.625   2.139
  220    HG   LEU  27           HG       LEU  27 -10.761   7.040  -0.101
  221   1HD1  LEU  27          HD13      LEU  27 -13.573   8.095   0.177
  222   2HD1  LEU  27          HD12      LEU  27 -13.020   7.378  -1.337
  223   3HD1  LEU  27          HD11      LEU  27 -13.023   6.418   0.144
  224   1HD2  LEU  27          HD21      LEU  27 -10.362   9.664  -0.428
  225   2HD2  LEU  27          HD23      LEU  27 -10.609   8.593  -1.807
  226   3HD2  LEU  27          HD22      LEU  27 -11.950   9.559  -1.187
  227    H    LYS  28           HN       LYS  28 -13.623   7.652   2.048
  228    HA   LYS  28           HA       LYS  28 -14.784   8.684   4.553
  229   1HB   LYS  28           HB2      LYS  28 -16.156   8.862   2.027
  230   2HB   LYS  28           HB1      LYS  28 -16.984   7.689   3.052
  231   1HG   LYS  28           HG2      LYS  28 -16.199  10.015   4.594
  232   2HG   LYS  28           HG1      LYS  28 -17.179  10.489   3.208
  233   1HD   LYS  28           HD2      LYS  28 -18.010   8.173   4.944
  234   2HD   LYS  28           HD1      LYS  28 -18.399   9.829   5.412
  235   1HE   LYS  28           HE2      LYS  28 -18.993   9.020   2.601
  236   2HE   LYS  28           HE1      LYS  28 -20.043   8.389   3.869
  237   1HZ   LYS  28           HZ2      LYS  28 -19.365  11.261   3.564
  238   2HZ   LYS  28           HZ1      LYS  28 -20.768  10.549   2.922
  239   3HZ   LYS  28           HZ3      LYS  28 -20.528  10.584   4.601
  240    H    LYS  29           HN       LYS  29 -16.210   6.880   5.534
  241    HA   LYS  29           HA       LYS  29 -14.760   4.362   5.244
  242   1HB   LYS  29           HB2      LYS  29 -15.415   4.415   7.410
  243   2HB   LYS  29           HB1      LYS  29 -16.744   5.507   7.082
  244   1HG   LYS  29           HG2      LYS  29 -16.863   2.583   6.330
  245   2HG   LYS  29           HG1      LYS  29 -17.338   3.145   7.928
  246   1HD   LYS  29           HD2      LYS  29 -18.705   3.522   5.301
  247   2HD   LYS  29           HD1      LYS  29 -19.392   3.238   6.893
  248   1HE   LYS  29           HE2      LYS  29 -18.904   5.564   7.542
  249   2HE   LYS  29           HE1      LYS  29 -18.181   5.863   5.962
  250   1HZ   LYS  29           HZ3      LYS  29 -20.607   4.794   5.369
  251   2HZ   LYS  29           HZ2      LYS  29 -20.945   5.769   6.719
  252   3HZ   LYS  29           HZ1      LYS  29 -20.223   6.446   5.338
  253    H    SER  30           HN       SER  30 -17.803   5.706   4.153
  254    HA   SER  30           HA       SER  30 -18.812   3.142   3.161
  255   1HB   SER  30           HB2      SER  30 -19.840   5.804   3.505
  256   2HB   SER  30           HB1      SER  30 -20.094   5.313   1.832
  257    HG   SER  30           HG       SER  30 -21.611   4.666   3.745
  258    H    GLU  31           HN       GLU  31 -16.868   5.772   1.893
  259    HA   GLU  31           HA       GLU  31 -17.101   4.743  -0.866
  260   1HB   GLU  31           HB2      GLU  31 -16.847   7.258  -0.078
  261   2HB   GLU  31           HB1      GLU  31 -15.131   6.853  -0.036
  262   1HG   GLU  31           HG2      GLU  31 -15.072   7.216  -2.259
  263   2HG   GLU  31           HG1      GLU  31 -16.076   5.778  -2.454
  264    H    LEU  32           HN       LEU  32 -15.086   4.493   1.922
  265    HA   LEU  32           HA       LEU  32 -12.762   3.474   0.461
  266   1HB   LEU  32           HB2      LEU  32 -12.201   4.555   2.498
  267   2HB   LEU  32           HB1      LEU  32 -13.490   3.744   3.381
  268    HG   LEU  32           HG       LEU  32 -12.333   1.667   3.384
  269   1HD1  LEU  32          HD13      LEU  32 -11.166   2.728   0.958
  270   2HD1  LEU  32          HD12      LEU  32  -9.903   2.117   2.025
  271   3HD1  LEU  32          HD11      LEU  32 -11.223   1.060   1.521
  272   1HD2  LEU  32          HD23      LEU  32 -10.920   4.098   4.174
  273   2HD2  LEU  32          HD22      LEU  32 -11.085   2.569   5.040
  274   3HD2  LEU  32          HD21      LEU  32  -9.809   2.770   3.837
  275    H    LYS  33           HN       LYS  33 -15.500   2.236   2.309
  276    HA   LYS  33           HA       LYS  33 -14.718  -0.525   2.328
  277   1HB   LYS  33           HB2      LYS  33 -16.702   0.871   3.505
  278   2HB   LYS  33           HB1      LYS  33 -17.605   0.190   2.156
  279   1HG   LYS  33           HG2      LYS  33 -16.286  -2.024   2.917
  280   2HG   LYS  33           HG1      LYS  33 -16.331  -1.189   4.472
  281   1HD   LYS  33           HD2      LYS  33 -18.812  -0.867   4.133
  282   2HD   LYS  33           HD1      LYS  33 -18.694  -1.921   2.723
  283   1HE   LYS  33           HE2      LYS  33 -17.420  -3.469   4.528
  284   2HE   LYS  33           HE1      LYS  33 -18.502  -2.597   5.614
  285   1HZ   LYS  33           HZ2      LYS  33 -19.372  -4.003   3.148
  286   2HZ   LYS  33           HZ1      LYS  33 -19.477  -4.656   4.713
  287   3HZ   LYS  33           HZ3      LYS  33 -20.374  -3.275   4.309
  288    H    GLU  34           HN       GLU  34 -16.363   1.540   0.022
  289    HA   GLU  34           HA       GLU  34 -17.071  -0.681  -1.752
  290   1HB   GLU  34           HB2      GLU  34 -18.136   0.939  -3.081
  291   2HB   GLU  34           HB1      GLU  34 -18.234   1.662  -1.479
  292   1HG   GLU  34           HG2      GLU  34 -16.405   3.132  -1.917
  293   2HG   GLU  34           HG1      GLU  34 -15.976   2.276  -3.396
  294    H    LEU  35           HN       LEU  35 -14.625   1.822  -1.527
  295    HA   LEU  35           HA       LEU  35 -13.288   1.555  -3.975
  296   1HB   LEU  35           HB2      LEU  35 -12.793   2.817  -1.550
  297   2HB   LEU  35           HB1      LEU  35 -11.462   1.661  -1.676
  298    HG   LEU  35           HG       LEU  35 -10.737   3.685  -2.757
  299   1HD1  LEU  35          HD11      LEU  35 -11.132   1.227  -4.204
  300   2HD1  LEU  35          HD13      LEU  35 -11.264   2.586  -5.320
  301   3HD1  LEU  35          HD12      LEU  35  -9.810   2.384  -4.342
  302   1HD2  LEU  35          HD23      LEU  35 -13.397   4.139  -3.215
  303   2HD2  LEU  35          HD22      LEU  35 -12.092   5.052  -3.973
  304   3HD2  LEU  35          HD21      LEU  35 -12.840   3.705  -4.831
  305    H    ILE  36           HN       ILE  36 -12.712  -0.327  -0.990
  306    HA   ILE  36           HA       ILE  36 -10.938  -2.195  -2.381
  307    HB   ILE  36           HB       ILE  36 -12.138  -2.904   0.255
  308   1HG1  ILE  36          HG12      ILE  36 -10.630  -0.368  -0.298
  309   2HG1  ILE  36          HG11      ILE  36 -11.927  -0.671   0.853
  310   1HG2  ILE  36          HG23      ILE  36  -9.330  -2.858  -0.892
  311   2HG2  ILE  36          HG22      ILE  36  -9.742  -3.440   0.721
  312   3HG2  ILE  36          HG21      ILE  36 -10.365  -4.273  -0.700
  313   1HD1  ILE  36          HD11      ILE  36 -10.016  -2.302   1.875
  314   2HD1  ILE  36          HD13      ILE  36  -9.002  -1.042   1.172
  315   3HD1  ILE  36          HD12      ILE  36 -10.222  -0.622   2.374
  316    H    ASN  37           HN       ASN  37 -14.122  -2.455  -0.827
  317    HA   ASN  37           HA       ASN  37 -14.644  -5.129  -1.686
  318   1HB   ASN  37           HB2      ASN  37 -15.820  -3.796   0.157
  319   2HB   ASN  37           HB1      ASN  37 -16.770  -3.061  -1.135
  320   1HD2  ASN  37          HD22      ASN  37 -17.506  -6.914  -0.026
  321   2HD2  ASN  37          HD21      ASN  37 -16.209  -6.051   0.650
  322    H    ASN  38           HN       ASN  38 -14.364  -2.446  -3.643
  323    HA   ASN  38           HA       ASN  38 -16.497  -3.344  -5.510
  324   1HB   ASN  38           HB2      ASN  38 -16.361  -0.918  -5.038
  325   2HB   ASN  38           HB1      ASN  38 -14.700  -0.902  -5.632
  326   1HD2  ASN  38          HD22      ASN  38 -15.651  -0.792  -9.027
  327   2HD2  ASN  38          HD21      ASN  38 -14.383  -0.785  -7.898
  328    H    GLU  39           HN       GLU  39 -12.988  -2.732  -5.387
  329    HA   GLU  39           HA       GLU  39 -12.739  -4.430  -7.841
  330   1HB   GLU  39           HB2      GLU  39 -12.012  -2.011  -8.050
  331   2HB   GLU  39           HB1      GLU  39 -10.757  -2.358  -6.860
  332   1HG   GLU  39           HG2      GLU  39  -9.747  -2.626  -9.021
  333   2HG   GLU  39           HG1      GLU  39  -9.997  -4.248  -8.370
  334    H    LEU  40           HN       LEU  40 -11.419  -3.686  -4.647
  335    HA   LEU  40           HA       LEU  40  -9.357  -5.718  -4.738
  336   1HB   LEU  40           HB2      LEU  40 -10.621  -4.097  -2.523
  337   2HB   LEU  40           HB1      LEU  40  -9.383  -5.300  -2.206
  338    HG   LEU  40           HG       LEU  40  -8.804  -2.717  -2.672
  339   1HD1  LEU  40          HD11      LEU  40  -7.445  -5.197  -2.643
  340   2HD1  LEU  40          HD13      LEU  40  -6.781  -4.267  -3.986
  341   3HD1  LEU  40          HD12      LEU  40  -6.774  -3.591  -2.356
  342   1HD2  LEU  40          HD21      LEU  40  -8.693  -4.041  -5.404
  343   2HD2  LEU  40          HD23      LEU  40  -9.760  -2.711  -4.949
  344   3HD2  LEU  40          HD22      LEU  40  -8.015  -2.463  -5.005
  345    H    SER  41           HN       SER  41 -12.747  -5.732  -4.092
  346    HA   SER  41           HA       SER  41 -12.834  -8.056  -2.387
  347   1HB   SER  41           HB2      SER  41 -14.880  -7.072  -2.230
  348   2HB   SER  41           HB1      SER  41 -14.759  -6.353  -3.834
  349    HG   SER  41           HG       SER  41 -15.996  -7.913  -4.479
  350    H    HIS  42           HN       HIS  42 -12.054  -7.707  -5.664
  351    HA   HIS  42           HA       HIS  42 -13.147 -10.319  -6.482
  352   1HB   HIS  42           HB2      HIS  42 -12.667  -8.099  -7.919
  353   2HB   HIS  42           HB1      HIS  42 -11.120  -8.913  -8.153
  354    HD1  HIS  42           HD1      HIS  42 -14.698  -9.057  -9.119
  355    HD2  HIS  42           HD2      HIS  42 -11.348 -11.521  -9.428
  356    HE1  HIS  42           HE1      HIS  42 -15.290 -10.865 -10.793
  357    H    PHE  43           HN       PHE  43 -10.917  -9.804  -4.359
  358    HA   PHE  43           HA       PHE  43  -9.097 -11.917  -5.427
  359   1HB   PHE  43           HB2      PHE  43  -8.245  -9.532  -3.754
  360   2HB   PHE  43           HB1      PHE  43  -7.190 -10.800  -4.384
  361    HD1  PHE  43           HD2      PHE  43  -7.734 -11.239  -7.067
  362    HD2  PHE  43           HD1      PHE  43  -8.119  -7.532  -4.930
  363    HE1  PHE  43           HE2      PHE  43  -7.495  -9.989  -9.196
  364    HE2  PHE  43           HE1      PHE  43  -7.881  -6.281  -7.058
  365    HZ   PHE  43           HZ       PHE  43  -7.568  -7.510  -9.191
  366    H    LEU  44           HN       LEU  44 -10.902 -13.055  -4.073
  367    HA   LEU  44           HA       LEU  44  -9.789 -13.438  -1.349
  368   1HB   LEU  44           HB2      LEU  44 -12.708 -12.877  -1.957
  369   2HB   LEU  44           HB1      LEU  44 -12.105 -13.441  -0.398
  370    HG   LEU  44           HG       LEU  44 -10.478 -11.390  -0.590
  371   1HD1  LEU  44          HD13      LEU  44 -11.937 -11.114  -2.975
  372   2HD1  LEU  44          HD12      LEU  44 -12.578  -9.869  -1.901
  373   3HD1  LEU  44          HD11      LEU  44 -10.851  -9.921  -2.261
  374   1HD2  LEU  44          HD21      LEU  44 -12.380 -11.736   1.047
  375   2HD2  LEU  44          HD23      LEU  44 -12.062 -10.049   0.647
  376   3HD2  LEU  44          HD22      LEU  44 -13.428 -10.888  -0.090
  377    H    GLU  45           HN       GLU  45 -12.718 -14.966  -1.376
  378    HA   GLU  45           HA       GLU  45 -13.391 -17.167  -1.826
  379   1HB   GLU  45           HB2      GLU  45 -11.111 -17.262  -3.818
  380   2HB   GLU  45           HB1      GLU  45 -12.568 -18.256  -3.803
  381   1HG   GLU  45           HG2      GLU  45 -13.706 -15.808  -3.867
  382   2HG   GLU  45           HG1      GLU  45 -12.200 -15.451  -4.715
  383    H    GLU  46           HN       GLU  46 -10.699 -16.239  -0.314
  384    HA   GLU  46           HA       GLU  46 -10.219 -18.853   0.862
  385   1HB   GLU  46           HB2      GLU  46  -8.171 -17.610  -0.987
  386   2HB   GLU  46           HB1      GLU  46  -7.713 -18.746   0.282
  387   1HG   GLU  46           HG2      GLU  46  -9.683 -20.186  -0.790
  388   2HG   GLU  46           HG1      GLU  46  -9.286 -19.226  -2.216
  389    H    ILE  47           HN       ILE  47 -10.939 -16.066   1.595
  390    HA   ILE  47           HA       ILE  47  -8.993 -14.486   2.729
  391    HB   ILE  47           HB       ILE  47 -11.616 -15.323   3.996
  392   1HG1  ILE  47          HG12      ILE  47 -10.988 -12.726   2.596
  393   2HG1  ILE  47          HG11      ILE  47 -11.481 -14.146   1.673
  394   1HG2  ILE  47          HG23      ILE  47  -9.490 -13.387   4.803
  395   2HG2  ILE  47          HG22      ILE  47 -11.168 -12.877   4.994
  396   3HG2  ILE  47          HG21      ILE  47 -10.590 -14.331   5.809
  397   1HD1  ILE  47          HD13      ILE  47 -13.431 -14.280   3.418
  398   2HD1  ILE  47          HD12      ILE  47 -13.045 -12.584   3.712
  399   3HD1  ILE  47          HD11      ILE  47 -13.535 -13.112   2.101
  400    H    LYS  48           HN       LYS  48  -7.358 -14.833   4.134
  401    HA   LYS  48           HA       LYS  48  -7.580 -17.179   5.979
  402   1HB   LYS  48           HB2      LYS  48  -5.785 -17.130   4.065
  403   2HB   LYS  48           HB1      LYS  48  -4.943 -16.002   5.131
  404   1HG   LYS  48           HG2      LYS  48  -4.224 -17.704   6.413
  405   2HG   LYS  48           HG1      LYS  48  -5.886 -18.231   6.684
  406   1HD   LYS  48           HD2      LYS  48  -5.137 -20.101   5.577
  407   2HD   LYS  48           HD1      LYS  48  -5.560 -19.132   4.165
  408   1HE   LYS  48           HE2      LYS  48  -3.188 -18.248   4.177
  409   2HE   LYS  48           HE1      LYS  48  -2.819 -19.451   5.416
  410   1HZ   LYS  48           HZ1      LYS  48  -3.997 -20.119   2.775
  411   2HZ   LYS  48           HZ3      LYS  48  -2.333 -20.166   3.098
  412   3HZ   LYS  48           HZ2      LYS  48  -3.389 -21.200   3.937
  413    H    GLU  49           HN       GLU  49  -6.174 -13.904   5.618
  414    HA   GLU  49           HA       GLU  49  -5.612 -13.707   8.477
  415   1HB   GLU  49           HB2      GLU  49  -5.376 -11.902   6.105
  416   2HB   GLU  49           HB1      GLU  49  -5.474 -11.153   7.697
  417   1HG   GLU  49           HG2      GLU  49  -3.570 -13.430   7.166
  418   2HG   GLU  49           HG1      GLU  49  -3.120 -11.760   6.815
  419    H    GLN  50           HN       GLN  50  -7.806 -14.261   9.220
  420    HA   GLN  50           HA       GLN  50 -10.105 -12.681   8.586
  421   1HB   GLN  50           HB2      GLN  50 -10.358 -14.855   9.637
  422   2HB   GLN  50           HB1      GLN  50  -9.435 -14.327  11.043
  423   1HG   GLN  50           HG2      GLN  50 -11.251 -12.465  11.245
  424   2HG   GLN  50           HG1      GLN  50 -12.209 -13.513  10.197
  425   1HE2  GLN  50          HE22      GLN  50 -13.090 -14.655  13.569
  426   2HE2  GLN  50          HE21      GLN  50 -13.427 -13.353  12.535
  427    H    GLU  51           HN       GLU  51  -7.457 -12.191  10.837
  428    HA   GLU  51           HA       GLU  51  -8.834 -10.114  12.346
  429   1HB   GLU  51           HB2      GLU  51  -6.301 -11.512  12.475
  430   2HB   GLU  51           HB1      GLU  51  -6.058  -9.775  12.662
  431   1HG   GLU  51           HG2      GLU  51  -8.266 -10.171  14.229
  432   2HG   GLU  51           HG1      GLU  51  -7.399 -11.690  14.464
  433    H    VAL  52           HN       VAL  52  -6.629 -10.181   9.578
  434    HA   VAL  52           HA       VAL  52  -6.170  -7.325   9.568
  435    HB   VAL  52           HB       VAL  52  -5.912  -9.380   7.350
  436   1HG1  VAL  52          HG13      VAL  52  -5.649  -6.478   7.387
  437   2HG1  VAL  52          HG12      VAL  52  -4.150  -7.267   6.901
  438   3HG1  VAL  52          HG11      VAL  52  -5.640  -7.584   6.012
  439   1HG2  VAL  52          HG23      VAL  52  -4.466  -9.173   9.681
  440   2HG2  VAL  52          HG22      VAL  52  -3.852  -9.864   8.179
  441   3HG2  VAL  52          HG21      VAL  52  -3.519  -8.177   8.577
  442    H    VAL  53           HN       VAL  53  -8.379  -9.444   7.722
  443    HA   VAL  53           HA       VAL  53  -9.586  -7.161   6.368
  444    HB   VAL  53           HB       VAL  53 -10.483 -10.052   6.603
  445   1HG1  VAL  53          HG11      VAL  53 -11.571  -7.672   5.113
  446   2HG1  VAL  53          HG13      VAL  53 -11.773  -9.296   4.457
  447   3HG1  VAL  53          HG12      VAL  53 -12.444  -8.894   6.038
  448   1HG2  VAL  53          HG21      VAL  53  -8.306  -9.031   5.268
  449   2HG2  VAL  53          HG23      VAL  53  -9.171 -10.493   4.793
  450   3HG2  VAL  53          HG22      VAL  53  -9.556  -8.953   4.024
  451    H    ASP  54           HN       ASP  54 -10.250  -9.026   9.275
  452    HA   ASP  54           HA       ASP  54 -12.908  -7.837   9.591
  453   1HB   ASP  54           HB2      ASP  54 -11.183  -9.435  11.508
  454   2HB   ASP  54           HB1      ASP  54 -12.832  -8.912  11.846
  455    H    LYS  55           HN       LYS  55  -9.646  -6.942  10.304
  456    HA   LYS  55           HA       LYS  55 -10.368  -5.163  12.511
  457   1HB   LYS  55           HB2      LYS  55  -8.121  -6.039  12.503
  458   2HB   LYS  55           HB1      LYS  55  -7.850  -5.471  10.854
  459   1HG   LYS  55           HG2      LYS  55  -8.691  -3.224  12.378
  460   2HG   LYS  55           HG1      LYS  55  -7.445  -4.051  13.316
  461   1HD   LYS  55           HD2      LYS  55  -6.134  -4.160  11.081
  462   2HD   LYS  55           HD1      LYS  55  -7.251  -2.912  10.533
  463   1HE   LYS  55           HE2      LYS  55  -6.617  -1.720  12.777
  464   2HE   LYS  55           HE1      LYS  55  -5.208  -2.778  12.736
  465   1HZ   LYS  55           HZ1      LYS  55  -5.910  -1.323  10.297
  466   2HZ   LYS  55           HZ3      LYS  55  -5.201  -0.446  11.564
  467   3HZ   LYS  55           HZ2      LYS  55  -4.383  -1.774  10.889
  468    H    VAL  56           HN       VAL  56  -9.560  -4.763   9.047
  469    HA   VAL  56           HA       VAL  56 -10.092  -1.885   9.192
  470    HB   VAL  56           HB       VAL  56  -9.975  -2.161   6.627
  471   1HG1  VAL  56          HG12      VAL  56  -8.057  -1.723   8.481
  472   2HG1  VAL  56          HG11      VAL  56  -7.444  -3.214   7.766
  473   3HG1  VAL  56          HG13      VAL  56  -7.714  -1.798   6.751
  474   1HG2  VAL  56          HG22      VAL  56 -10.207  -4.846   7.291
  475   2HG2  VAL  56          HG21      VAL  56  -9.720  -4.211   5.720
  476   3HG2  VAL  56          HG23      VAL  56  -8.497  -4.660   6.910
  477    H    MET  57           HN       MET  57 -11.763  -4.808   8.257
  478    HA   MET  57           HA       MET  57 -14.057  -3.466   7.079
  479   1HB   MET  57           HB2      MET  57 -13.279  -5.872   6.649
  480   2HB   MET  57           HB1      MET  57 -13.968  -6.262   8.228
  481   1HG   MET  57           HG2      MET  57 -16.010  -6.407   7.299
  482   2HG   MET  57           HG1      MET  57 -15.895  -4.721   6.793
  483   1HE   MET  57           HE3      MET  57 -14.282  -4.032   5.131
  484   2HE   MET  57           HE2      MET  57 -13.156  -5.219   4.477
  485   3HE   MET  57           HE1      MET  57 -14.452  -4.592   3.462
  486    H    GLU  58           HN       GLU  58 -13.063  -4.308  10.321
  487    HA   GLU  58           HA       GLU  58 -15.797  -4.171  11.382
  488   1HB   GLU  58           HB2      GLU  58 -13.077  -4.549  12.554
  489   2HB   GLU  58           HB1      GLU  58 -14.313  -3.863  13.604
  490   1HG   GLU  58           HG2      GLU  58 -15.772  -5.848  12.573
  491   2HG   GLU  58           HG1      GLU  58 -14.183  -6.582  12.375
  492    H    THR  59           HN       THR  59 -12.936  -2.001  11.390
  493    HA   THR  59           HA       THR  59 -14.329   0.109  12.805
  494    HB   THR  59           HB       THR  59 -11.955   0.259  10.910
  495    HG1  THR  59           HG1      THR  59 -12.296  -0.355  13.599
  496   1HG2  THR  59          HG23      THR  59 -13.145   2.423  11.257
  497   2HG2  THR  59          HG22      THR  59 -12.916   2.238  12.996
  498   3HG2  THR  59          HG21      THR  59 -11.518   2.427  11.937
  499    H    LEU  60           HN       LEU  60 -14.133  -0.987   9.533
  500    HA   LEU  60           HA       LEU  60 -15.191   1.361   8.232
  501   1HB   LEU  60           HB2      LEU  60 -14.712  -1.509   7.541
  502   2HB   LEU  60           HB1      LEU  60 -15.819  -0.605   6.516
  503    HG   LEU  60           HG       LEU  60 -13.009   0.292   7.217
  504   1HD1  LEU  60          HD11      LEU  60 -14.144  -1.308   4.948
  505   2HD1  LEU  60          HD13      LEU  60 -12.822  -0.186   4.621
  506   3HD1  LEU  60          HD12      LEU  60 -12.602  -1.493   5.784
  507   1HD2  LEU  60          HD22      LEU  60 -15.309   1.562   5.959
  508   2HD2  LEU  60          HD21      LEU  60 -13.780   2.278   6.467
  509   3HD2  LEU  60          HD23      LEU  60 -13.917   1.527   4.877
  510    H    ASP  61           HN       ASP  61 -16.699  -1.818   8.828
  511    HA   ASP  61           HA       ASP  61 -19.382  -0.808   8.394
  512   1HB   ASP  61           HB2      ASP  61 -18.216  -3.295   8.343
  513   2HB   ASP  61           HB1      ASP  61 -19.094  -3.341   9.873
  514    H    GLU  62           HN       GLU  62 -17.282  -0.594  11.029
  515    HA   GLU  62           HA       GLU  62 -19.229  -0.938  13.152
  516   1HB   GLU  62           HB2      GLU  62 -16.932  -1.157  13.784
  517   2HB   GLU  62           HB1      GLU  62 -16.511   0.389  13.044
  518   1HG   GLU  62           HG2      GLU  62 -16.971   1.452  14.974
  519   2HG   GLU  62           HG1      GLU  62 -18.621   0.829  14.938
  520    H    ASP  63           HN       ASP  63 -17.642   1.972  11.839
  521    HA   ASP  63           HA       ASP  63 -19.998   3.483  11.474
  522   1HB   ASP  63           HB2      ASP  63 -20.283   3.244  13.926
  523   2HB   ASP  63           HB1      ASP  63 -18.697   3.973  14.173
  524    H    GLY  64           HN       GLY  64 -18.049   3.591   9.798
  525   1HA   GLY  64           HA2      GLY  64 -16.077   5.656  10.584
  526   2HA   GLY  64           HA1      GLY  64 -16.080   4.762   9.066
  527    H    ASP  65           HN       ASP  65 -19.081   6.017  10.130
  528    HA   ASP  65           HA       ASP  65 -19.959   7.347   7.953
  529   1HB   ASP  65           HB2      ASP  65 -21.292   7.220   9.982
  530   2HB   ASP  65           HB1      ASP  65 -20.204   8.339  10.805
  531    H    GLY  66           HN       GLY  66 -17.317   8.507   9.965
  532   1HA   GLY  66           HA2      GLY  66 -17.390  11.160   8.716
  533   2HA   GLY  66           HA1      GLY  66 -16.198  10.600   9.888
  534    H    GLU  67           HN       GLU  67 -15.229  11.926   7.758
  535    HA   GLU  67           HA       GLU  67 -14.596  10.214   5.514
  536   1HB   GLU  67           HB2      GLU  67 -13.163  12.750   6.312
  537   2HB   GLU  67           HB1      GLU  67 -13.292  12.045   4.700
  538   1HG   GLU  67           HG2      GLU  67 -15.494  12.716   4.429
  539   2HG   GLU  67           HG1      GLU  67 -15.814  12.721   6.165
  540    H    CYS  68           HN       CYS  68 -12.449   9.529   4.922
  541    HA   CYS  68           HA       CYS  68 -10.748   8.861   7.286
  542   1HB   CYS  68           HB2      CYS  68 -11.309   7.444   4.675
  543   2HB   CYS  68           HB1      CYS  68  -9.897   7.042   5.650
  544    HG   CYS  68           HG       CYS  68 -12.498   5.875   6.189
  545    H    ASP  69           HN       ASP  69  -8.335   8.657   6.632
  546    HA   ASP  69           HA       ASP  69  -7.698  11.016   4.925
  547   1HB   ASP  69           HB2      ASP  69  -6.079   9.481   6.978
  548   2HB   ASP  69           HB1      ASP  69  -5.406  10.769   5.979
  549    H    PHE  70           HN       PHE  70  -5.441  10.675   3.764
  550    HA   PHE  70           HA       PHE  70  -5.840   8.487   1.893
  551   1HB   PHE  70           HB2      PHE  70  -4.930  10.598   1.092
  552   2HB   PHE  70           HB1      PHE  70  -3.576  10.478   2.215
  553    HD1  PHE  70           HD1      PHE  70  -5.119   7.745   0.201
  554    HD2  PHE  70           HD2      PHE  70  -1.707  10.295   0.764
  555    HE1  PHE  70           HE1      PHE  70  -3.852   6.414  -1.464
  556    HE2  PHE  70           HE2      PHE  70  -0.439   8.964  -0.902
  557    HZ   PHE  70           HZ       PHE  70  -1.512   7.024  -2.016
  558    H    GLN  71           HN       GLN  71  -3.837   9.037   4.720
  559    HA   GLN  71           HA       GLN  71  -2.034   6.813   4.178
  560   1HB   GLN  71           HB2      GLN  71  -2.473   8.769   6.369
  561   2HB   GLN  71           HB1      GLN  71  -1.764   7.222   6.839
  562   1HG   GLN  71           HG2      GLN  71  -0.532   8.141   4.403
  563   2HG   GLN  71           HG1      GLN  71  -0.450   9.413   5.622
  564   1HE2  GLN  71          HE22      GLN  71   1.166   5.816   6.800
  565   2HE2  GLN  71          HE21      GLN  71  -0.338   5.830   6.011
  566    H    GLU  72           HN       GLU  72  -5.096   7.213   5.915
  567    HA   GLU  72           HA       GLU  72  -4.873   4.613   7.192
  568   1HB   GLU  72           HB2      GLU  72  -6.831   5.181   8.265
  569   2HB   GLU  72           HB1      GLU  72  -6.307   6.792   7.796
  570   1HG   GLU  72           HG2      GLU  72  -7.866   6.940   6.061
  571   2HG   GLU  72           HG1      GLU  72  -8.083   5.197   5.966
  572    H    PHE  73           HN       PHE  73  -6.600   5.945   4.386
  573    HA   PHE  73           HA       PHE  73  -7.797   3.425   3.611
  574   1HB   PHE  73           HB2      PHE  73  -8.908   5.165   2.569
  575   2HB   PHE  73           HB1      PHE  73  -7.452   6.142   2.418
  576    HD1  PHE  73           HD1      PHE  73  -5.746   5.549   0.637
  577    HD2  PHE  73           HD2      PHE  73  -9.655   3.776   0.786
  578    HE1  PHE  73           HE1      PHE  73  -5.511   4.834  -1.727
  579    HE2  PHE  73           HE2      PHE  73  -9.422   3.059  -1.578
  580    HZ   PHE  73           HZ       PHE  73  -7.349   3.589  -2.835
  581    H    MET  74           HN       MET  74  -4.666   4.839   3.308
  582    HA   MET  74           HA       MET  74  -3.787   3.249   1.036
  583   1HB   MET  74           HB2      MET  74  -2.659   5.263   2.846
  584   2HB   MET  74           HB1      MET  74  -1.506   3.996   2.439
  585   1HG   MET  74           HG2      MET  74  -3.134   5.100   0.203
  586   2HG   MET  74           HG1      MET  74  -1.880   6.144   0.869
  587   1HE   MET  74           HE3      MET  74  -2.817   4.120  -1.645
  588   2HE   MET  74           HE2      MET  74  -1.516   3.061  -2.188
  589   3HE   MET  74           HE1      MET  74  -2.557   2.559  -0.858
  590    H    ALA  75           HN       ALA  75  -3.082   3.126   4.541
  591    HA   ALA  75           HA       ALA  75  -1.749   0.565   4.340
  592   1HB   ALA  75           HB1      ALA  75  -1.532   2.364   6.197
  593   2HB   ALA  75           HB3      ALA  75  -3.007   1.660   6.857
  594   3HB   ALA  75           HB2      ALA  75  -1.554   0.674   6.696
  595    H    PHE  76           HN       PHE  76  -5.037   1.572   4.489
  596    HA   PHE  76           HA       PHE  76  -6.066  -0.932   5.595
  597   1HB   PHE  76           HB2      PHE  76  -7.189   1.635   4.633
  598   2HB   PHE  76           HB1      PHE  76  -8.226   0.226   4.418
  599    HD1  PHE  76           HD1      PHE  76  -5.852   1.490   7.046
  600    HD2  PHE  76           HD2      PHE  76  -9.721  -0.152   6.155
  601    HE1  PHE  76           HE1      PHE  76  -6.431   1.545   9.457
  602    HE2  PHE  76           HE2      PHE  76 -10.300  -0.096   8.567
  603    HZ   PHE  76           HZ       PHE  76  -8.654   0.753  10.218
  604    H    VAL  77           HN       VAL  77  -5.549   0.446   2.372
  605    HA   VAL  77           HA       VAL  77  -7.034  -1.673   1.019
  606    HB   VAL  77           HB       VAL  77  -5.047   0.389   0.018
  607   1HG1  VAL  77          HG13      VAL  77  -5.889  -2.014  -1.233
  608   2HG1  VAL  77          HG12      VAL  77  -6.775  -0.703  -2.013
  609   3HG1  VAL  77          HG11      VAL  77  -5.012  -0.671  -1.967
  610   1HG2  VAL  77          HG21      VAL  77  -7.435   0.974   0.931
  611   2HG2  VAL  77          HG23      VAL  77  -6.923   1.653  -0.614
  612   3HG2  VAL  77          HG22      VAL  77  -7.997   0.254  -0.579
  613    H    SER  78           HN       SER  78  -3.713  -1.190   2.055
  614    HA   SER  78           HA       SER  78  -2.677  -3.390   0.435
  615   1HB   SER  78           HB2      SER  78  -1.518  -1.800   2.735
  616   2HB   SER  78           HB1      SER  78  -0.639  -3.087   1.913
  617    HG   SER  78           HG       SER  78  -0.234  -1.718   0.383
  618    H    MET  79           HN       MET  79  -3.835  -2.990   3.761
  619    HA   MET  79           HA       MET  79  -2.914  -5.501   4.756
  620   1HB   MET  79           HB2      MET  79  -5.369  -3.910   5.552
  621   2HB   MET  79           HB1      MET  79  -4.603  -5.174   6.509
  622   1HG   MET  79           HG2      MET  79  -2.713  -3.120   5.629
  623   2HG   MET  79           HG1      MET  79  -4.002  -2.478   6.647
  624   1HE   MET  79           HE1      MET  79  -4.048  -2.286   8.631
  625   2HE   MET  79           HE3      MET  79  -4.443  -3.826   9.407
  626   3HE   MET  79           HE2      MET  79  -3.017  -2.922   9.909
  627    H    VAL  80           HN       VAL  80  -6.025  -4.563   3.263
  628    HA   VAL  80           HA       VAL  80  -7.130  -7.218   3.464
  629    HB   VAL  80           HB       VAL  80  -8.820  -6.310   1.831
  630   1HG1  VAL  80          HG12      VAL  80  -8.769  -6.023   4.426
  631   2HG1  VAL  80          HG11      VAL  80  -8.387  -4.340   4.064
  632   3HG1  VAL  80          HG13      VAL  80  -9.899  -5.045   3.490
  633   1HG2  VAL  80          HG22      VAL  80  -6.743  -4.276   1.583
  634   2HG2  VAL  80          HG21      VAL  80  -8.122  -4.601   0.535
  635   3HG2  VAL  80          HG23      VAL  80  -8.317  -3.578   1.958
  636    H    THR  81           HN       THR  81  -5.532  -5.434   0.809
  637    HA   THR  81           HA       THR  81  -5.928  -7.431  -1.193
  638    HB   THR  81           HB       THR  81  -3.479  -5.669  -1.037
  639    HG1  THR  81           HG1      THR  81  -6.135  -4.989  -1.205
  640   1HG2  THR  81          HG23      THR  81  -4.405  -7.490  -2.924
  641   2HG2  THR  81          HG22      THR  81  -4.928  -5.930  -3.560
  642   3HG2  THR  81          HG21      THR  81  -3.222  -6.214  -3.214
  643    H    THR  82           HN       THR  82  -4.013  -7.512   1.625
  644    HA   THR  82           HA       THR  82  -2.363  -9.726   0.467
  645    HB   THR  82           HB       THR  82  -0.766  -9.279   2.305
  646    HG1  THR  82           HG1      THR  82  -2.658  -7.259   2.902
  647   1HG2  THR  82          HG23      THR  82  -1.574  -6.961   0.543
  648   2HG2  THR  82          HG22      THR  82  -0.130  -6.920   1.554
  649   3HG2  THR  82          HG21      THR  82  -0.278  -8.128   0.277
  650    H    ALA  83           HN       ALA  83  -4.956  -9.036   2.508
  651    HA   ALA  83           HA       ALA  83  -4.463 -11.426   4.212
  652   1HB   ALA  83           HB2      ALA  83  -6.336  -9.071   4.392
  653   2HB   ALA  83           HB1      ALA  83  -6.652 -10.541   5.315
  654   3HB   ALA  83           HB3      ALA  83  -5.159  -9.637   5.578
  655    H    CYS  84           HN       CYS  84  -4.863 -12.429   1.832
  656    HA   CYS  84           HA       CYS  84  -7.523 -13.636   1.992
  657   1HB   CYS  84           HB2      CYS  84  -7.940 -13.019  -0.494
  658   2HB   CYS  84           HB1      CYS  84  -8.273 -11.792   0.729
  659    HG   CYS  84           HG       CYS  84  -6.781 -10.550  -0.934
  660    H    HIS  85           HN       HIS  85  -4.617 -14.394   1.978
  661    HA   HIS  85           HA       HIS  85  -3.219 -16.009   0.988
  662   1HB   HIS  85           HB2      HIS  85  -5.254 -17.332   1.765
  663   2HB   HIS  85           HB1      HIS  85  -5.834 -17.250   0.100
  664    HD1  HIS  85           HD1      HIS  85  -5.193 -19.258  -1.217
  665    HD2  HIS  85           HD2      HIS  85  -2.322 -18.353   1.669
  666    HE1  HIS  85           HE1      HIS  85  -3.377 -21.009  -1.440
  667    H    GLU  86           HN       GLU  86  -3.686 -13.732  -0.665
  668    HA   GLU  86           HA       GLU  86  -3.873 -14.977  -3.380
  669   1HB   GLU  86           HB2      GLU  86  -5.384 -12.950  -2.557
  670   2HB   GLU  86           HB1      GLU  86  -3.951 -12.010  -2.974
  671   1HG   GLU  86           HG2      GLU  86  -4.549 -13.974  -5.033
  672   2HG   GLU  86           HG1      GLU  86  -5.925 -12.906  -4.750
  673    H    PHE  87           HN       PHE  87  -1.493 -15.340  -2.017
  674    HA   PHE  87           HA       PHE  87   0.431 -13.245  -2.498
  675   1HB   PHE  87           HB2      PHE  87   0.424 -15.726  -1.192
  676   2HB   PHE  87           HB1      PHE  87   1.582 -15.916  -2.509
  677    HD1  PHE  87           HD1      PHE  87   0.595 -13.410   0.104
  678    HD2  PHE  87           HD2      PHE  87   3.775 -15.190  -2.171
  679    HE1  PHE  87           HE1      PHE  87   2.250 -12.067   1.369
  680    HE2  PHE  87           HE2      PHE  87   5.432 -13.847  -0.905
  681    HZ   PHE  87           HZ       PHE  87   4.669 -12.285   0.865
  682    H    PHE  88           HN       PHE  88   0.512 -12.568  -4.638
  683    HA   PHE  88           HA       PHE  88   0.823 -12.697  -6.964
  684   1HB   PHE  88           HB2      PHE  88   2.670 -14.962  -6.177
  685   2HB   PHE  88           HB1      PHE  88   2.816 -13.905  -7.582
  686    HD1  PHE  88           HD2      PHE  88   2.864 -11.313  -7.015
  687    HD2  PHE  88           HD1      PHE  88   3.901 -14.438  -4.262
  688    HE1  PHE  88           HE2      PHE  88   4.152  -9.688  -5.655
  689    HE2  PHE  88           HE1      PHE  88   5.191 -12.813  -2.902
  690    HZ   PHE  88           HZ       PHE  88   5.314 -10.437  -3.600
  691    H    GLU  89           HN       GLU  89  -1.163 -13.448  -7.737
  692    HA   GLU  89           HA       GLU  89  -1.703 -16.353  -7.735
  693   1HB   GLU  89           HB2      GLU  89  -3.470 -14.597  -7.237
  694   2HB   GLU  89           HB1      GLU  89  -3.382 -14.142  -8.939
  695   1HG   GLU  89           HG2      GLU  89  -5.152 -15.701  -8.870
  696   2HG   GLU  89           HG1      GLU  89  -3.775 -16.660  -9.418
  697    H    HIS  90           HN       HIS  90   0.030 -14.276  -9.657
  698    HA   HIS  90           HA       HIS  90  -0.704 -14.672 -12.296
  699   1HB   HIS  90           HB2      HIS  90   1.549 -14.282 -12.901
  700   2HB   HIS  90           HB1      HIS  90   1.386 -13.490 -11.334
  701    HD1  HIS  90           HD1      HIS  90   3.074 -16.340 -13.047
  702    HD2  HIS  90           HD2      HIS  90   2.674 -14.886  -9.161
  703    HE1  HIS  90           HE1      HIS  90   4.805 -17.548 -11.647
  704    H    GLU  91           HN       GLU  91   0.474 -17.094 -10.064
  705    HA   GLU  91           HA       GLU  91   1.420 -19.098 -11.760
  706   1HB   GLU  91           HB2      GLU  91   1.297 -19.313  -9.290
  707   2HB   GLU  91           HB1      GLU  91  -0.454 -19.502  -9.406
  708   1HG   GLU  91           HG2      GLU  91   0.286 -21.727  -9.340
  709   2HG   GLU  91           HG1      GLU  91   0.117 -21.435 -11.072
  710   1H    MET   0           HT3      MET   0  -7.171  -2.779 -14.793
  711   2H    MET   0           HT2      MET   0  -7.167  -3.373 -16.386
  712   3H    MET   0           HT1      MET   0  -7.335  -1.707 -16.096
  713    HA   MET   0           HA       MET   0  -9.464  -2.661 -16.676
  714   1HB   MET   0           HB2      MET   0  -8.649  -4.923 -15.577
  715   2HB   MET   0           HB1      MET   0  -9.407  -4.250 -14.132
  716   1HG   MET   0           HG2      MET   0 -11.538  -4.161 -15.144
  717   2HG   MET   0           HG1      MET   0 -10.868  -4.303 -16.770
  718   1HE   MET   0           HE1      MET   0 -12.659  -5.946 -14.050
  719   2HE   MET   0           HE3      MET   0 -13.302  -5.959 -15.697
  720   3HE   MET   0           HE2      MET   0 -12.957  -7.476 -14.871
  721    H    SER   1           HN       SER   1  -8.371  -2.306 -13.281
  722    HA   SER   1           HA       SER   1 -10.439  -0.159 -12.995
  723   1HB   SER   1           HB2      SER   1 -11.240  -1.715 -11.482
  724   2HB   SER   1           HB1      SER   1  -9.646  -2.404 -11.187
  725    HG   SER   1           HG       SER   1 -10.898  -0.184 -10.054
  726    H    GLU   2           HN       GLU   2  -9.806   1.423 -11.189
  727    HA   GLU   2           HA       GLU   2  -7.076   2.340 -11.708
  728   1HB   GLU   2           HB2      GLU   2  -9.431   3.616 -11.092
  729   2HB   GLU   2           HB1      GLU   2  -8.586   3.655  -9.544
  730   1HG   GLU   2           HG2      GLU   2  -7.810   5.603 -10.604
  731   2HG   GLU   2           HG1      GLU   2  -6.535   4.436 -10.953
  732    H    LEU   3           HN       LEU   3  -8.863   0.915  -9.005
  733    HA   LEU   3           HA       LEU   3  -6.629   1.167  -7.143
  734   1HB   LEU   3           HB2      LEU   3  -9.145   0.980  -6.580
  735   2HB   LEU   3           HB1      LEU   3  -8.948  -0.747  -6.865
  736    HG   LEU   3           HG       LEU   3  -7.138  -0.819  -5.184
  737   1HD1  LEU   3          HD13      LEU   3  -7.301   2.041  -5.517
  738   2HD1  LEU   3          HD12      LEU   3  -7.550   1.630  -3.819
  739   3HD1  LEU   3          HD11      LEU   3  -6.088   1.097  -4.651
  740   1HD2  LEU   3          HD23      LEU   3  -9.783  -0.818  -4.699
  741   2HD2  LEU   3          HD22      LEU   3  -8.597  -0.959  -3.402
  742   3HD2  LEU   3          HD21      LEU   3  -9.339   0.602  -3.750
  743    H    GLU   4           HN       GLU   4  -8.157  -1.569  -8.853
  744    HA   GLU   4           HA       GLU   4  -6.429  -3.614  -8.004
  745   1HB   GLU   4           HB2      GLU   4  -8.383  -4.164  -9.294
  746   2HB   GLU   4           HB1      GLU   4  -7.832  -3.196 -10.658
  747   1HG   GLU   4           HG2      GLU   4  -5.767  -4.792 -10.654
  748   2HG   GLU   4           HG1      GLU   4  -6.794  -5.852  -9.688
  749    H    LYS   5           HN       LYS   5  -6.063  -1.557 -10.907
  750    HA   LYS   5           HA       LYS   5  -3.612  -2.655 -11.794
  751   1HB   LYS   5           HB2      LYS   5  -5.247  -0.399 -12.435
  752   2HB   LYS   5           HB1      LYS   5  -3.578   0.157 -12.298
  753   1HG   LYS   5           HG2      LYS   5  -2.854  -1.133 -14.066
  754   2HG   LYS   5           HG1      LYS   5  -4.062  -2.389 -13.780
  755   1HD   LYS   5           HD2      LYS   5  -5.254  -1.488 -15.468
  756   2HD   LYS   5           HD1      LYS   5  -5.559  -0.110 -14.410
  757   1HE   LYS   5           HE2      LYS   5  -4.602   0.897 -16.307
  758   2HE   LYS   5           HE1      LYS   5  -3.225   0.727 -15.219
  759   1HZ   LYS   5           HZ2      LYS   5  -3.966  -1.177 -17.375
  760   2HZ   LYS   5           HZ1      LYS   5  -2.701  -0.046 -17.450
  761   3HZ   LYS   5           HZ3      LYS   5  -2.630  -1.323 -16.336
  762    H    ALA   6           HN       ALA   6  -4.221  -0.189  -9.327
  763    HA   ALA   6           HA       ALA   6  -1.377   0.420  -9.039
  764   1HB   ALA   6           HB3      ALA   6  -3.536   1.872  -8.481
  765   2HB   ALA   6           HB2      ALA   6  -3.355   1.100  -6.906
  766   3HB   ALA   6           HB1      ALA   6  -2.040   2.069  -7.569
  767    H    MET   7           HN       MET   7  -3.659  -0.725  -6.544
  768    HA   MET   7           HA       MET   7  -1.774  -1.739  -4.755
  769   1HB   MET   7           HB2      MET   7  -4.043  -1.657  -4.038
  770   2HB   MET   7           HB1      MET   7  -4.590  -2.635  -5.403
  771   1HG   MET   7           HG2      MET   7  -4.524  -3.981  -3.339
  772   2HG   MET   7           HG1      MET   7  -3.344  -4.574  -4.509
  773   1HE   MET   7           HE1      MET   7  -4.021  -2.507  -1.337
  774   2HE   MET   7           HE3      MET   7  -2.433  -1.862  -0.905
  775   3HE   MET   7           HE2      MET   7  -3.239  -1.317  -2.374
  776    H    VAL   8           HN       VAL   8  -3.481  -3.593  -7.282
  777    HA   VAL   8           HA       VAL   8  -2.022  -6.010  -6.885
  778    HB   VAL   8           HB       VAL   8  -3.146  -5.104  -9.540
  779   1HG1  VAL   8          HG11      VAL   8  -2.871  -7.785  -8.146
  780   2HG1  VAL   8          HG13      VAL   8  -3.687  -7.542  -9.690
  781   3HG1  VAL   8          HG12      VAL   8  -1.956  -7.238  -9.549
  782   1HG2  VAL   8          HG22      VAL   8  -4.523  -5.130  -7.082
  783   2HG2  VAL   8          HG21      VAL   8  -5.242  -5.093  -8.690
  784   3HG2  VAL   8          HG23      VAL   8  -4.975  -6.635  -7.881
  785    H    ALA   9           HN       ALA   9  -1.233  -3.082  -8.657
  786    HA   ALA   9           HA       ALA   9   0.882  -4.198 -10.266
  787   1HB   ALA   9           HB2      ALA   9   0.140  -1.437  -9.344
  788   2HB   ALA   9           HB1      ALA   9   1.723  -1.701 -10.077
  789   3HB   ALA   9           HB3      ALA   9   0.256  -2.070 -10.986
  790    H    LEU  10           HN       LEU  10   0.843  -2.669  -7.042
  791    HA   LEU  10           HA       LEU  10   3.602  -2.633  -6.524
  792   1HB   LEU  10           HB2      LEU  10   1.165  -2.541  -4.963
  793   2HB   LEU  10           HB1      LEU  10   2.381  -3.512  -4.135
  794    HG   LEU  10           HG       LEU  10   3.400  -1.014  -5.343
  795   1HD1  LEU  10          HD12      LEU  10   1.000  -0.954  -3.772
  796   2HD1  LEU  10          HD11      LEU  10   2.314  -0.261  -2.821
  797   3HD1  LEU  10          HD13      LEU  10   1.927   0.405  -4.408
  798   1HD2  LEU  10          HD22      LEU  10   4.089  -2.896  -3.320
  799   2HD2  LEU  10          HD21      LEU  10   5.019  -1.497  -3.852
  800   3HD2  LEU  10          HD23      LEU  10   3.867  -1.337  -2.526
  801    H    ILE  11           HN       ILE  11   1.292  -5.321  -6.153
  802    HA   ILE  11           HA       ILE  11   3.031  -7.248  -5.049
  803    HB   ILE  11           HB       ILE  11   0.832  -7.612  -7.111
  804   1HG1  ILE  11          HG12      ILE  11   0.795  -8.062  -4.113
  805   2HG1  ILE  11          HG11      ILE  11   0.226  -6.579  -4.880
  806   1HG2  ILE  11          HG22      ILE  11   2.609  -9.485  -6.804
  807   2HG2  ILE  11          HG21      ILE  11   1.855  -9.729  -5.228
  808   3HG2  ILE  11          HG23      ILE  11   0.905  -9.928  -6.702
  809   1HD1  ILE  11          HD12      ILE  11  -0.926  -8.829  -6.242
  810   2HD1  ILE  11          HD11      ILE  11  -1.212  -9.003  -4.510
  811   3HD1  ILE  11          HD13      ILE  11  -1.748  -7.548  -5.350
  812    H    ASP  12           HN       ASP  12   2.568  -6.281  -8.436
  813    HA   ASP  12           HA       ASP  12   4.232  -8.178  -9.691
  814   1HB   ASP  12           HB2      ASP  12   2.789  -6.416 -10.803
  815   2HB   ASP  12           HB1      ASP  12   4.061  -5.250 -10.451
  816    H    VAL  13           HN       VAL  13   5.147  -4.910  -8.573
  817    HA   VAL  13           HA       VAL  13   7.865  -4.922  -9.084
  818    HB   VAL  13           HB       VAL  13   6.366  -3.906  -6.661
  819   1HG1  VAL  13          HG11      VAL  13   9.304  -3.599  -7.347
  820   2HG1  VAL  13          HG13      VAL  13   8.457  -2.595  -6.170
  821   3HG1  VAL  13          HG12      VAL  13   8.627  -4.329  -5.891
  822   1HG2  VAL  13          HG21      VAL  13   6.775  -2.996  -9.323
  823   2HG2  VAL  13          HG23      VAL  13   5.975  -2.143  -8.003
  824   3HG2  VAL  13          HG22      VAL  13   7.708  -1.937  -8.265
  825    H    PHE  14           HN       PHE  14   6.173  -6.754  -6.596
  826    HA   PHE  14           HA       PHE  14   8.474  -7.573  -5.104
  827   1HB   PHE  14           HB2      PHE  14   5.775  -7.960  -4.844
  828   2HB   PHE  14           HB1      PHE  14   6.309  -9.564  -5.346
  829    HD1  PHE  14           HD2      PHE  14   6.881  -6.858  -2.853
  830    HD2  PHE  14           HD1      PHE  14   7.528 -10.982  -3.869
  831    HE1  PHE  14           HE2      PHE  14   7.750  -7.283  -0.570
  832    HE2  PHE  14           HE1      PHE  14   8.400 -11.407  -1.586
  833    HZ   PHE  14           HZ       PHE  14   8.510  -9.557   0.064
  834    H    HIS  15           HN       HIS  15   6.594  -9.688  -7.304
  835    HA   HIS  15           HA       HIS  15   8.458 -11.721  -7.600
  836   1HB   HIS  15           HB2      HIS  15   6.078 -11.265  -8.736
  837   2HB   HIS  15           HB1      HIS  15   7.103 -10.818 -10.101
  838    HD1  HIS  15           HD1      HIS  15   5.756 -13.182 -10.921
  839    HD2  HIS  15           HD2      HIS  15   8.969 -13.527  -8.286
  840    HE1  HIS  15           HE1      HIS  15   6.547 -15.584 -11.068
  841    H    GLN  16           HN       GLN  16   8.661  -8.485  -8.878
  842    HA   GLN  16           HA       GLN  16  10.683  -9.081 -10.878
  843   1HB   GLN  16           HB2      GLN  16   9.108  -7.001 -10.668
  844   2HB   GLN  16           HB1      GLN  16  10.356  -6.383  -9.585
  845   1HG   GLN  16           HG2      GLN  16  11.524  -5.726 -11.393
  846   2HG   GLN  16           HG1      GLN  16  11.723  -7.424 -11.826
  847   1HE2  GLN  16          HE22      GLN  16   9.696  -5.260 -14.371
  848   2HE2  GLN  16          HE21      GLN  16  10.975  -4.750 -13.379
  849    H    TYR  17           HN       TYR  17  10.826  -7.533  -7.650
  850    HA   TYR  17           HA       TYR  17  13.767  -7.827  -7.657
  851   1HB   TYR  17           HB2      TYR  17  11.808  -6.523  -5.752
  852   2HB   TYR  17           HB1      TYR  17  13.530  -6.666  -5.397
  853    HD1  TYR  17           HD1      TYR  17  11.224  -5.528  -8.129
  854    HD2  TYR  17           HD2      TYR  17  14.978  -4.981  -6.115
  855    HE1  TYR  17           HE1      TYR  17  11.682  -3.527  -9.524
  856    HE2  TYR  17           HE2      TYR  17  15.436  -2.981  -7.507
  857    HH   TYR  17           HH       TYR  17  13.566  -1.236  -8.889
  858    H    SER  18           HN       SER  18  11.698 -10.115  -7.363
  859    HA   SER  18           HA       SER  18  12.597 -11.134  -4.706
  860   1HB   SER  18           HB2      SER  18  10.103 -11.093  -5.426
  861   2HB   SER  18           HB1      SER  18  10.529 -12.445  -6.471
  862    HG   SER  18           HG       SER  18  10.085 -13.479  -4.652
  863    H    GLY  19           HN       GLY  19  12.687 -11.768  -8.165
  864   1HA   GLY  19           HA2      GLY  19  13.867 -14.412  -7.902
  865   2HA   GLY  19           HA1      GLY  19  13.788 -13.460  -9.385
  866    H    ARG  20           HN       ARG  20  15.092 -11.116  -8.170
  867    HA   ARG  20           HA       ARG  20  17.787 -11.663  -8.828
  868   1HB   ARG  20           HB2      ARG  20  16.752  -9.532  -6.931
  869   2HB   ARG  20           HB1      ARG  20  18.314  -9.520  -7.751
  870   1HG   ARG  20           HG2      ARG  20  16.556  -9.916  -9.841
  871   2HG   ARG  20           HG1      ARG  20  15.656  -8.823  -8.790
  872   1HD   ARG  20           HD2      ARG  20  17.279  -7.138  -8.932
  873   2HD   ARG  20           HD1      ARG  20  18.547  -8.268  -9.409
  874    HE   ARG  20           HE       ARG  20  17.672  -8.244 -11.659
  875   1HH1  ARG  20          HH21      ARG  20  14.809  -8.069 -11.416
  876   2HH1  ARG  20          HH22      ARG  20  14.449  -6.407 -11.746
  877   1HH2  ARG  20          HH11      ARG  20  17.701  -5.325 -11.227
  878   2HH2  ARG  20          HH12      ARG  20  16.087  -4.854 -11.640
  879    H    GLU  21           HN       GLU  21  16.689 -10.910  -5.516
  880    HA   GLU  21           HA       GLU  21  18.626 -12.976  -4.547
  881   1HB   GLU  21           HB2      GLU  21  18.422 -10.147  -3.923
  882   2HB   GLU  21           HB1      GLU  21  18.232 -11.127  -2.468
  883   1HG   GLU  21           HG2      GLU  21  20.299 -12.414  -3.207
  884   2HG   GLU  21           HG1      GLU  21  20.538 -11.164  -4.428
  885    H    GLY  22           HN       GLY  22  17.882 -12.911  -1.848
  886   1HA   GLY  22           HA2      GLY  22  16.331 -13.983  -0.444
  887   2HA   GLY  22           HA1      GLY  22  15.151 -12.925  -1.220
  888    H    ASP  23           HN       ASP  23  14.058 -15.236  -0.604
  889    HA   ASP  23           HA       ASP  23  14.478 -17.384  -2.473
  890   1HB   ASP  23           HB2      ASP  23  12.007 -16.731  -0.840
  891   2HB   ASP  23           HB1      ASP  23  12.407 -18.288  -1.557
  892    H    LYS  24           HN       LYS  24  11.768 -17.879  -3.292
  893    HA   LYS  24           HA       LYS  24  11.628 -15.945  -5.536
  894   1HB   LYS  24           HB2      LYS  24  10.215 -18.586  -5.056
  895   2HB   LYS  24           HB1      LYS  24  10.022 -17.597  -6.503
  896   1HG   LYS  24           HG2      LYS  24  12.832 -18.013  -5.897
  897   2HG   LYS  24           HG1      LYS  24  11.987 -19.551  -6.068
  898   1HD   LYS  24           HD2      LYS  24  10.948 -18.068  -8.153
  899   2HD   LYS  24           HD1      LYS  24  12.630 -17.539  -8.107
  900   1HE   LYS  24           HE2      LYS  24  13.370 -19.519  -8.906
  901   2HE   LYS  24           HE1      LYS  24  12.380 -20.428  -7.764
  902   1HZ   LYS  24           HZ1      LYS  24  10.449 -19.849  -9.256
  903   2HZ   LYS  24           HZ3      LYS  24  11.591 -19.343 -10.404
  904   3HZ   LYS  24           HZ2      LYS  24  11.570 -20.961  -9.885
  905    H    HIS  25           HN       HIS  25  10.437 -15.975  -2.514
  906    HA   HIS  25           HA       HIS  25   8.105 -14.345  -3.295
  907   1HB   HIS  25           HB2      HIS  25   7.775 -16.703  -1.417
  908   2HB   HIS  25           HB1      HIS  25   6.512 -15.601  -1.969
  909    HD1  HIS  25           HD1      HIS  25   8.400 -18.633  -2.944
  910    HD2  HIS  25           HD2      HIS  25   5.857 -15.898  -4.794
  911    HE1  HIS  25           HE1      HIS  25   7.697 -19.682  -5.140
  912    H    LYS  26           HN       LYS  26  10.734 -14.009  -1.907
  913    HA   LYS  26           HA       LYS  26   9.657 -12.662   0.520
  914   1HB   LYS  26           HB2      LYS  26  12.225 -14.256   0.641
  915   2HB   LYS  26           HB1      LYS  26  11.283 -13.596   1.979
  916   1HG   LYS  26           HG2      LYS  26  10.125 -15.666   0.110
  917   2HG   LYS  26           HG1      LYS  26  11.071 -16.128   1.524
  918   1HD   LYS  26           HD2      LYS  26   8.934 -14.115   1.982
  919   2HD   LYS  26           HD1      LYS  26   8.395 -15.755   1.615
  920   1HE   LYS  26           HE2      LYS  26  10.252 -14.900   3.850
  921   2HE   LYS  26           HE1      LYS  26   8.639 -15.594   4.012
  922   1HZ   LYS  26           HZ1      LYS  26   9.917 -17.419   2.494
  923   2HZ   LYS  26           HZ3      LYS  26  11.160 -16.897   3.525
  924   3HZ   LYS  26           HZ2      LYS  26   9.722 -17.521   4.180
  925    H    LEU  27           HN       LEU  27  10.648 -10.688   0.866
  926    HA   LEU  27           HA       LEU  27  12.649  -9.850  -1.157
  927   1HB   LEU  27           HB2      LEU  27  10.470  -8.581   0.192
  928   2HB   LEU  27           HB1      LEU  27  11.948  -7.727   0.630
  929    HG   LEU  27           HG       LEU  27  10.829  -6.874  -1.472
  930   1HD1  LEU  27          HD13      LEU  27  13.645  -7.954  -1.455
  931   2HD1  LEU  27          HD12      LEU  27  13.028  -7.055  -2.841
  932   3HD1  LEU  27          HD11      LEU  27  13.104  -6.287  -1.255
  933   1HD2  LEU  27          HD21      LEU  27  10.403  -9.439  -2.099
  934   2HD2  LEU  27          HD23      LEU  27  10.594  -8.209  -3.347
  935   3HD2  LEU  27          HD22      LEU  27  11.957  -9.241  -2.911
  936    H    LYS  28           HN       LYS  28  13.784  -7.741   0.453
  937    HA   LYS  28           HA       LYS  28  15.051  -9.071   2.758
  938   1HB   LYS  28           HB2      LYS  28  16.308  -8.937   0.169
  939   2HB   LYS  28           HB1      LYS  28  17.187  -7.897   1.290
  940   1HG   LYS  28           HG2      LYS  28  16.460 -10.395   2.570
  941   2HG   LYS  28           HG1      LYS  28  17.375 -10.695   1.093
  942   1HD   LYS  28           HD2      LYS  28  18.295  -8.607   3.060
  943   2HD   LYS  28           HD1      LYS  28  18.696 -10.308   3.304
  944   1HE   LYS  28           HE2      LYS  28  19.166  -9.162   0.589
  945   2HE   LYS  28           HE1      LYS  28  20.276  -8.690   1.876
  946   1HZ   LYS  28           HZ2      LYS  28  19.571 -11.504   1.251
  947   2HZ   LYS  28           HZ1      LYS  28  20.947 -10.717   0.639
  948   3HZ   LYS  28           HZ3      LYS  28  20.782 -10.958   2.310
  949    H    LYS  29           HN       LYS  29  16.530  -7.399   3.886
  950    HA   LYS  29           HA       LYS  29  15.078  -4.866   3.973
  951   1HB   LYS  29           HB2      LYS  29  15.832  -5.183   6.084
  952   2HB   LYS  29           HB1      LYS  29  17.139  -6.224   5.563
  953   1HG   LYS  29           HG2      LYS  29  17.239  -3.231   5.170
  954   2HG   LYS  29           HG1      LYS  29  17.782  -3.982   6.665
  955   1HD   LYS  29           HD2      LYS  29  19.027  -4.036   3.952
  956   2HD   LYS  29           HD1      LYS  29  19.787  -3.947   5.533
  957   1HE   LYS  29           HE2      LYS  29  19.318  -6.334   5.914
  958   2HE   LYS  29           HE1      LYS  29  18.522  -6.441   4.345
  959   1HZ   LYS  29           HZ3      LYS  29  20.924  -5.305   3.777
  960   2HZ   LYS  29           HZ2      LYS  29  21.318  -6.436   4.981
  961   3HZ   LYS  29           HZ1      LYS  29  20.531  -6.940   3.562
  962    H    SER  30           HN       SER  30  18.064  -6.063   2.587
  963    HA   SER  30           HA       SER  30  19.039  -3.397   1.871
  964   1HB   SER  30           HB2      SER  30  20.068  -6.079   1.840
  965   2HB   SER  30           HB1      SER  30  20.249  -5.387   0.229
  966    HG   SER  30           HG       SER  30  21.854  -4.979   2.136
  967    H    GLU  31           HN       GLU  31  17.027  -5.853   0.382
  968    HA   GLU  31           HA       GLU  31  17.139  -4.496  -2.240
  969   1HB   GLU  31           HB2      GLU  31  16.909  -7.090  -1.754
  970   2HB   GLU  31           HB1      GLU  31  15.199  -6.694  -1.584
  971   1HG   GLU  31           HG2      GLU  31  15.037  -6.781  -3.830
  972   2HG   GLU  31           HG1      GLU  31  16.039  -5.331  -3.893
  973    H    LEU  32           HN       LEU  32  15.255  -4.590   0.648
  974    HA   LEU  32           HA       LEU  32  12.872  -3.401  -0.570
  975   1HB   LEU  32           HB2      LEU  32  12.398  -4.723   1.344
  976   2HB   LEU  32           HB1      LEU  32  13.731  -4.024   2.260
  977    HG   LEU  32           HG       LEU  32  12.584  -1.965   2.569
  978   1HD1  LEU  32          HD13      LEU  32  11.301  -2.723   0.087
  979   2HD1  LEU  32          HD12      LEU  32  10.093  -2.247   1.278
  980   3HD1  LEU  32          HD11      LEU  32  11.393  -1.136   0.847
  981   1HD2  LEU  32          HD23      LEU  32  11.197  -4.475   3.120
  982   2HD2  LEU  32          HD22      LEU  32  11.407  -3.064   4.158
  983   3HD2  LEU  32          HD21      LEU  32  10.078  -3.117   2.998
  984    H    LYS  33           HN       LYS  33  15.697  -2.397   1.288
  985    HA   LYS  33           HA       LYS  33  14.929   0.339   1.681
  986   1HB   LYS  33           HB2      LYS  33  16.957  -1.186   2.589
  987   2HB   LYS  33           HB1      LYS  33  17.803  -0.347   1.293
  988   1HG   LYS  33           HG2      LYS  33  16.529   1.758   2.377
  989   2HG   LYS  33           HG1      LYS  33  16.640   0.740   3.814
  990   1HD   LYS  33           HD2      LYS  33  19.102   0.464   3.326
  991   2HD   LYS  33           HD1      LYS  33  18.925   1.681   2.063
  992   1HE   LYS  33           HE2      LYS  33  17.742   2.996   4.099
  993   2HE   LYS  33           HE1      LYS  33  18.868   1.998   5.020
  994   1HZ   LYS  33           HZ2      LYS  33  19.632   3.697   2.707
  995   2HZ   LYS  33           HZ1      LYS  33  19.810   4.153   4.334
  996   3HZ   LYS  33           HZ3      LYS  33  20.682   2.832   3.724
  997    H    GLU  34           HN       GLU  34  16.458  -1.427  -0.932
  998    HA   GLU  34           HA       GLU  34  17.096   0.995  -2.452
  999   1HB   GLU  34           HB2      GLU  34  18.091  -0.449  -4.017
 1000   2HB   GLU  34           HB1      GLU  34  18.259  -1.363  -2.521
 1001   1HG   GLU  34           HG2      GLU  34  16.404  -2.769  -3.051
 1002   2HG   GLU  34           HG1      GLU  34  15.913  -1.739  -4.394
 1003    H    LEU  35           HN       LEU  35  14.650  -1.519  -2.424
 1004    HA   LEU  35           HA       LEU  35  13.206  -0.955  -4.756
 1005   1HB   LEU  35           HB2      LEU  35  12.814  -2.505  -2.485
 1006   2HB   LEU  35           HB1      LEU  35  11.485  -1.342  -2.407
 1007    HG   LEU  35           HG       LEU  35  10.701  -3.220  -3.693
 1008   1HD1  LEU  35          HD11      LEU  35  11.043  -0.603  -4.845
 1009   2HD1  LEU  35          HD13      LEU  35  11.118  -1.815  -6.123
 1010   3HD1  LEU  35          HD12      LEU  35   9.710  -1.736  -5.063
 1011   1HD2  LEU  35          HD23      LEU  35  13.336  -3.613  -4.325
 1012   2HD2  LEU  35          HD22      LEU  35  11.995  -4.428  -5.128
 1013   3HD2  LEU  35          HD21      LEU  35  12.709  -2.985  -5.849
 1014    H    ILE  36           HN       ILE  36  12.774   0.548  -1.542
 1015    HA   ILE  36           HA       ILE  36  10.948   2.571  -2.611
 1016    HB   ILE  36           HB       ILE  36  12.268   2.953   0.035
 1017   1HG1  ILE  36          HG12      ILE  36  10.727   0.503  -0.754
 1018   2HG1  ILE  36          HG11      ILE  36  12.074   0.664   0.364
 1019   1HG2  ILE  36          HG23      ILE  36   9.411   3.044  -0.979
 1020   2HG2  ILE  36          HG22      ILE  36   9.900   3.426   0.673
 1021   3HG2  ILE  36          HG21      ILE  36  10.461   4.426  -0.664
 1022   1HD1  ILE  36          HD11      ILE  36  10.220   2.156   1.665
 1023   2HD1  ILE  36          HD13      ILE  36   9.169   0.990   0.859
 1024   3HD1  ILE  36          HD12      ILE  36  10.440   0.428   1.943
 1025    H    ASN  37           HN       ASN  37  14.201   2.641  -1.183
 1026    HA   ASN  37           HA       ASN  37  14.698   5.402  -1.730
 1027   1HB   ASN  37           HB2      ASN  37  15.947   3.854  -0.120
 1028   2HB   ASN  37           HB1      ASN  37  16.834   3.282  -1.536
 1029   1HD2  ASN  37          HD22      ASN  37  17.638   6.971   0.002
 1030   2HD2  ASN  37          HD21      ASN  37  16.369   6.032   0.626
 1031    H    ASN  38           HN       ASN  38  14.314   2.975  -3.987
 1032    HA   ASN  38           HA       ASN  38  16.365   4.097  -5.825
 1033   1HB   ASN  38           HB2      ASN  38  16.238   1.631  -5.648
 1034   2HB   ASN  38           HB1      ASN  38  14.552   1.688  -6.164
 1035   1HD2  ASN  38          HD22      ASN  38  15.348   1.994  -9.586
 1036   2HD2  ASN  38          HD21      ASN  38  14.133   1.847  -8.410
 1037    H    GLU  39           HN       GLU  39  12.862   3.474  -5.619
 1038    HA   GLU  39           HA       GLU  39  12.510   5.456  -7.833
 1039   1HB   GLU  39           HB2      GLU  39  11.764   3.081  -8.303
 1040   2HB   GLU  39           HB1      GLU  39  10.565   3.278  -7.023
 1041   1HG   GLU  39           HG2      GLU  39   9.458   3.808  -9.087
 1042   2HG   GLU  39           HG1      GLU  39   9.746   5.338  -8.256
 1043    H    LEU  40           HN       LEU  40  11.333   4.326  -4.697
 1044    HA   LEU  40           HA       LEU  40   9.279   6.355  -4.442
 1045   1HB   LEU  40           HB2      LEU  40  10.634   4.475  -2.503
 1046   2HB   LEU  40           HB1      LEU  40   9.418   5.630  -1.986
 1047    HG   LEU  40           HG       LEU  40   8.805   3.124  -2.737
 1048   1HD1  LEU  40          HD11      LEU  40   7.462   5.579  -2.343
 1049   2HD1  LEU  40          HD13      LEU  40   6.732   4.818  -3.758
 1050   3HD1  LEU  40          HD12      LEU  40   6.796   3.949  -2.224
 1051   1HD2  LEU  40          HD21      LEU  40   8.578   4.770  -5.279
 1052   2HD2  LEU  40          HD23      LEU  40   9.657   3.395  -5.039
 1053   3HD2  LEU  40          HD22      LEU  40   7.911   3.156  -5.045
 1054    H    SER  41           HN       SER  41  12.695   6.291  -3.958
 1055    HA   SER  41           HA       SER  41  12.870   8.389  -1.985
 1056   1HB   SER  41           HB2      SER  41  14.917   7.395  -2.044
 1057   2HB   SER  41           HB1      SER  41  14.720   6.877  -3.716
 1058    HG   SER  41           HG       SER  41  15.933   8.505  -4.222
 1059    H    HIS  42           HN       HIS  42  11.942   8.443  -5.243
 1060    HA   HIS  42           HA       HIS  42  13.008  11.135  -5.782
 1061   1HB   HIS  42           HB2      HIS  42  12.453   9.107  -7.457
 1062   2HB   HIS  42           HB1      HIS  42  10.900   9.943  -7.519
 1063    HD1  HIS  42           HD1      HIS  42  14.432  10.207  -8.622
 1064    HD2  HIS  42           HD2      HIS  42  11.083  12.687  -8.474
 1065    HE1  HIS  42           HE1      HIS  42  14.956  12.204 -10.088
 1066    H    PHE  43           HN       PHE  43  10.874  10.362  -3.640
 1067    HA   PHE  43           HA       PHE  43   9.017  12.589  -4.356
 1068   1HB   PHE  43           HB2      PHE  43   8.230  10.018  -2.951
 1069   2HB   PHE  43           HB1      PHE  43   7.155  11.352  -3.371
 1070    HD1  PHE  43           HD2      PHE  43   7.578  12.116  -6.004
 1071    HD2  PHE  43           HD1      PHE  43   8.041   8.176  -4.356
 1072    HE1  PHE  43           HE2      PHE  43   7.238  11.134  -8.256
 1073    HE2  PHE  43           HE1      PHE  43   7.702   7.194  -6.607
 1074    HZ   PHE  43           HZ       PHE  43   7.300   8.672  -8.557
 1075    H    LEU  44           HN       LEU  44  10.888  13.556  -2.957
 1076    HA   LEU  44           HA       LEU  44   9.901  13.602  -0.158
 1077   1HB   LEU  44           HB2      LEU  44  12.786  13.121  -0.963
 1078   2HB   LEU  44           HB1      LEU  44  12.256  13.491   0.680
 1079    HG   LEU  44           HG       LEU  44  10.614  11.477   0.312
 1080   1HD1  LEU  44          HD13      LEU  44  11.962  11.494  -2.153
 1081   2HD1  LEU  44          HD12      LEU  44  12.644  10.128  -1.268
 1082   3HD1  LEU  44          HD11      LEU  44  10.905  10.222  -1.541
 1083   1HD2  LEU  44          HD21      LEU  44  12.590  11.622   1.891
 1084   2HD2  LEU  44          HD23      LEU  44  12.245   9.996   1.301
 1085   3HD2  LEU  44          HD22      LEU  44  13.580  10.920   0.610
 1086    H    GLU  45           HN       GLU  45  12.834  15.125  -0.133
 1087    HA   GLU  45           HA       GLU  45  13.495  17.364  -0.340
 1088   1HB   GLU  45           HB2      GLU  45  11.127  17.702  -2.200
 1089   2HB   GLU  45           HB1      GLU  45  12.589  18.685  -2.129
 1090   1HG   GLU  45           HG2      GLU  45  13.711  16.264  -2.544
 1091   2HG   GLU  45           HG1      GLU  45  12.167  16.013  -3.359
 1092    H    GLU  46           HN       GLU  46  10.868  16.257   1.169
 1093    HA   GLU  46           HA       GLU  46  10.457  18.707   2.675
 1094   1HB   GLU  46           HB2      GLU  46   8.320  17.698   0.784
 1095   2HB   GLU  46           HB1      GLU  46   7.926  18.669   2.202
 1096   1HG   GLU  46           HG2      GLU  46   9.851  20.231   1.227
 1097   2HG   GLU  46           HG1      GLU  46   9.386  19.453  -0.286
 1098    H    ILE  47           HN       ILE  47  11.194  15.850   3.027
 1099    HA   ILE  47           HA       ILE  47   9.296  14.144   4.050
 1100    HB   ILE  47           HB       ILE  47  11.977  14.822   5.289
 1101   1HG1  ILE  47          HG12      ILE  47  11.275  12.416   3.612
 1102   2HG1  ILE  47          HG11      ILE  47  11.731  13.938   2.847
 1103   1HG2  ILE  47          HG23      ILE  47   9.880  12.801   5.948
 1104   2HG2  ILE  47          HG22      ILE  47  11.562  12.272   5.999
 1105   3HG2  ILE  47          HG21      ILE  47  11.028  13.614   7.011
 1106   1HD1  ILE  47          HD13      ILE  47  13.760  13.859   4.505
 1107   2HD1  ILE  47          HD12      ILE  47  13.378  12.140   4.605
 1108   3HD1  ILE  47          HD11      ILE  47  13.797  12.860   3.051
 1109    H    LYS  48           HN       LYS  48   7.728  14.315   5.560
 1110    HA   LYS  48           HA       LYS  48   8.042  16.419   7.666
 1111   1HB   LYS  48           HB2      LYS  48   6.164  16.602   5.843
 1112   2HB   LYS  48           HB1      LYS  48   5.365  15.353   6.800
 1113   1HG   LYS  48           HG2      LYS  48   4.714  16.885   8.313
 1114   2HG   LYS  48           HG1      LYS  48   6.389  17.375   8.568
 1115   1HD   LYS  48           HD2      LYS  48   5.599  19.366   7.737
 1116   2HD   LYS  48           HD1      LYS  48   5.952  18.578   6.198
 1117   1HE   LYS  48           HE2      LYS  48   3.579  17.698   6.211
 1118   2HE   LYS  48           HE1      LYS  48   3.274  18.738   7.602
 1119   1HZ   LYS  48           HZ1      LYS  48   4.333  19.725   5.013
 1120   2HZ   LYS  48           HZ3      LYS  48   2.686  19.732   5.415
 1121   3HZ   LYS  48           HZ2      LYS  48   3.785  20.656   6.325
 1122    H    GLU  49           HN       GLU  49   6.607  13.211   6.971
 1123    HA   GLU  49           HA       GLU  49   6.175  12.668   9.806
 1124   1HB   GLU  49           HB2      GLU  49   5.822  11.164   7.246
 1125   2HB   GLU  49           HB1      GLU  49   5.989  10.227   8.729
 1126   1HG   GLU  49           HG2      GLU  49   4.074  12.550   8.567
 1127   2HG   GLU  49           HG1      GLU  49   3.601  10.935   8.035
 1128    H    GLN  50           HN       GLN  50   8.403  13.127  10.512
 1129    HA   GLN  50           HA       GLN  50  10.662  11.638   9.585
 1130   1HB   GLN  50           HB2      GLN  50  10.973  13.669  10.881
 1131   2HB   GLN  50           HB1      GLN  50  10.112  12.971  12.253
 1132   1HG   GLN  50           HG2      GLN  50  11.926  11.101  12.142
 1133   2HG   GLN  50           HG1      GLN  50  12.841  12.270  11.188
 1134   1HE2  GLN  50          HE22      GLN  50  13.879  12.992  14.631
 1135   2HE2  GLN  50          HE21      GLN  50  14.163  11.826  13.429
 1136    H    GLU  51           HN       GLU  51   8.116  10.876  11.878
 1137    HA   GLU  51           HA       GLU  51   9.552   8.630  13.056
 1138   1HB   GLU  51           HB2      GLU  51   7.035  10.001  13.470
 1139   2HB   GLU  51           HB1      GLU  51   6.789   8.255  13.454
 1140   1HG   GLU  51           HG2      GLU  51   9.069   8.458  14.957
 1141   2HG   GLU  51           HG1      GLU  51   8.221   9.935  15.414
 1142    H    VAL  52           HN       VAL  52   7.222   9.034  10.420
 1143    HA   VAL  52           HA       VAL  52   6.751   6.200  10.082
 1144    HB   VAL  52           HB       VAL  52   6.403   8.509   8.147
 1145   1HG1  VAL  52          HG13      VAL  52   6.127   5.624   7.839
 1146   2HG1  VAL  52          HG12      VAL  52   4.610   6.466   7.522
 1147   3HG1  VAL  52          HG11      VAL  52   6.061   6.890   6.613
 1148   1HG2  VAL  52          HG23      VAL  52   5.063   8.019  10.499
 1149   2HG2  VAL  52          HG22      VAL  52   4.384   8.888   9.122
 1150   3HG2  VAL  52          HG21      VAL  52   4.061   7.165   9.325
 1151    H    VAL  53           HN       VAL  53   8.884   8.530   8.410
 1152    HA   VAL  53           HA       VAL  53  10.017   6.429   6.734
 1153    HB   VAL  53           HB       VAL  53  10.937   9.272   7.279
 1154   1HG1  VAL  53          HG11      VAL  53  11.945   7.091   5.462
 1155   2HG1  VAL  53          HG13      VAL  53  12.125   8.784   5.000
 1156   3HG1  VAL  53          HG12      VAL  53  12.865   8.192   6.488
 1157   1HG2  VAL  53          HG21      VAL  53   8.698   8.419   5.929
 1158   2HG2  VAL  53          HG23      VAL  53   9.546   9.930   5.599
 1159   3HG2  VAL  53          HG22      VAL  53   9.890   8.495   4.631
 1160    H    ASP  54           HN       ASP  54  10.821   7.926   9.814
 1161    HA   ASP  54           HA       ASP  54  13.484   6.711   9.861
 1162   1HB   ASP  54           HB2      ASP  54  11.857   8.061  12.035
 1163   2HB   ASP  54           HB1      ASP  54  13.516   7.503  12.232
 1164    H    LYS  55           HN       LYS  55  10.255   5.732  10.606
 1165    HA   LYS  55           HA       LYS  55  11.067   3.698  12.544
 1166   1HB   LYS  55           HB2      LYS  55   8.826   4.567  12.745
 1167   2HB   LYS  55           HB1      LYS  55   8.478   4.205  11.054
 1168   1HG   LYS  55           HG2      LYS  55   9.375   1.788  12.252
 1169   2HG   LYS  55           HG1      LYS  55   8.177   2.494  13.340
 1170   1HD   LYS  55           HD2      LYS  55   6.766   2.874  11.197
 1171   2HD   LYS  55           HD1      LYS  55   7.854   1.703  10.450
 1172   1HE   LYS  55           HE2      LYS  55   7.316   0.246  12.558
 1173   2HE   LYS  55           HE1      LYS  55   5.910   1.300  12.711
 1174   1HZ   LYS  55           HZ1      LYS  55   6.496   0.154  10.082
 1175   2HZ   LYS  55           HZ3      LYS  55   5.840  -0.871  11.264
 1176   3HZ   LYS  55           HZ2      LYS  55   4.997   0.528  10.794
 1177    H    VAL  56           HN       VAL  56  10.101   3.724   9.097
 1178    HA   VAL  56           HA       VAL  56  10.625   0.850   8.864
 1179    HB   VAL  56           HB       VAL  56  10.394   1.436   6.360
 1180   1HG1  VAL  56          HG12      VAL  56   8.559   0.774   8.233
 1181   2HG1  VAL  56          HG11      VAL  56   7.922   2.341   7.735
 1182   3HG1  VAL  56          HG13      VAL  56   8.139   1.059   6.543
 1183   1HG2  VAL  56          HG22      VAL  56  10.669   4.021   7.336
 1184   2HG2  VAL  56          HG21      VAL  56  10.107   3.581   5.725
 1185   3HG2  VAL  56          HG23      VAL  56   8.942   3.881   7.015
 1186    H    MET  57           HN       MET  57  12.266   3.866   8.219
 1187    HA   MET  57           HA       MET  57  14.498   2.680   6.782
 1188   1HB   MET  57           HB2      MET  57  13.713   5.119   6.686
 1189   2HB   MET  57           HB1      MET  57  14.475   5.314   8.267
 1190   1HG   MET  57           HG2      MET  57  16.472   5.573   7.270
 1191   2HG   MET  57           HG1      MET  57  16.327   3.961   6.568
 1192   1HE   MET  57           HE3      MET  57  14.638   3.479   4.910
 1193   2HE   MET  57           HE2      MET  57  13.489   4.737   4.459
 1194   3HE   MET  57           HE1      MET  57  14.734   4.238   3.316
 1195    H    GLU  58           HN       GLU  58  13.657   3.120  10.145
 1196    HA   GLU  58           HA       GLU  58  16.434   2.855  11.054
 1197   1HB   GLU  58           HB2      GLU  58  13.773   3.084  12.387
 1198   2HB   GLU  58           HB1      GLU  58  15.052   2.277  13.288
 1199   1HG   GLU  58           HG2      GLU  58  16.473   4.374  12.442
 1200   2HG   GLU  58           HG1      GLU  58  14.879   5.127  12.409
 1201    H    THR  59           HN       THR  59  13.566   0.698  10.929
 1202    HA   THR  59           HA       THR  59  15.012  -1.568  12.009
 1203    HB   THR  59           HB       THR  59  12.553  -1.486  10.222
 1204    HG1  THR  59           HG1      THR  59  13.020  -1.205  12.946
 1205   1HG2  THR  59          HG23      THR  59  13.747  -3.677  10.246
 1206   2HG2  THR  59          HG22      THR  59  13.598  -3.705  12.002
 1207   3HG2  THR  59          HG21      THR  59  12.153  -3.763  10.993
 1208    H    LEU  60           HN       LEU  60  14.673  -0.080   8.909
 1209    HA   LEU  60           HA       LEU  60  15.659  -2.251   7.283
 1210   1HB   LEU  60           HB2      LEU  60  15.163   0.681   6.970
 1211   2HB   LEU  60           HB1      LEU  60  16.219  -0.090   5.793
 1212    HG   LEU  60           HG       LEU  60  13.439  -1.068   6.507
 1213   1HD1  LEU  60          HD11      LEU  60  14.478   0.799   4.401
 1214   2HD1  LEU  60          HD13      LEU  60  13.137  -0.276   4.000
 1215   3HD1  LEU  60          HD12      LEU  60  12.977   0.879   5.323
 1216   1HD2  LEU  60          HD22      LEU  60  15.674  -2.172   4.999
 1217   2HD2  LEU  60          HD21      LEU  60  14.165  -2.946   5.485
 1218   3HD2  LEU  60          HD23      LEU  60  14.234  -2.008   3.994
 1219    H    ASP  61           HN       ASP  61  17.208   0.833   8.193
 1220    HA   ASP  61           HA       ASP  61  19.864  -0.115   7.518
 1221   1HB   ASP  61           HB2      ASP  61  18.708   2.358   7.825
 1222   2HB   ASP  61           HB1      ASP  61  19.656   2.219   9.308
 1223    H    GLU  62           HN       GLU  62  17.885  -0.651  10.198
 1224    HA   GLU  62           HA       GLU  62  19.927  -0.565  12.258
 1225   1HB   GLU  62           HB2      GLU  62  17.661  -0.428  13.016
 1226   2HB   GLU  62           HB1      GLU  62  17.202  -1.873  12.112
 1227   1HG   GLU  62           HG2      GLU  62  17.743  -3.163  13.873
 1228   2HG   GLU  62           HG1      GLU  62  19.393  -2.538  13.839
 1229    H    ASP  63           HN       ASP  63  18.268  -3.296  10.673
 1230    HA   ASP  63           HA       ASP  63  20.599  -4.748  10.019
 1231   1HB   ASP  63           HB2      ASP  63  20.995  -4.810  12.465
 1232   2HB   ASP  63           HB1      ASP  63  19.418  -5.566  12.693
 1233    H    GLY  64           HN       GLY  64  18.575  -4.652   8.431
 1234   1HA   GLY  64           HA2      GLY  64  16.632  -6.800   9.049
 1235   2HA   GLY  64           HA1      GLY  64  16.570  -5.728   7.652
 1236    H    ASP  65           HN       ASP  65  19.609  -7.101   8.418
 1237    HA   ASP  65           HA       ASP  65  20.381  -8.155   6.055
 1238   1HB   ASP  65           HB2      ASP  65  21.805  -8.275   8.022
 1239   2HB   ASP  65           HB1      ASP  65  20.751  -9.487   8.750
 1240    H    GLY  66           HN       GLY  66  17.827  -9.553   8.029
 1241   1HA   GLY  66           HA2      GLY  66  17.832 -12.034   6.463
 1242   2HA   GLY  66           HA1      GLY  66  16.695 -11.622   7.748
 1243    H    GLU  67           HN       GLU  67  15.625 -12.679   5.519
 1244    HA   GLU  67           HA       GLU  67  14.899 -10.706   3.531
 1245   1HB   GLU  67           HB2      GLU  67  13.493 -13.322   4.078
 1246   2HB   GLU  67           HB1      GLU  67  13.553 -12.426   2.560
 1247   1HG   GLU  67           HG2      GLU  67  15.736 -13.057   2.108
 1248   2HG   GLU  67           HG1      GLU  67  16.135 -13.274   3.812
 1249    H    CYS  68           HN       CYS  68  12.730  -9.955   3.126
 1250    HA   CYS  68           HA       CYS  68  11.143  -9.582   5.630
 1251   1HB   CYS  68           HB2      CYS  68  11.590  -7.856   3.189
 1252   2HB   CYS  68           HB1      CYS  68  10.226  -7.579   4.271
 1253    HG   CYS  68           HG       CYS  68  12.855  -6.484   4.828
 1254    H    ASP  69           HN       ASP  69   8.702  -9.301   5.118
 1255    HA   ASP  69           HA       ASP  69   7.979 -11.436   3.166
 1256   1HB   ASP  69           HB2      ASP  69   6.462 -10.164   5.463
 1257   2HB   ASP  69           HB1      ASP  69   5.739 -11.322   4.344
 1258    H    PHE  70           HN       PHE  70   5.673 -10.958   2.160
 1259    HA   PHE  70           HA       PHE  70   5.998  -8.558   0.553
 1260   1HB   PHE  70           HB2      PHE  70   5.042 -10.556  -0.458
 1261   2HB   PHE  70           HB1      PHE  70   3.740 -10.574   0.733
 1262    HD1  PHE  70           HD1      PHE  70   5.205  -7.616  -1.000
 1263    HD2  PHE  70           HD2      PHE  70   1.809 -10.219  -0.601
 1264    HE1  PHE  70           HE1      PHE  70   3.868  -6.092  -2.431
 1265    HE2  PHE  70           HE2      PHE  70   0.473  -8.695  -2.031
 1266    HZ   PHE  70           HZ       PHE  70   1.503  -6.632  -2.945
 1267    H    GLN  71           HN       GLN  71   4.122  -9.451   3.380
 1268    HA   GLN  71           HA       GLN  71   2.307  -7.179   3.197
 1269   1HB   GLN  71           HB2      GLN  71   2.834  -9.387   5.109
 1270   2HB   GLN  71           HB1      GLN  71   2.156  -7.911   5.798
 1271   1HG   GLN  71           HG2      GLN  71   0.811  -8.524   3.326
 1272   2HG   GLN  71           HG1      GLN  71   0.779  -9.936   4.382
 1273   1HE2  GLN  71          HE22      GLN  71  -0.767  -6.511   6.064
 1274   2HE2  GLN  71          HE21      GLN  71   0.700  -6.427   5.212
 1275    H    GLU  72           HN       GLU  72   5.441  -7.785   4.731
 1276    HA   GLU  72           HA       GLU  72   5.290  -5.359   6.324
 1277   1HB   GLU  72           HB2      GLU  72   7.291  -6.054   7.230
 1278   2HB   GLU  72           HB1      GLU  72   6.739  -7.596   6.590
 1279   1HG   GLU  72           HG2      GLU  72   8.216  -7.529   4.781
 1280   2HG   GLU  72           HG1      GLU  72   8.437  -5.787   4.891
 1281    H    PHE  73           HN       PHE  73   6.882  -6.338   3.300
 1282    HA   PHE  73           HA       PHE  73   8.054  -3.742   2.787
 1283   1HB   PHE  73           HB2      PHE  73   9.110  -5.340   1.489
 1284   2HB   PHE  73           HB1      PHE  73   7.642  -6.292   1.286
 1285    HD1  PHE  73           HD1      PHE  73   5.861  -5.488  -0.330
 1286    HD2  PHE  73           HD2      PHE  73   9.780  -3.744  -0.143
 1287    HE1  PHE  73           HE1      PHE  73   5.522  -4.490  -2.574
 1288    HE2  PHE  73           HE2      PHE  73   9.445  -2.744  -2.387
 1289    HZ   PHE  73           HZ       PHE  73   7.314  -3.118  -3.604
 1290    H    MET  74           HN       MET  74   4.907  -5.109   2.454
 1291    HA   MET  74           HA       MET  74   3.933  -3.254   0.437
 1292   1HB   MET  74           HB2      MET  74   2.880  -5.477   2.037
 1293   2HB   MET  74           HB1      MET  74   1.715  -4.172   1.841
 1294   1HG   MET  74           HG2      MET  74   3.237  -4.992  -0.584
 1295   2HG   MET  74           HG1      MET  74   2.008  -6.113   0.006
 1296   1HE   MET  74           HE3      MET  74   2.838  -3.794  -2.283
 1297   2HE   MET  74           HE2      MET  74   1.519  -2.677  -2.631
 1298   3HE   MET  74           HE1      MET  74   2.620  -2.340  -1.296
 1299    H    ALA  75           HN       ALA  75   3.388  -3.562   3.961
 1300    HA   ALA  75           HA       ALA  75   2.059  -0.996   4.134
 1301   1HB   ALA  75           HB1      ALA  75   1.918  -3.010   5.765
 1302   2HB   ALA  75           HB3      ALA  75   3.425  -2.389   6.438
 1303   3HB   ALA  75           HB2      ALA  75   1.970  -1.391   6.466
 1304    H    PHE  76           HN       PHE  76   5.347  -2.012   4.010
 1305    HA   PHE  76           HA       PHE  76   6.435   0.340   5.364
 1306   1HB   PHE  76           HB2      PHE  76   7.504  -2.090   4.046
 1307   2HB   PHE  76           HB1      PHE  76   8.536  -0.665   3.959
 1308    HD1  PHE  76           HD1      PHE  76   6.276  -2.242   6.518
 1309    HD2  PHE  76           HD2      PHE  76  10.108  -0.501   5.659
 1310    HE1  PHE  76           HE1      PHE  76   6.964  -2.590   8.876
 1311    HE2  PHE  76           HE2      PHE  76  10.797  -0.850   8.016
 1312    HZ   PHE  76           HZ       PHE  76   9.223  -1.895   9.625
 1313    H    VAL  77           HN       VAL  77   5.768  -0.636   2.024
 1314    HA   VAL  77           HA       VAL  77   7.201   1.634   0.876
 1315    HB   VAL  77           HB       VAL  77   5.160  -0.292  -0.279
 1316   1HG1  VAL  77          HG13      VAL  77   5.954   2.246  -1.264
 1317   2HG1  VAL  77          HG12      VAL  77   6.798   1.041  -2.239
 1318   3HG1  VAL  77          HG11      VAL  77   5.039   1.002  -2.117
 1319   1HG2  VAL  77          HG21      VAL  77   7.583  -0.981   0.447
 1320   2HG2  VAL  77          HG23      VAL  77   6.998  -1.467  -1.145
 1321   3HG2  VAL  77          HG22      VAL  77   8.080  -0.083  -0.988
 1322    H    SER  78           HN       SER  78   3.926   1.025   1.993
 1323    HA   SER  78           HA       SER  78   2.829   3.407   0.706
 1324   1HB   SER  78           HB2      SER  78   1.768   1.544   2.843
 1325   2HB   SER  78           HB1      SER  78   0.858   2.923   2.230
 1326    HG   SER  78           HG       SER  78   0.378   1.758   0.559
 1327    H    MET  79           HN       MET  79   4.133   2.604   3.902
 1328    HA   MET  79           HA       MET  79   3.272   4.975   5.238
 1329   1HB   MET  79           HB2      MET  79   5.752   3.299   5.718
 1330   2HB   MET  79           HB1      MET  79   5.037   4.437   6.858
 1331   1HG   MET  79           HG2      MET  79   3.097   2.506   5.820
 1332   2HG   MET  79           HG1      MET  79   4.428   1.745   6.691
 1333   1HE   MET  79           HE1      MET  79   4.564   1.310   8.634
 1334   2HE   MET  79           HE3      MET  79   5.001   2.745   9.573
 1335   3HE   MET  79           HE2      MET  79   3.595   1.787  10.027
 1336    H    VAL  80           HN       VAL  80   6.307   4.228   3.501
 1337    HA   VAL  80           HA       VAL  80   7.432   6.840   3.973
 1338    HB   VAL  80           HB       VAL  80   9.042   6.139   2.166
 1339   1HG1  VAL  80          HG12      VAL  80   9.108   5.537   4.706
 1340   2HG1  VAL  80          HG11      VAL  80   8.702   3.911   4.157
 1341   3HG1  VAL  80          HG13      VAL  80  10.190   4.682   3.606
 1342   1HG2  VAL  80          HG22      VAL  80   6.946   4.150   1.767
 1343   2HG2  VAL  80          HG21      VAL  80   8.278   4.600   0.704
 1344   3HG2  VAL  80          HG23      VAL  80   8.532   3.412   1.982
 1345    H    THR  81           HN       THR  81   5.708   5.391   1.196
 1346    HA   THR  81           HA       THR  81   6.023   7.617  -0.563
 1347    HB   THR  81           HB       THR  81   3.575   5.848  -0.512
 1348    HG1  THR  81           HG1      THR  81   6.216   5.196  -0.882
 1349   1HG2  THR  81          HG23      THR  81   4.422   7.886  -2.201
 1350   2HG2  THR  81          HG22      THR  81   4.910   6.417  -3.046
 1351   3HG2  THR  81          HG21      THR  81   3.222   6.654  -2.590
 1352    H    THR  82           HN       THR  82   4.238   7.354   2.328
 1353    HA   THR  82           HA       THR  82   2.547   9.692   1.527
 1354    HB   THR  82           HB       THR  82   1.033   9.021   3.366
 1355    HG1  THR  82           HG1      THR  82   2.937   6.944   3.626
 1356   1HG2  THR  82          HG23      THR  82   1.751   6.937   1.300
 1357   2HG2  THR  82          HG22      THR  82   0.352   6.771   2.362
 1358   3HG2  THR  82          HG21      THR  82   0.449   8.126   1.237
 1359    H    ALA  83           HN       ALA  83   5.227   8.759   3.346
 1360    HA   ALA  83           HA       ALA  83   4.823  10.923   5.352
 1361   1HB   ALA  83           HB2      ALA  83   6.691   8.564   5.157
 1362   2HB   ALA  83           HB1      ALA  83   7.055   9.910   6.237
 1363   3HB   ALA  83           HB3      ALA  83   5.571   8.982   6.456
 1364    H    CYS  84           HN       CYS  84   5.119  12.209   3.098
 1365    HA   CYS  84           HA       CYS  84   7.787  13.390   3.282
 1366   1HB   CYS  84           HB2      CYS  84   8.090  13.080   0.723
 1367   2HB   CYS  84           HB1      CYS  84   8.471  11.714   1.771
 1368    HG   CYS  84           HG       CYS  84   6.901  10.683   0.037
 1369    H    HIS  85           HN       HIS  85   4.888  14.141   3.493
 1370    HA   HIS  85           HA       HIS  85   3.455  15.862   2.771
 1371   1HB   HIS  85           HB2      HIS  85   5.528  17.083   3.612
 1372   2HB   HIS  85           HB1      HIS  85   6.034  17.204   1.926
 1373    HD1  HIS  85           HD1      HIS  85   5.345  19.358   0.895
 1374    HD2  HIS  85           HD2      HIS  85   2.602  18.107   3.776
 1375    HE1  HIS  85           HE1      HIS  85   3.528  21.121   0.970
 1376    H    GLU  86           HN       GLU  86   3.836  13.806   0.832
 1377    HA   GLU  86           HA       GLU  86   3.907  15.373  -1.714
 1378   1HB   GLU  86           HB2      GLU  86   5.444  13.262  -1.216
 1379   2HB   GLU  86           HB1      GLU  86   3.988  12.378  -1.679
 1380   1HG   GLU  86           HG2      GLU  86   4.503  14.579  -3.507
 1381   2HG   GLU  86           HG1      GLU  86   5.886  13.487  -3.420
 1382    H    PHE  87           HN       PHE  87   1.593  15.565  -0.210
 1383    HA   PHE  87           HA       PHE  87  -0.363  13.542  -0.855
 1384   1HB   PHE  87           HB2      PHE  87  -0.282  15.846   0.743
 1385   2HB   PHE  87           HB1      PHE  87  -1.499  16.195  -0.486
 1386    HD1  PHE  87           HD1      PHE  87  -0.407  13.391   1.754
 1387    HD2  PHE  87           HD2      PHE  87  -3.677  15.433  -0.140
 1388    HE1  PHE  87           HE1      PHE  87  -2.012  11.903   2.921
 1389    HE2  PHE  87           HE2      PHE  87  -5.282  13.947   1.028
 1390    HZ   PHE  87           HZ       PHE  87  -4.449  12.182   2.559
 1391    H    PHE  88           HN       PHE  88  -0.543  13.130  -3.054
 1392    HA   PHE  88           HA       PHE  88  -0.958  13.544  -5.331
 1393   1HB   PHE  88           HB2      PHE  88  -2.757  15.694  -4.190
 1394   2HB   PHE  88           HB1      PHE  88  -2.971  14.816  -5.705
 1395    HD1  PHE  88           HD2      PHE  88  -3.007  12.175  -5.461
 1396    HD2  PHE  88           HD1      PHE  88  -3.901  14.940  -2.298
 1397    HE1  PHE  88           HE2      PHE  88  -4.242  10.395  -4.252
 1398    HE2  PHE  88           HE1      PHE  88  -5.137  13.158  -1.091
 1399    HZ   PHE  88           HZ       PHE  88  -5.308  10.887  -2.069
 1400    H    GLU  89           HN       GLU  89   0.995  14.386  -6.095
 1401    HA   GLU  89           HA       GLU  89   1.550  17.270  -5.763
 1402   1HB   GLU  89           HB2      GLU  89   3.328  15.467  -5.566
 1403   2HB   GLU  89           HB1      GLU  89   3.160  15.222  -7.304
 1404   1HG   GLU  89           HG2      GLU  89   4.939  16.763  -7.128
 1405   2HG   GLU  89           HG1      GLU  89   3.545  17.779  -7.491
 1406    H    HIS  90           HN       HIS  90  -0.280  15.441  -7.845
 1407    HA   HIS  90           HA       HIS  90   0.335  16.155 -10.447
 1408   1HB   HIS  90           HB2      HIS  90  -1.945  15.840 -10.992
 1409   2HB   HIS  90           HB1      HIS  90  -1.714  14.862  -9.543
 1410    HD1  HIS  90           HD1      HIS  90  -3.463  17.899 -10.814
 1411    HD2  HIS  90           HD2      HIS  90  -2.895  15.981  -7.158
 1412    HE1  HIS  90           HE1      HIS  90  -5.123  18.927  -9.200
 1413    H    GLU  91           HN       GLU  91  -0.731  18.285  -7.884
 1414    HA   GLU  91           HA       GLU  91  -1.740  20.482  -9.277
 1415   1HB   GLU  91           HB2      GLU  91  -1.503  20.395  -6.805
 1416   2HB   GLU  91           HB1      GLU  91   0.240  20.596  -6.978
 1417   1HG   GLU  91           HG2      GLU  91  -0.485  22.797  -6.606
 1418   2HG   GLU  91           HG1      GLU  91  -0.397  22.720  -8.367
   
  No H/Q in entry =        1418
  Start of MODEL   14
    1   1H    MET   0           HT1      MET   0  11.891   5.845 -15.375
    2   2H    MET   0           HT3      MET   0  10.869   6.591 -16.507
    3   3H    MET   0           HT2      MET   0  11.232   7.375 -15.042
    4    HA   MET   0           HA       MET   0   9.366   6.529 -14.231
    5   1HB   MET   0           HB2      MET   0   7.928   5.185 -15.520
    6   2HB   MET   0           HB1      MET   0   8.875   6.031 -16.742
    7   1HG   MET   0           HG2      MET   0   9.397   3.224 -15.710
    8   2HG   MET   0           HG1      MET   0   8.735   3.642 -17.291
    9   1HE   MET   0           HE2      MET   0  11.190   1.773 -16.812
   10   2HE   MET   0           HE1      MET   0  10.583   2.167 -18.418
   11   3HE   MET   0           HE3      MET   0  12.311   2.301 -18.064
   12    H    SER   1           HN       SER   1   8.666   4.635 -12.926
   13    HA   SER   1           HA       SER   1  10.783   2.554 -12.630
   14   1HB   SER   1           HB2      SER   1  11.429   3.800 -10.805
   15   2HB   SER   1           HB1      SER   1   9.837   4.529 -10.606
   16    HG   SER   1           HG       SER   1  10.834   2.074  -9.705
   17    H    GLU   2           HN       GLU   2   9.978   0.655 -11.368
   18    HA   GLU   2           HA       GLU   2   7.319  -0.093 -12.258
   19   1HB   GLU   2           HB2      GLU   2   9.620  -1.450 -11.427
   20   2HB   GLU   2           HB1      GLU   2   8.432  -1.797 -10.172
   21   1HG   GLU   2           HG2      GLU   2   7.655  -3.389 -11.584
   22   2HG   GLU   2           HG1      GLU   2   6.950  -2.050 -12.492
   23    H    LEU   3           HN       LEU   3   8.742   0.225  -8.986
   24    HA   LEU   3           HA       LEU   3   6.266   0.013  -7.584
   25   1HB   LEU   3           HB2      LEU   3   8.780   0.025  -6.758
   26   2HB   LEU   3           HB1      LEU   3   8.476   1.746  -6.541
   27    HG   LEU   3           HG       LEU   3   6.380   1.101  -5.256
   28   1HD1  LEU   3          HD12      LEU   3   7.689  -1.603  -5.585
   29   2HD1  LEU   3          HD11      LEU   3   6.589  -1.260  -4.249
   30   3HD1  LEU   3          HD13      LEU   3   6.015  -1.152  -5.913
   31   1HD2  LEU   3          HD23      LEU   3   9.180   0.973  -4.462
   32   2HD2  LEU   3          HD22      LEU   3   7.810   1.681  -3.606
   33   3HD2  LEU   3          HD21      LEU   3   8.171  -0.036  -3.426
   34    H    GLU   4           HN       GLU   4   7.991   2.799  -8.914
   35    HA   GLU   4           HA       GLU   4   6.339   4.819  -7.756
   36   1HB   GLU   4           HB2      GLU   4   8.436   5.433  -8.793
   37   2HB   GLU   4           HB1      GLU   4   7.908   4.793 -10.350
   38   1HG   GLU   4           HG2      GLU   4   5.924   6.638  -9.460
   39   2HG   GLU   4           HG1      GLU   4   7.496   7.420  -9.286
   40    H    LYS   5           HN       LYS   5   6.132   3.362 -11.036
   41    HA   LYS   5           HA       LYS   5   3.735   4.723 -11.757
   42   1HB   LYS   5           HB2      LYS   5   4.958   2.122 -12.691
   43   2HB   LYS   5           HB1      LYS   5   3.475   2.771 -13.393
   44   1HG   LYS   5           HG2      LYS   5   4.708   4.918 -13.842
   45   2HG   LYS   5           HG1      LYS   5   6.189   4.117 -13.315
   46   1HD   LYS   5           HD2      LYS   5   6.378   2.938 -15.242
   47   2HD   LYS   5           HD1      LYS   5   4.651   2.580 -15.297
   48   1HE   LYS   5           HE2      LYS   5   5.106   5.408 -15.729
   49   2HE   LYS   5           HE1      LYS   5   6.039   4.451 -16.881
   50   1HZ   LYS   5           HZ2      LYS   5   3.192   3.872 -16.335
   51   2HZ   LYS   5           HZ1      LYS   5   3.656   5.025 -17.495
   52   3HZ   LYS   5           HZ3      LYS   5   4.130   3.406 -17.673
   53    H    ALA   6           HN       ALA   6   4.225   1.648 -10.050
   54    HA   ALA   6           HA       ALA   6   1.371   1.022 -10.073
   55   1HB   ALA   6           HB1      ALA   6   3.720  -0.173  -8.579
   56   2HB   ALA   6           HB3      ALA   6   2.073  -0.796  -8.468
   57   3HB   ALA   6           HB2      ALA   6   2.927  -0.824 -10.012
   58    H    MET   7           HN       MET   7   3.540   1.404  -7.265
   59    HA   MET   7           HA       MET   7   1.635   1.847  -5.309
   60   1HB   MET   7           HB2      MET   7   3.988   1.680  -4.742
   61   2HB   MET   7           HB1      MET   7   4.349   3.169  -5.621
   62   1HG   MET   7           HG2      MET   7   4.148   3.443  -3.106
   63   2HG   MET   7           HG1      MET   7   3.090   4.492  -4.051
   64   1HE   MET   7           HE1      MET   7   3.591   2.942  -1.290
   65   2HE   MET   7           HE3      MET   7   2.073   3.641  -0.709
   66   3HE   MET   7           HE2      MET   7   2.286   1.893  -0.743
   67    H    VAL   8           HN       VAL   8   3.225   4.412  -7.225
   68    HA   VAL   8           HA       VAL   8   1.694   6.567  -6.195
   69    HB   VAL   8           HB       VAL   8   2.736   6.306  -9.030
   70   1HG1  VAL   8          HG13      VAL   8   2.055   8.660  -7.247
   71   2HG1  VAL   8          HG12      VAL   8   2.931   8.805  -8.771
   72   3HG1  VAL   8          HG11      VAL   8   1.270   8.213  -8.763
   73   1HG2  VAL   8          HG22      VAL   8   4.473   5.815  -7.304
   74   2HG2  VAL   8          HG21      VAL   8   4.795   7.323  -8.161
   75   3HG2  VAL   8          HG23      VAL   8   4.113   7.361  -6.536
   76    H    ALA   9           HN       ALA   9   0.975   4.262  -8.789
   77    HA   ALA   9           HA       ALA   9  -1.313   5.478  -9.900
   78   1HB   ALA   9           HB2      ALA   9  -0.289   3.333 -10.701
   79   2HB   ALA   9           HB1      ALA   9  -0.971   2.521  -9.294
   80   3HB   ALA   9           HB3      ALA   9  -2.037   3.225 -10.510
   81    H    LEU  10           HN       LEU  10  -1.008   3.487  -6.962
   82    HA   LEU  10           HA       LEU  10  -3.720   3.328  -6.229
   83   1HB   LEU  10           HB2      LEU  10  -1.279   2.747  -5.006
   84   2HB   LEU  10           HB1      LEU  10  -2.003   3.962  -3.950
   85    HG   LEU  10           HG       LEU  10  -3.862   1.869  -4.902
   86   1HD1  LEU  10          HD13      LEU  10  -1.804   0.542  -4.537
   87   2HD1  LEU  10          HD12      LEU  10  -1.655   1.230  -2.919
   88   3HD1  LEU  10          HD11      LEU  10  -3.023   0.186  -3.311
   89   1HD2  LEU  10          HD21      LEU  10  -3.942   3.821  -3.023
   90   2HD2  LEU  10          HD23      LEU  10  -4.910   2.351  -2.918
   91   3HD2  LEU  10          HD22      LEU  10  -3.392   2.472  -2.028
   92    H    ILE  11           HN       ILE  11  -1.368   5.898  -5.392
   93    HA   ILE  11           HA       ILE  11  -3.089   7.630  -4.011
   94    HB   ILE  11           HB       ILE  11  -0.678   8.029  -5.750
   95   1HG1  ILE  11          HG12      ILE  11   0.085   9.136  -3.591
   96   2HG1  ILE  11          HG11      ILE  11  -1.443   8.614  -2.879
   97   1HG2  ILE  11          HG23      ILE  11  -2.588  10.198  -4.877
   98   2HG2  ILE  11          HG22      ILE  11  -0.866  10.528  -5.072
   99   3HG2  ILE  11          HG21      ILE  11  -1.817   9.976  -6.449
  100   1HD1  ILE  11          HD11      ILE  11   0.233   6.590  -4.322
  101   2HD1  ILE  11          HD13      ILE  11   0.715   7.085  -2.699
  102   3HD1  ILE  11          HD12      ILE  11  -0.873   6.365  -2.966
  103    H    ASP  12           HN       ASP  12  -2.697   7.187  -7.510
  104    HA   ASP  12           HA       ASP  12  -4.279   9.284  -8.485
  105   1HB   ASP  12           HB2      ASP  12  -3.017   7.433  -9.774
  106   2HB   ASP  12           HB1      ASP  12  -4.484   6.479  -9.587
  107    H    VAL  13           HN       VAL  13  -5.373   6.029  -7.509
  108    HA   VAL  13           HA       VAL  13  -8.143   6.418  -7.912
  109    HB   VAL  13           HB       VAL  13  -6.644   4.760  -5.870
  110   1HG1  VAL  13          HG13      VAL  13  -9.468   5.443  -5.994
  111   2HG1  VAL  13          HG12      VAL  13  -9.221   3.708  -6.205
  112   3HG1  VAL  13          HG11      VAL  13  -8.598   4.520  -4.769
  113   1HG2  VAL  13          HG21      VAL  13  -7.747   4.378  -8.618
  114   2HG2  VAL  13          HG23      VAL  13  -6.283   3.711  -7.895
  115   3HG2  VAL  13          HG22      VAL  13  -7.855   3.013  -7.507
  116    H    PHE  14           HN       PHE  14  -6.077   7.397  -5.215
  117    HA   PHE  14           HA       PHE  14  -8.160   8.167  -3.413
  118   1HB   PHE  14           HB2      PHE  14  -5.604   7.953  -2.995
  119   2HB   PHE  14           HB1      PHE  14  -5.519   9.609  -3.597
  120    HD1  PHE  14           HD2      PHE  14  -7.448   7.506  -1.161
  121    HD2  PHE  14           HD1      PHE  14  -5.848  11.381  -2.105
  122    HE1  PHE  14           HE2      PHE  14  -8.181   8.349   1.053
  123    HE2  PHE  14           HE1      PHE  14  -6.581  12.224   0.110
  124    HZ   PHE  14           HZ       PHE  14  -7.748  10.708   1.689
  125    H    HIS  15           HN       HIS  15  -6.534   9.908  -6.047
  126    HA   HIS  15           HA       HIS  15  -7.879  12.425  -5.466
  127   1HB   HIS  15           HB2      HIS  15  -5.677  12.137  -6.743
  128   2HB   HIS  15           HB1      HIS  15  -6.659  11.618  -8.114
  129    HD1  HIS  15           HD1      HIS  15  -7.317  13.476  -9.629
  130    HD2  HIS  15           HD2      HIS  15  -6.752  14.825  -5.724
  131    HE1  HIS  15           HE1      HIS  15  -7.714  15.979  -9.669
  132    H    GLN  16           HN       GLN  16  -8.851   9.508  -6.919
  133    HA   GLN  16           HA       GLN  16 -10.829  10.764  -8.707
  134   1HB   GLN  16           HB2      GLN  16  -9.574   8.504  -9.082
  135   2HB   GLN  16           HB1      GLN  16 -10.779   7.839  -7.978
  136   1HG   GLN  16           HG2      GLN  16 -11.453   7.659 -10.384
  137   2HG   GLN  16           HG1      GLN  16 -12.589   8.602  -9.417
  138   1HE2  GLN  16          HE22      GLN  16 -10.032  10.974 -11.572
  139   2HE2  GLN  16          HE21      GLN  16  -9.407   9.760 -10.564
  140    H    TYR  17           HN       TYR  17 -10.940   8.615  -5.843
  141    HA   TYR  17           HA       TYR  17 -13.795   9.063  -5.487
  142   1HB   TYR  17           HB2      TYR  17 -11.672   7.776  -3.755
  143   2HB   TYR  17           HB1      TYR  17 -13.370   7.874  -3.285
  144    HD1  TYR  17           HD2      TYR  17 -11.010   6.513  -5.805
  145    HD2  TYR  17           HD1      TYR  17 -15.037   6.482  -4.310
  146    HE1  TYR  17           HE2      TYR  17 -11.511   4.521  -7.198
  147    HE2  TYR  17           HE1      TYR  17 -15.538   4.493  -5.704
  148    HH   TYR  17           HH       TYR  17 -14.705   3.389  -7.701
  149    H    SER  18           HN       SER  18 -10.872  10.601  -4.361
  150    HA   SER  18           HA       SER  18 -12.443  12.182  -2.382
  151   1HB   SER  18           HB2      SER  18 -10.013  11.046  -2.064
  152   2HB   SER  18           HB1      SER  18  -9.514  12.612  -2.696
  153    HG   SER  18           HG       SER  18  -9.705  12.848  -0.509
  154    H    GLY  19           HN       GLY  19 -11.325  12.340  -5.569
  155   1HA   GLY  19           HA2      GLY  19 -10.900  15.252  -5.573
  156   2HA   GLY  19           HA1      GLY  19 -10.786  14.190  -6.975
  157    H    ARG  20           HN       ARG  20 -13.458  12.964  -6.284
  158    HA   ARG  20           HA       ARG  20 -15.092  14.629  -7.930
  159   1HB   ARG  20           HB2      ARG  20 -15.910  12.497  -5.929
  160   2HB   ARG  20           HB1      ARG  20 -16.965  13.179  -7.167
  161   1HG   ARG  20           HG2      ARG  20 -15.686  12.255  -8.932
  162   2HG   ARG  20           HG1      ARG  20 -14.318  11.914  -7.872
  163   1HD   ARG  20           HD2      ARG  20 -15.150   9.861  -7.476
  164   2HD   ARG  20           HD1      ARG  20 -16.598  10.595  -6.782
  165    HE   ARG  20           HE       ARG  20 -17.628   9.662  -8.691
  166   1HH1  ARG  20          HH21      ARG  20 -14.590   9.274  -9.691
  167   2HH1  ARG  20          HH22      ARG  20 -14.777   9.913 -11.291
  168   1HH2  ARG  20          HH11      ARG  20 -17.892  11.303 -10.660
  169   2HH2  ARG  20          HH12      ARG  20 -16.644  11.063 -11.838
  170    H    GLU  21           HN       GLU  21 -17.492  14.451  -6.026
  171    HA   GLU  21           HA       GLU  21 -17.438  17.136  -5.101
  172   1HB   GLU  21           HB2      GLU  21 -19.414  16.363  -3.665
  173   2HB   GLU  21           HB1      GLU  21 -19.570  16.111  -5.404
  174   1HG   GLU  21           HG2      GLU  21 -18.233  13.856  -4.163
  175   2HG   GLU  21           HG1      GLU  21 -19.794  14.155  -3.399
  176    H    GLY  22           HN       GLY  22 -18.431  15.442  -2.364
  177   1HA   GLY  22           HA2      GLY  22 -17.543  15.589  -0.177
  178   2HA   GLY  22           HA1      GLY  22 -16.221  14.682  -0.915
  179    H    ASP  23           HN       ASP  23 -14.278  15.717  -1.281
  180    HA   ASP  23           HA       ASP  23 -13.956  18.545  -1.522
  181   1HB   ASP  23           HB2      ASP  23 -14.453  17.777   1.106
  182   2HB   ASP  23           HB1      ASP  23 -12.696  17.900   1.034
  183    H    LYS  24           HN       LYS  24 -11.961  16.331   0.428
  184    HA   LYS  24           HA       LYS  24 -10.284  15.093  -1.299
  185   1HB   LYS  24           HB2      LYS  24  -8.389  16.807  -1.637
  186   2HB   LYS  24           HB1      LYS  24  -9.810  16.984  -2.664
  187   1HG   LYS  24           HG2      LYS  24 -10.426  18.951  -1.689
  188   2HG   LYS  24           HG1      LYS  24  -9.955  18.411  -0.076
  189   1HD   LYS  24           HD2      LYS  24  -8.547  20.300  -1.054
  190   2HD   LYS  24           HD1      LYS  24  -7.644  18.891  -0.492
  191   1HE   LYS  24           HE2      LYS  24  -6.970  18.329  -2.592
  192   2HE   LYS  24           HE1      LYS  24  -8.532  18.736  -3.305
  193   1HZ   LYS  24           HZ1      LYS  24  -7.029  20.990  -2.293
  194   2HZ   LYS  24           HZ3      LYS  24  -6.304  20.194  -3.604
  195   3HZ   LYS  24           HZ2      LYS  24  -7.879  20.816  -3.755
  196    H    HIS  25           HN       HIS  25  -8.095  14.634  -0.363
  197    HA   HIS  25           HA       HIS  25  -6.686  14.244   1.478
  198   1HB   HIS  25           HB2      HIS  25  -6.841  16.831   1.520
  199   2HB   HIS  25           HB1      HIS  25  -7.992  16.606   2.836
  200    HD1  HIS  25           HD1      HIS  25  -4.400  16.691   2.113
  201    HD2  HIS  25           HD2      HIS  25  -6.824  15.106   5.111
  202    HE1  HIS  25           HE1      HIS  25  -2.872  16.151   4.060
  203    H    LYS  26           HN       LYS  26  -9.850  13.692   1.410
  204    HA   LYS  26           HA       LYS  26  -9.801  12.398   4.080
  205   1HB   LYS  26           HB2      LYS  26 -12.081  13.221   4.595
  206   2HB   LYS  26           HB1      LYS  26 -10.928  14.548   4.460
  207   1HG   LYS  26           HG2      LYS  26 -11.681  15.064   2.220
  208   2HG   LYS  26           HG1      LYS  26 -12.698  13.623   2.180
  209   1HD   LYS  26           HD2      LYS  26 -13.190  15.447   4.460
  210   2HD   LYS  26           HD1      LYS  26 -13.615  16.093   2.874
  211   1HE   LYS  26           HE2      LYS  26 -15.546  14.933   3.082
  212   2HE   LYS  26           HE1      LYS  26 -14.577  13.492   2.775
  213   1HZ   LYS  26           HZ2      LYS  26 -15.088  14.668   5.454
  214   2HZ   LYS  26           HZ1      LYS  26 -15.888  13.314   4.815
  215   3HZ   LYS  26           HZ3      LYS  26 -14.224  13.241   5.133
  216    H    LEU  27           HN       LEU  27 -11.503  10.734   4.278
  217    HA   LEU  27           HA       LEU  27 -12.711   9.875   1.699
  218   1HB   LEU  27           HB2      LEU  27 -10.459   8.614   3.012
  219   2HB   LEU  27           HB1      LEU  27 -11.838   7.513   2.983
  220    HG   LEU  27           HG       LEU  27 -10.396   7.337   0.942
  221   1HD1  LEU  27          HD12      LEU  27 -12.942   6.931   1.026
  222   2HD1  LEU  27          HD11      LEU  27 -13.091   8.491   0.217
  223   3HD1  LEU  27          HD13      LEU  27 -12.220   7.170  -0.565
  224   1HD2  LEU  27          HD23      LEU  27 -10.085   9.975   1.055
  225   2HD2  LEU  27          HD22      LEU  27 -10.045   9.129  -0.493
  226   3HD2  LEU  27          HD21      LEU  27 -11.514   9.960   0.020
  227    H    LYS  28           HN       LYS  28 -13.691   7.396   2.706
  228    HA   LYS  28           HA       LYS  28 -15.151   8.053   5.191
  229   1HB   LYS  28           HB2      LYS  28 -16.296   8.467   2.616
  230   2HB   LYS  28           HB1      LYS  28 -17.088   7.059   3.328
  231   1HG   LYS  28           HG2      LYS  28 -17.797   8.278   5.229
  232   2HG   LYS  28           HG1      LYS  28 -16.664   9.592   4.913
  233   1HD   LYS  28           HD2      LYS  28 -18.709  10.486   4.176
  234   2HD   LYS  28           HD1      LYS  28 -17.984   9.883   2.686
  235   1HE   LYS  28           HE2      LYS  28 -19.967   8.799   2.423
  236   2HE   LYS  28           HE1      LYS  28 -19.290   7.650   3.578
  237   1HZ   LYS  28           HZ2      LYS  28 -20.239   9.370   5.284
  238   2HZ   LYS  28           HZ1      LYS  28 -21.277   9.766   3.997
  239   3HZ   LYS  28           HZ3      LYS  28 -21.242   8.181   4.601
  240    H    LYS  29           HN       LYS  29 -16.418   6.130   5.954
  241    HA   LYS  29           HA       LYS  29 -14.859   3.706   5.612
  242   1HB   LYS  29           HB2      LYS  29 -17.555   4.031   6.964
  243   2HB   LYS  29           HB1      LYS  29 -16.387   2.733   7.226
  244   1HG   LYS  29           HG2      LYS  29 -15.886   5.668   7.807
  245   2HG   LYS  29           HG1      LYS  29 -16.273   4.446   9.018
  246   1HD   LYS  29           HD2      LYS  29 -14.254   3.146   8.206
  247   2HD   LYS  29           HD1      LYS  29 -13.822   4.560   7.246
  248   1HE   LYS  29           HE2      LYS  29 -12.655   5.096   9.153
  249   2HE   LYS  29           HE1      LYS  29 -14.218   5.770   9.618
  250   1HZ   LYS  29           HZ1      LYS  29 -13.702   2.936  10.156
  251   2HZ   LYS  29           HZ3      LYS  29 -12.959   4.087  11.156
  252   3HZ   LYS  29           HZ2      LYS  29 -14.653   4.048  11.022
  253    H    SER  30           HN       SER  30 -17.802   4.992   4.236
  254    HA   SER  30           HA       SER  30 -18.658   2.414   3.142
  255   1HB   SER  30           HB2      SER  30 -19.651   5.215   3.101
  256   2HB   SER  30           HB1      SER  30 -20.068   4.228   1.703
  257    HG   SER  30           HG       SER  30 -20.368   3.238   4.325
  258    H    GLU  31           HN       GLU  31 -17.098   5.361   1.877
  259    HA   GLU  31           HA       GLU  31 -16.894   4.295  -0.815
  260   1HB   GLU  31           HB2      GLU  31 -16.785   6.790   0.003
  261   2HB   GLU  31           HB1      GLU  31 -15.076   6.438   0.266
  262   1HG   GLU  31           HG2      GLU  31 -14.626   6.437  -1.952
  263   2HG   GLU  31           HG1      GLU  31 -16.052   5.468  -2.323
  264    H    LEU  32           HN       LEU  32 -15.035   4.083   2.118
  265    HA   LEU  32           HA       LEU  32 -12.582   3.172   0.819
  266   1HB   LEU  32           HB2      LEU  32 -12.391   4.219   2.997
  267   2HB   LEU  32           HB1      LEU  32 -13.538   3.075   3.697
  268    HG   LEU  32           HG       LEU  32 -11.991   1.224   3.295
  269   1HD1  LEU  32          HD12      LEU  32 -10.251   3.380   2.062
  270   2HD1  LEU  32          HD11      LEU  32  -9.677   1.760   2.460
  271   3HD1  LEU  32          HD13      LEU  32 -10.939   1.976   1.245
  272   1HD2  LEU  32          HD21      LEU  32 -11.365   3.550   4.949
  273   2HD2  LEU  32          HD23      LEU  32 -11.260   1.835   5.348
  274   3HD2  LEU  32          HD22      LEU  32  -9.917   2.633   4.528
  275    H    LYS  33           HN       LYS  33 -15.233   1.612   2.644
  276    HA   LYS  33           HA       LYS  33 -14.297  -1.066   2.417
  277   1HB   LYS  33           HB2      LYS  33 -16.368  -0.039   3.693
  278   2HB   LYS  33           HB1      LYS  33 -17.227  -0.417   2.201
  279   1HG   LYS  33           HG2      LYS  33 -15.550  -2.645   2.988
  280   2HG   LYS  33           HG1      LYS  33 -16.637  -2.195   4.303
  281   1HD   LYS  33           HD2      LYS  33 -17.875  -2.233   1.616
  282   2HD   LYS  33           HD1      LYS  33 -17.363  -3.809   2.227
  283   1HE   LYS  33           HE2      LYS  33 -18.915  -1.928   3.994
  284   2HE   LYS  33           HE1      LYS  33 -19.755  -2.951   2.829
  285   1HZ   LYS  33           HZ3      LYS  33 -18.671  -4.883   3.807
  286   2HZ   LYS  33           HZ2      LYS  33 -17.887  -3.889   4.940
  287   3HZ   LYS  33           HZ1      LYS  33 -19.579  -4.041   4.968
  288    H    GLU  34           HN       GLU  34 -16.319   0.906   0.280
  289    HA   GLU  34           HA       GLU  34 -16.657  -1.174  -1.705
  290   1HB   GLU  34           HB2      GLU  34 -18.016   0.349  -2.757
  291   2HB   GLU  34           HB1      GLU  34 -17.927   1.156  -1.197
  292   1HG   GLU  34           HG2      GLU  34 -17.284   2.953  -2.413
  293   2HG   GLU  34           HG1      GLU  34 -15.708   2.176  -2.426
  294    H    LEU  35           HN       LEU  35 -14.319   1.352  -1.103
  295    HA   LEU  35           HA       LEU  35 -12.980   1.412  -3.612
  296   1HB   LEU  35           HB2      LEU  35 -12.600   2.608  -1.146
  297   2HB   LEU  35           HB1      LEU  35 -11.204   1.536  -1.268
  298    HG   LEU  35           HG       LEU  35 -10.642   3.693  -2.254
  299   1HD1  LEU  35          HD12      LEU  35 -11.101   1.456  -4.244
  300   2HD1  LEU  35          HD11      LEU  35 -10.173   2.908  -4.625
  301   3HD1  LEU  35          HD13      LEU  35  -9.620   1.814  -3.356
  302   1HD2  LEU  35          HD21      LEU  35 -13.352   3.513  -3.205
  303   2HD2  LEU  35          HD23      LEU  35 -12.259   4.896  -3.265
  304   3HD2  LEU  35          HD22      LEU  35 -12.274   3.725  -4.583
  305    H    ILE  36           HN       ILE  36 -12.696  -0.803  -0.867
  306    HA   ILE  36           HA       ILE  36 -10.457  -2.261  -2.054
  307    HB   ILE  36           HB       ILE  36 -12.168  -3.441   0.096
  308   1HG1  ILE  36          HG12      ILE  36 -10.563  -0.893   0.289
  309   2HG1  ILE  36          HG11      ILE  36 -12.155  -1.248   0.955
  310   1HG2  ILE  36          HG22      ILE  36 -10.125  -4.565  -0.765
  311   2HG2  ILE  36          HG21      ILE  36  -9.172  -3.159  -0.286
  312   3HG2  ILE  36          HG23      ILE  36  -9.976  -4.138   0.941
  313   1HD1  ILE  36          HD13      ILE  36 -10.798  -3.094   2.309
  314   2HD1  ILE  36          HD12      ILE  36  -9.453  -1.993   2.006
  315   3HD1  ILE  36          HD11      ILE  36 -10.879  -1.426   2.879
  316    H    ASN  37           HN       ASN  37 -13.838  -3.178  -1.299
  317    HA   ASN  37           HA       ASN  37 -13.714  -5.633  -2.764
  318   1HB   ASN  37           HB2      ASN  37 -15.406  -5.168  -1.019
  319   2HB   ASN  37           HB1      ASN  37 -16.146  -3.959  -2.070
  320   1HD2  ASN  37          HD22      ASN  37 -17.518  -7.596  -2.467
  321   2HD2  ASN  37          HD21      ASN  37 -16.935  -6.865  -1.050
  322    H    ASN  38           HN       ASN  38 -15.556  -2.678  -3.636
  323    HA   ASN  38           HA       ASN  38 -16.242  -3.425  -6.233
  324   1HB   ASN  38           HB2      ASN  38 -17.039  -1.348  -5.164
  325   2HB   ASN  38           HB1      ASN  38 -15.431  -0.646  -5.337
  326   1HD2  ASN  38          HD22      ASN  38 -16.753  -1.497  -9.062
  327   2HD2  ASN  38          HD21      ASN  38 -16.363  -2.724  -7.958
  328    H    GLU  39           HN       GLU  39 -13.317  -1.512  -5.398
  329    HA   GLU  39           HA       GLU  39 -12.272  -1.686  -8.078
  330   1HB   GLU  39           HB2      GLU  39 -10.717  -1.128  -5.543
  331   2HB   GLU  39           HB1      GLU  39 -10.280  -0.666  -7.188
  332   1HG   GLU  39           HG2      GLU  39 -12.661   0.337  -5.603
  333   2HG   GLU  39           HG1      GLU  39 -11.241   1.269  -6.083
  334    H    LEU  40           HN       LEU  40 -10.570  -2.980  -5.201
  335    HA   LEU  40           HA       LEU  40  -9.082  -4.852  -6.725
  336   1HB   LEU  40           HB2      LEU  40  -9.789  -4.875  -3.777
  337   2HB   LEU  40           HB1      LEU  40  -8.551  -5.879  -4.525
  338    HG   LEU  40           HG       LEU  40  -8.575  -2.892  -4.142
  339   1HD1  LEU  40          HD13      LEU  40  -7.482  -4.510  -2.515
  340   2HD1  LEU  40          HD12      LEU  40  -6.359  -4.933  -3.808
  341   3HD1  LEU  40          HD11      LEU  40  -6.405  -3.283  -3.184
  342   1HD2  LEU  40          HD22      LEU  40  -7.168  -4.490  -6.281
  343   2HD2  LEU  40          HD21      LEU  40  -8.016  -2.950  -6.432
  344   3HD2  LEU  40          HD23      LEU  40  -6.443  -3.015  -5.638
  345    H    SER  41           HN       SER  41 -10.833  -6.374  -4.140
  346    HA   SER  41           HA       SER  41 -11.992  -8.440  -4.216
  347   1HB   SER  41           HB2      SER  41 -13.866  -6.958  -4.438
  348   2HB   SER  41           HB1      SER  41 -13.498  -6.648  -6.134
  349    HG   SER  41           HG       SER  41 -14.861  -8.714  -4.975
  350    H    HIS  42           HN       HIS  42  -9.693  -8.510  -5.892
  351    HA   HIS  42           HA       HIS  42 -10.720 -10.021  -8.261
  352   1HB   HIS  42           HB2      HIS  42  -8.912  -7.924  -8.193
  353   2HB   HIS  42           HB1      HIS  42  -7.868  -9.345  -8.271
  354    HD1  HIS  42           HD1      HIS  42 -10.829  -7.804 -10.099
  355    HD2  HIS  42           HD2      HIS  42  -7.756 -10.541 -10.779
  356    HE1  HIS  42           HE1      HIS  42 -10.940  -8.412 -12.557
  357    H    PHE  43           HN       PHE  43  -8.871 -10.211  -5.337
  358    HA   PHE  43           HA       PHE  43  -8.267 -13.068  -5.983
  359   1HB   PHE  43           HB2      PHE  43  -6.270 -12.582  -4.294
  360   2HB   PHE  43           HB1      PHE  43  -6.103 -12.233  -6.015
  361    HD1  PHE  43           HD2      PHE  43  -7.834 -10.483  -3.176
  362    HD2  PHE  43           HD1      PHE  43  -4.943 -10.238  -6.344
  363    HE1  PHE  43           HE2      PHE  43  -7.470  -8.085  -2.657
  364    HE2  PHE  43           HE1      PHE  43  -4.579  -7.840  -5.825
  365    HZ   PHE  43           HZ       PHE  43  -5.843  -6.763  -3.982
  366    H    LEU  44           HN       LEU  44 -10.530 -11.827  -4.529
  367    HA   LEU  44           HA       LEU  44  -9.972 -12.776  -1.755
  368   1HB   LEU  44           HB2      LEU  44 -11.012 -10.427  -2.358
  369   2HB   LEU  44           HB1      LEU  44 -12.500 -11.357  -2.541
  370    HG   LEU  44           HG       LEU  44 -12.237 -10.468  -0.234
  371   1HD1  LEU  44          HD13      LEU  44 -13.415 -12.641  -0.724
  372   2HD1  LEU  44          HD12      LEU  44 -11.912 -13.481  -0.336
  373   3HD1  LEU  44          HD11      LEU  44 -12.744 -12.543   0.905
  374   1HD2  LEU  44          HD21      LEU  44  -9.640 -10.775  -0.433
  375   2HD2  LEU  44          HD23      LEU  44 -10.411 -11.022   1.134
  376   3HD2  LEU  44          HD22      LEU  44  -9.965 -12.410   0.141
  377    H    GLU  45           HN       GLU  45 -10.601 -14.848  -1.398
  378    HA   GLU  45           HA       GLU  45 -13.225 -15.723  -2.461
  379   1HB   GLU  45           HB2      GLU  45 -11.832 -18.019  -2.831
  380   2HB   GLU  45           HB1      GLU  45 -12.114 -16.846  -4.115
  381   1HG   GLU  45           HG2      GLU  45  -9.955 -15.915  -3.905
  382   2HG   GLU  45           HG1      GLU  45  -9.712 -16.610  -2.303
  383    H    GLU  46           HN       GLU  46 -10.418 -17.002  -0.652
  384    HA   GLU  46           HA       GLU  46 -12.358 -18.055   1.361
  385   1HB   GLU  46           HB2      GLU  46  -9.678 -18.992   0.387
  386   2HB   GLU  46           HB1      GLU  46 -10.176 -19.390   2.032
  387   1HG   GLU  46           HG2      GLU  46 -12.294 -20.343   1.124
  388   2HG   GLU  46           HG1      GLU  46 -11.708 -20.023  -0.508
  389    H    ILE  47           HN       ILE  47  -9.685 -15.895   0.851
  390    HA   ILE  47           HA       ILE  47  -8.681 -14.337   2.293
  391    HB   ILE  47           HB       ILE  47 -11.038 -15.071   4.059
  392   1HG1  ILE  47          HG12      ILE  47 -10.702 -12.616   2.328
  393   2HG1  ILE  47          HG11      ILE  47 -11.443 -14.092   1.706
  394   1HG2  ILE  47          HG23      ILE  47  -9.073 -13.974   5.212
  395   2HG2  ILE  47          HG22      ILE  47  -9.290 -12.597   4.130
  396   3HG2  ILE  47          HG21      ILE  47 -10.566 -13.036   5.266
  397   1HD1  ILE  47          HD11      ILE  47 -12.398 -12.879   4.294
  398   2HD1  ILE  47          HD13      ILE  47 -12.993 -12.272   2.749
  399   3HD1  ILE  47          HD12      ILE  47 -13.258 -13.959   3.195
  400    H    LYS  48           HN       LYS  48  -6.982 -14.513   3.726
  401    HA   LYS  48           HA       LYS  48  -6.788 -17.081   5.244
  402   1HB   LYS  48           HB2      LYS  48  -5.039 -16.324   3.411
  403   2HB   LYS  48           HB1      LYS  48  -4.417 -15.318   4.719
  404   1HG   LYS  48           HG2      LYS  48  -4.253 -17.330   6.166
  405   2HG   LYS  48           HG1      LYS  48  -4.810 -18.324   4.819
  406   1HD   LYS  48           HD2      LYS  48  -2.829 -18.104   3.650
  407   2HD   LYS  48           HD1      LYS  48  -2.478 -16.518   4.343
  408   1HE   LYS  48           HE2      LYS  48  -2.506 -18.915   6.145
  409   2HE   LYS  48           HE1      LYS  48  -1.099 -18.635   5.119
  410   1HZ   LYS  48           HZ3      LYS  48  -2.092 -16.307   6.533
  411   2HZ   LYS  48           HZ2      LYS  48  -1.438 -17.525   7.522
  412   3HZ   LYS  48           HZ1      LYS  48  -0.497 -16.832   6.288
  413    H    GLU  49           HN       GLU  49  -5.377 -13.799   5.527
  414    HA   GLU  49           HA       GLU  49  -5.252 -13.935   8.403
  415   1HB   GLU  49           HB2      GLU  49  -4.822 -11.848   6.320
  416   2HB   GLU  49           HB1      GLU  49  -5.178 -11.277   7.951
  417   1HG   GLU  49           HG2      GLU  49  -3.072 -13.377   7.409
  418   2HG   GLU  49           HG1      GLU  49  -2.703 -11.653   7.399
  419    H    GLN  50           HN       GLN  50  -7.423 -14.575   9.001
  420    HA   GLN  50           HA       GLN  50  -9.766 -13.111   8.259
  421   1HB   GLN  50           HB2      GLN  50  -9.810 -15.381   9.283
  422   2HB   GLN  50           HB1      GLN  50  -9.262 -14.681  10.807
  423   1HG   GLN  50           HG2      GLN  50 -11.275 -13.572  11.183
  424   2HG   GLN  50           HG1      GLN  50 -11.693 -13.537   9.469
  425   1HE2  GLN  50          HE22      GLN  50 -12.483 -16.933  11.646
  426   2HE2  GLN  50          HE21      GLN  50 -11.353 -15.811  12.234
  427    H    GLU  51           HN       GLU  51  -7.262 -12.505  10.609
  428    HA   GLU  51           HA       GLU  51  -8.838 -10.553  12.116
  429   1HB   GLU  51           HB2      GLU  51  -6.023 -11.562  12.175
  430   2HB   GLU  51           HB1      GLU  51  -6.357  -9.991  12.907
  431   1HG   GLU  51           HG2      GLU  51  -6.865 -11.267  14.737
  432   2HG   GLU  51           HG1      GLU  51  -8.422 -11.421  13.922
  433    H    VAL  52           HN       VAL  52  -6.506 -10.486   9.460
  434    HA   VAL  52           HA       VAL  52  -6.154  -7.611   9.504
  435    HB   VAL  52           HB       VAL  52  -5.728  -9.590   7.244
  436   1HG1  VAL  52          HG11      VAL  52  -5.713  -6.764   7.258
  437   2HG1  VAL  52          HG13      VAL  52  -4.020  -7.262   7.251
  438   3HG1  VAL  52          HG12      VAL  52  -5.111  -7.830   5.987
  439   1HG2  VAL  52          HG21      VAL  52  -4.436  -9.524   9.663
  440   2HG2  VAL  52          HG23      VAL  52  -3.706 -10.096   8.163
  441   3HG2  VAL  52          HG22      VAL  52  -3.434  -8.438   8.702
  442    H    VAL  53           HN       VAL  53  -8.145  -9.803   7.498
  443    HA   VAL  53           HA       VAL  53  -9.399  -7.581   6.100
  444    HB   VAL  53           HB       VAL  53 -10.259 -10.482   6.329
  445   1HG1  VAL  53          HG11      VAL  53 -11.585  -8.207   5.257
  446   2HG1  VAL  53          HG13      VAL  53 -11.013  -9.162   3.888
  447   3HG1  VAL  53          HG12      VAL  53 -12.056  -9.900   5.104
  448   1HG2  VAL  53          HG21      VAL  53  -8.295  -9.015   4.622
  449   2HG2  VAL  53          HG23      VAL  53  -8.243 -10.675   5.217
  450   3HG2  VAL  53          HG22      VAL  53  -9.272 -10.262   3.846
  451    H    ASP  54           HN       ASP  54 -10.021  -9.373   9.021
  452    HA   ASP  54           HA       ASP  54 -12.780  -8.441   9.270
  453   1HB   ASP  54           HB2      ASP  54 -12.058 -10.590  10.271
  454   2HB   ASP  54           HB1      ASP  54 -10.949  -9.715  11.328
  455    H    LYS  55           HN       LYS  55  -9.594  -7.301  10.195
  456    HA   LYS  55           HA       LYS  55 -10.620  -5.452  12.209
  457   1HB   LYS  55           HB2      LYS  55  -8.335  -4.498  12.178
  458   2HB   LYS  55           HB1      LYS  55  -8.298  -6.252  12.350
  459   1HG   LYS  55           HG2      LYS  55  -7.654  -6.566  10.084
  460   2HG   LYS  55           HG1      LYS  55  -8.076  -4.913   9.651
  461   1HD   LYS  55           HD2      LYS  55  -5.585  -5.385   9.937
  462   2HD   LYS  55           HD1      LYS  55  -6.222  -4.015  10.849
  463   1HE   LYS  55           HE2      LYS  55  -6.442  -6.541  12.312
  464   2HE   LYS  55           HE1      LYS  55  -4.774  -6.128  11.917
  465   1HZ   LYS  55           HZ2      LYS  55  -6.078  -3.798  12.748
  466   2HZ   LYS  55           HZ1      LYS  55  -6.419  -5.009  13.890
  467   3HZ   LYS  55           HZ3      LYS  55  -4.808  -4.623  13.522
  468    H    VAL  56           HN       VAL  56  -9.684  -5.238   8.781
  469    HA   VAL  56           HA       VAL  56 -10.277  -2.369   8.699
  470    HB   VAL  56           HB       VAL  56 -10.072  -2.833   6.163
  471   1HG1  VAL  56          HG13      VAL  56  -7.766  -3.418   8.041
  472   2HG1  VAL  56          HG12      VAL  56  -7.592  -2.992   6.338
  473   3HG1  VAL  56          HG11      VAL  56  -8.269  -1.825   7.476
  474   1HG2  VAL  56          HG22      VAL  56 -10.237  -5.468   7.021
  475   2HG2  VAL  56          HG21      VAL  56  -9.695  -4.938   5.431
  476   3HG2  VAL  56          HG23      VAL  56  -8.517  -5.249   6.705
  477    H    MET  57           HN       MET  57 -11.843  -5.396   7.891
  478    HA   MET  57           HA       MET  57 -14.143  -4.174   6.590
  479   1HB   MET  57           HB2      MET  57 -13.363  -6.536   6.184
  480   2HB   MET  57           HB1      MET  57 -13.874  -6.938   7.824
  481   1HG   MET  57           HG2      MET  57 -16.040  -7.062   7.218
  482   2HG   MET  57           HG1      MET  57 -15.956  -5.538   6.335
  483   1HE   MET  57           HE3      MET  57 -14.840  -5.180   4.287
  484   2HE   MET  57           HE2      MET  57 -13.522  -6.322   4.022
  485   3HE   MET  57           HE1      MET  57 -14.873  -6.268   2.891
  486    H    GLU  58           HN       GLU  58 -13.205  -4.959   9.868
  487    HA   GLU  58           HA       GLU  58 -15.932  -4.714  10.925
  488   1HB   GLU  58           HB2      GLU  58 -13.195  -5.001  12.161
  489   2HB   GLU  58           HB1      GLU  58 -14.575  -4.532  13.153
  490   1HG   GLU  58           HG2      GLU  58 -15.795  -6.542  12.470
  491   2HG   GLU  58           HG1      GLU  58 -14.469  -7.009  11.403
  492    H    THR  59           HN       THR  59 -12.944  -2.730  11.028
  493    HA   THR  59           HA       THR  59 -14.191  -0.477  12.312
  494    HB   THR  59           HB       THR  59 -11.932  -0.207  10.328
  495    HG1  THR  59           HG1      THR  59 -10.682  -0.726  12.373
  496   1HG2  THR  59          HG22      THR  59 -13.144   1.593  11.965
  497   2HG2  THR  59          HG21      THR  59 -11.869   1.001  13.031
  498   3HG2  THR  59          HG23      THR  59 -11.456   1.709  11.469
  499    H    LEU  60           HN       LEU  60 -14.016  -1.633   9.033
  500    HA   LEU  60           HA       LEU  60 -14.908   0.752   7.702
  501   1HB   LEU  60           HB2      LEU  60 -14.636  -2.146   7.061
  502   2HB   LEU  60           HB1      LEU  60 -15.749  -1.223   6.055
  503    HG   LEU  60           HG       LEU  60 -12.903  -0.366   6.634
  504   1HD1  LEU  60          HD13      LEU  60 -14.074  -2.158   4.547
  505   2HD1  LEU  60          HD12      LEU  60 -12.816  -1.027   4.045
  506   3HD1  LEU  60          HD11      LEU  60 -12.484  -2.213   5.310
  507   1HD2  LEU  60          HD21      LEU  60 -14.811   1.277   5.910
  508   2HD2  LEU  60          HD23      LEU  60 -13.268   1.339   5.057
  509   3HD2  LEU  60          HD22      LEU  60 -14.643   0.506   4.332
  510    H    ASP  61           HN       ASP  61 -16.670  -2.237   8.576
  511    HA   ASP  61           HA       ASP  61 -19.257  -0.953   8.107
  512   1HB   ASP  61           HB2      ASP  61 -18.353  -3.576   8.151
  513   2HB   ASP  61           HB1      ASP  61 -19.286  -3.449   9.642
  514    H    GLU  62           HN       GLU  62 -17.069  -0.687  10.575
  515    HA   GLU  62           HA       GLU  62 -18.923  -0.849  12.831
  516   1HB   GLU  62           HB2      GLU  62 -16.564  -1.311  13.222
  517   2HB   GLU  62           HB1      GLU  62 -16.116   0.277  12.596
  518   1HG   GLU  62           HG2      GLU  62 -17.182   1.397  14.433
  519   2HG   GLU  62           HG1      GLU  62 -17.952  -0.095  14.974
  520    H    ASP  63           HN       ASP  63 -17.537   1.699  10.808
  521    HA   ASP  63           HA       ASP  63 -19.214   3.692  12.265
  522   1HB   ASP  63           HB2      ASP  63 -16.549   3.772  11.235
  523   2HB   ASP  63           HB1      ASP  63 -17.521   4.931  10.327
  524    H    GLY  64           HN       GLY  64 -18.065   3.334   8.905
  525   1HA   GLY  64           HA2      GLY  64 -19.391   3.148   6.933
  526   2HA   GLY  64           HA1      GLY  64 -20.841   3.301   7.926
  527    H    ASP  65           HN       ASP  65 -20.635   5.651   9.190
  528    HA   ASP  65           HA       ASP  65 -20.528   7.600   6.943
  529   1HB   ASP  65           HB2      ASP  65 -22.610   7.334   8.400
  530   2HB   ASP  65           HB1      ASP  65 -21.672   8.060   9.706
  531    H    GLY  66           HN       GLY  66 -18.186   6.553   8.598
  532   1HA   GLY  66           HA2      GLY  66 -17.314   9.043   9.941
  533   2HA   GLY  66           HA1      GLY  66 -16.493   7.484  10.040
  534    H    GLU  67           HN       GLU  67 -15.105   9.868   9.426
  535    HA   GLU  67           HA       GLU  67 -14.591   9.637   6.496
  536   1HB   GLU  67           HB2      GLU  67 -13.275  11.775   6.875
  537   2HB   GLU  67           HB1      GLU  67 -15.010  11.911   7.167
  538   1HG   GLU  67           HG2      GLU  67 -14.735  11.868   9.518
  539   2HG   GLU  67           HG1      GLU  67 -13.085  11.251   9.398
  540    H    CYS  68           HN       CYS  68 -12.449   9.240   5.753
  541    HA   CYS  68           HA       CYS  68 -10.591   8.209   7.865
  542   1HB   CYS  68           HB2      CYS  68 -10.495   7.295   5.000
  543   2HB   CYS  68           HB1      CYS  68  -9.938   6.459   6.449
  544    HG   CYS  68           HG       CYS  68 -12.138   5.300   6.236
  545    H    ASP  69           HN       ASP  69  -8.229   8.179   6.949
  546    HA   ASP  69           HA       ASP  69  -7.758  10.849   5.687
  547   1HB   ASP  69           HB2      ASP  69  -6.123   9.170   7.598
  548   2HB   ASP  69           HB1      ASP  69  -5.407  10.501   6.686
  549    H    PHE  70           HN       PHE  70  -5.342  10.697   4.612
  550    HA   PHE  70           HA       PHE  70  -5.700   8.775   2.435
  551   1HB   PHE  70           HB2      PHE  70  -3.591   9.814   1.537
  552   2HB   PHE  70           HB1      PHE  70  -4.884  10.972   1.838
  553    HD1  PHE  70           HD1      PHE  70  -4.767  12.537   3.734
  554    HD2  PHE  70           HD2      PHE  70  -1.583   9.768   2.912
  555    HE1  PHE  70           HE1      PHE  70  -3.261  13.821   5.229
  556    HE2  PHE  70           HE2      PHE  70  -0.081  11.054   4.410
  557    HZ   PHE  70           HZ       PHE  70  -0.921  13.080   5.566
  558    H    GLN  71           HN       GLN  71  -3.606   9.114   5.257
  559    HA   GLN  71           HA       GLN  71  -1.889   6.876   4.453
  560   1HB   GLN  71           HB2      GLN  71  -2.230   8.279   7.129
  561   2HB   GLN  71           HB1      GLN  71  -0.987   7.079   6.768
  562   1HG   GLN  71           HG2      GLN  71  -0.762   8.894   4.674
  563   2HG   GLN  71           HG1      GLN  71  -1.084   9.916   6.076
  564   1HE2  GLN  71          HE22      GLN  71   2.151   7.429   6.568
  565   2HE2  GLN  71          HE21      GLN  71   0.687   6.788   5.995
  566    H    GLU  72           HN       GLU  72  -4.886   7.337   6.148
  567    HA   GLU  72           HA       GLU  72  -4.854   4.754   7.495
  568   1HB   GLU  72           HB2      GLU  72  -6.815   6.977   7.094
  569   2HB   GLU  72           HB1      GLU  72  -7.454   5.393   7.523
  570   1HG   GLU  72           HG2      GLU  72  -5.296   5.697   9.242
  571   2HG   GLU  72           HG1      GLU  72  -5.992   7.317   9.171
  572    H    PHE  73           HN       PHE  73  -6.703   6.078   4.723
  573    HA   PHE  73           HA       PHE  73  -7.801   3.550   3.937
  574   1HB   PHE  73           HB2      PHE  73  -8.925   4.910   2.520
  575   2HB   PHE  73           HB1      PHE  73  -7.925   6.255   3.048
  576    HD1  PHE  73           HD1      PHE  73  -5.735   6.707   1.844
  577    HD2  PHE  73           HD2      PHE  73  -8.677   3.955   0.352
  578    HE1  PHE  73           HE1      PHE  73  -4.683   6.798  -0.400
  579    HE2  PHE  73           HE2      PHE  73  -7.624   4.047  -1.893
  580    HZ   PHE  73           HZ       PHE  73  -5.627   5.468  -2.267
  581    H    MET  74           HN       MET  74  -4.711   5.059   3.469
  582    HA   MET  74           HA       MET  74  -3.840   3.432   1.245
  583   1HB   MET  74           HB2      MET  74  -2.642   5.377   3.131
  584   2HB   MET  74           HB1      MET  74  -1.525   4.175   2.492
  585   1HG   MET  74           HG2      MET  74  -3.295   6.032   0.873
  586   2HG   MET  74           HG1      MET  74  -1.542   6.129   1.024
  587   1HE   MET  74           HE2      MET  74  -0.426   3.585   1.035
  588   2HE   MET  74           HE1      MET  74  -1.779   2.458   1.062
  589   3HE   MET  74           HE3      MET  74  -0.666   2.477  -0.314
  590    H    ALA  75           HN       ALA  75  -3.145   3.287   4.759
  591    HA   ALA  75           HA       ALA  75  -1.725   0.780   4.572
  592   1HB   ALA  75           HB1      ALA  75  -1.522   2.384   6.492
  593   2HB   ALA  75           HB3      ALA  75  -3.160   1.947   6.980
  594   3HB   ALA  75           HB2      ALA  75  -1.878   0.734   7.004
  595    H    PHE  76           HN       PHE  76  -5.070   1.642   4.622
  596    HA   PHE  76           HA       PHE  76  -6.079  -0.905   5.600
  597   1HB   PHE  76           HB2      PHE  76  -7.174   1.635   4.643
  598   2HB   PHE  76           HB1      PHE  76  -8.096   0.249   4.064
  599    HD1  PHE  76           HD2      PHE  76  -6.329   1.209   7.242
  600    HD2  PHE  76           HD1      PHE  76  -9.895  -0.337   5.413
  601    HE1  PHE  76           HE2      PHE  76  -7.376   0.977   9.479
  602    HE2  PHE  76           HE1      PHE  76 -10.943  -0.569   7.649
  603    HZ   PHE  76           HZ       PHE  76  -9.682   0.089   9.682
  604    H    VAL  77           HN       VAL  77  -5.359   0.492   2.437
  605    HA   VAL  77           HA       VAL  77  -6.552  -1.665   0.907
  606    HB   VAL  77           HB       VAL  77  -4.446   0.385   0.156
  607   1HG1  VAL  77          HG12      VAL  77  -5.706  -1.850  -1.299
  608   2HG1  VAL  77          HG11      VAL  77  -5.777  -0.302  -2.140
  609   3HG1  VAL  77          HG13      VAL  77  -4.219  -0.971  -1.653
  610   1HG2  VAL  77          HG21      VAL  77  -7.198   0.664   0.740
  611   2HG2  VAL  77          HG23      VAL  77  -6.146   1.857  -0.023
  612   3HG2  VAL  77          HG22      VAL  77  -7.068   0.729  -1.018
  613    H    SER  78           HN       SER  78  -3.453  -1.148   2.440
  614    HA   SER  78           HA       SER  78  -2.077  -3.225   0.922
  615   1HB   SER  78           HB2      SER  78  -1.333  -1.889   3.541
  616   2HB   SER  78           HB1      SER  78  -0.263  -2.886   2.556
  617    HG   SER  78           HG       SER  78  -0.944  -0.278   2.287
  618    H    MET  79           HN       MET  79  -3.574  -3.040   4.159
  619    HA   MET  79           HA       MET  79  -2.768  -5.624   5.040
  620   1HB   MET  79           HB2      MET  79  -5.434  -4.452   5.790
  621   2HB   MET  79           HB1      MET  79  -4.288  -5.338   6.793
  622   1HG   MET  79           HG2      MET  79  -2.880  -3.081   5.887
  623   2HG   MET  79           HG1      MET  79  -4.479  -2.485   6.336
  624   1HE   MET  79           HE1      MET  79  -5.191  -1.908   8.224
  625   2HE   MET  79           HE3      MET  79  -4.516  -2.111   9.847
  626   3HE   MET  79           HE2      MET  79  -3.702  -1.080   8.672
  627    H    VAL  80           HN       VAL  80  -5.664  -4.594   3.234
  628    HA   VAL  80           HA       VAL  80  -6.726  -7.308   3.159
  629    HB   VAL  80           HB       VAL  80  -8.303  -6.213   1.436
  630   1HG1  VAL  80          HG12      VAL  80  -8.869  -6.619   3.808
  631   2HG1  VAL  80          HG11      VAL  80  -8.107  -5.091   4.246
  632   3HG1  VAL  80          HG13      VAL  80  -9.556  -5.097   3.241
  633   1HG2  VAL  80          HG22      VAL  80  -6.359  -4.191   1.601
  634   2HG2  VAL  80          HG21      VAL  80  -7.929  -4.078   0.813
  635   3HG2  VAL  80          HG23      VAL  80  -7.750  -3.566   2.488
  636    H    THR  81           HN       THR  81  -4.979  -5.209   0.867
  637    HA   THR  81           HA       THR  81  -5.253  -6.994  -1.373
  638    HB   THR  81           HB       THR  81  -3.023  -5.005  -0.839
  639    HG1  THR  81           HG1      THR  81  -5.682  -4.754  -1.575
  640   1HG2  THR  81          HG22      THR  81  -3.336  -6.882  -2.883
  641   2HG2  THR  81          HG21      THR  81  -3.937  -5.378  -3.582
  642   3HG2  THR  81          HG23      THR  81  -2.300  -5.456  -2.928
  643    H    THR  82           HN       THR  82  -3.587  -7.400   1.518
  644    HA   THR  82           HA       THR  82  -1.615  -9.239   0.224
  645    HB   THR  82           HB       THR  82  -0.575  -9.126   2.615
  646    HG1  THR  82           HG1      THR  82  -1.087  -6.897   3.410
  647   1HG2  THR  82          HG21      THR  82   0.013  -7.897   0.297
  648   2HG2  THR  82          HG23      THR  82  -0.360  -6.478   1.276
  649   3HG2  THR  82          HG22      THR  82   0.912  -7.590   1.783
  650    H    ALA  83           HN       ALA  83  -4.282  -9.015   2.484
  651    HA   ALA  83           HA       ALA  83  -3.990 -11.436   3.902
  652   1HB   ALA  83           HB3      ALA  83  -6.382  -9.859   2.982
  653   2HB   ALA  83           HB2      ALA  83  -6.611 -11.423   3.765
  654   3HB   ALA  83           HB1      ALA  83  -5.788 -10.119   4.623
  655    H    CYS  84           HN       CYS  84  -6.627 -11.454   1.589
  656    HA   CYS  84           HA       CYS  84  -7.314 -13.211   0.171
  657   1HB   CYS  84           HB2      CYS  84  -4.439 -13.318  -0.721
  658   2HB   CYS  84           HB1      CYS  84  -5.903 -13.471  -1.692
  659    HG   CYS  84           HG       CYS  84  -4.985 -10.747  -0.448
  660    H    HIS  85           HN       HIS  85  -6.089 -15.470  -0.791
  661    HA   HIS  85           HA       HIS  85  -5.134 -16.896   1.656
  662   1HB   HIS  85           HB2      HIS  85  -7.604 -17.298   0.958
  663   2HB   HIS  85           HB1      HIS  85  -6.920 -18.205  -0.391
  664    HD1  HIS  85           HD1      HIS  85  -4.682 -18.533   2.410
  665    HD2  HIS  85           HD2      HIS  85  -8.234 -20.395   1.266
  666    HE1  HIS  85           HE1      HIS  85  -4.818 -20.690   3.730
  667    H    GLU  86           HN       GLU  86  -5.379 -17.001  -1.900
  668    HA   GLU  86           HA       GLU  86  -3.082 -18.862  -2.021
  669   1HB   GLU  86           HB2      GLU  86  -5.061 -17.768  -3.997
  670   2HB   GLU  86           HB1      GLU  86  -3.525 -18.408  -4.587
  671   1HG   GLU  86           HG2      GLU  86  -3.948 -20.553  -3.540
  672   2HG   GLU  86           HG1      GLU  86  -5.400 -19.929  -2.754
  673    H    PHE  87           HN       PHE  87  -2.659 -16.179  -0.946
  674    HA   PHE  87           HA       PHE  87  -0.931 -14.584  -1.106
  675   1HB   PHE  87           HB2      PHE  87   0.133 -16.656  -2.424
  676   2HB   PHE  87           HB1      PHE  87  -0.093 -15.577  -3.799
  677    HD1  PHE  87           HD2      PHE  87   0.170 -13.097  -1.700
  678    HD2  PHE  87           HD1      PHE  87   2.619 -16.438  -2.856
  679    HE1  PHE  87           HE2      PHE  87   2.202 -11.840  -1.034
  680    HE2  PHE  87           HE1      PHE  87   4.649 -15.180  -2.188
  681    HZ   PHE  87           HZ       PHE  87   4.440 -12.881  -1.277
  682    H    PHE  88           HN       PHE  88  -0.073 -13.563  -3.813
  683    HA   PHE  88           HA       PHE  88  -2.088 -11.539  -4.104
  684   1HB   PHE  88           HB2      PHE  88   0.063 -12.334  -6.087
  685   2HB   PHE  88           HB1      PHE  88  -0.794 -10.793  -6.029
  686    HD1  PHE  88           HD1      PHE  88  -0.890 -10.425  -3.034
  687    HD2  PHE  88           HD2      PHE  88   2.299 -11.640  -5.647
  688    HE1  PHE  88           HE1      PHE  88   0.771  -9.562  -1.406
  689    HE2  PHE  88           HE2      PHE  88   3.960 -10.778  -4.019
  690    HZ   PHE  88           HZ       PHE  88   3.197  -9.738  -1.900
  691    H    GLU  89           HN       GLU  89  -1.056 -13.620  -6.803
  692    HA   GLU  89           HA       GLU  89  -3.938 -13.856  -7.549
  693   1HB   GLU  89           HB2      GLU  89  -2.039 -12.808  -9.095
  694   2HB   GLU  89           HB1      GLU  89  -1.750 -14.506  -9.482
  695   1HG   GLU  89           HG2      GLU  89  -3.360 -13.611 -11.071
  696   2HG   GLU  89           HG1      GLU  89  -4.190 -14.745 -10.006
  697    H    HIS  90           HN       HIS  90  -1.045 -15.795  -8.329
  698    HA   HIS  90           HA       HIS  90  -2.193 -18.121  -6.940
  699   1HB   HIS  90           HB2      HIS  90  -2.401 -19.526  -8.863
  700   2HB   HIS  90           HB1      HIS  90  -3.224 -18.023  -9.279
  701    HD1  HIS  90           HD1      HIS  90  -1.987 -16.398 -10.929
  702    HD2  HIS  90           HD2      HIS  90  -0.063 -20.054 -10.366
  703    HE1  HIS  90           HE1      HIS  90  -0.250 -16.582 -12.762
  704    H    GLU  91           HN       GLU  91   0.352 -16.824  -9.030
  705    HA   GLU  91           HA       GLU  91   2.339 -18.296  -7.388
  706   1HB   GLU  91           HB2      GLU  91   1.764 -19.624  -9.500
  707   2HB   GLU  91           HB1      GLU  91   2.504 -18.306 -10.408
  708   1HG   GLU  91           HG2      GLU  91   4.429 -18.743  -8.539
  709   2HG   GLU  91           HG1      GLU  91   3.777 -20.373  -8.709
  710   1H    MET   0           HT1      MET   0 -12.503  -3.878 -15.400
  711   2H    MET   0           HT3      MET   0 -11.537  -4.479 -16.661
  712   3H    MET   0           HT2      MET   0 -11.832  -5.436 -15.288
  713    HA   MET   0           HA       MET   0  -9.929  -4.689 -14.467
  714   1HB   MET   0           HB2      MET   0  -8.548  -3.195 -15.648
  715   2HB   MET   0           HB1      MET   0  -9.554  -3.888 -16.920
  716   1HG   MET   0           HG2      MET   0 -10.018  -1.230 -15.529
  717   2HG   MET   0           HG1      MET   0  -9.432  -1.450 -17.178
  718   1HE   MET   0           HE2      MET   0 -11.854   0.338 -16.358
  719   2HE   MET   0           HE1      MET   0 -11.325   0.145 -18.027
  720   3HE   MET   0           HE3      MET   0 -13.035  -0.035 -17.611
  721    H    SER   1           HN       SER   1  -9.162  -2.967 -12.976
  722    HA   SER   1           HA       SER   1 -11.256  -0.942 -12.327
  723   1HB   SER   1           HB2      SER   1 -11.819  -2.407 -10.639
  724   2HB   SER   1           HB1      SER   1 -10.221  -3.149 -10.607
  725    HG   SER   1           HG       SER   1 -11.166  -0.823  -9.367
  726    H    GLU   2           HN       GLU   2 -10.385   0.790 -10.882
  727    HA   GLU   2           HA       GLU   2  -7.768   1.647 -11.798
  728   1HB   GLU   2           HB2      GLU   2 -10.024   2.885 -10.701
  729   2HB   GLU   2           HB1      GLU   2  -8.777   3.079  -9.469
  730   1HG   GLU   2           HG2      GLU   2  -8.062   4.834 -10.709
  731   2HG   GLU   2           HG1      GLU   2  -7.405   3.618 -11.807
  732    H    LEU   3           HN       LEU   3  -9.036   0.928  -8.526
  733    HA   LEU   3           HA       LEU   3  -6.498   0.974  -7.226
  734   1HB   LEU   3           HB2      LEU   3  -8.970   0.855  -6.290
  735   2HB   LEU   3           HB1      LEU   3  -8.660  -0.879  -6.300
  736    HG   LEU   3           HG       LEU   3  -6.505  -0.390  -5.046
  737   1HD1  LEU   3          HD12      LEU   3  -7.819   2.330  -4.979
  738   2HD1  LEU   3          HD11      LEU   3  -6.659   1.829  -3.749
  739   3HD1  LEU   3          HD13      LEU   3  -6.165   1.925  -5.440
  740   1HD2  LEU   3          HD23      LEU   3  -9.265  -0.368  -4.112
  741   2HD2  LEU   3          HD22      LEU   3  -7.858  -1.171  -3.414
  742   3HD2  LEU   3          HD21      LEU   3  -8.205   0.511  -3.008
  743    H    GLU   4           HN       GLU   4  -8.292  -1.634  -8.803
  744    HA   GLU   4           HA       GLU   4  -6.593  -3.776  -7.980
  745   1HB   GLU   4           HB2      GLU   4  -8.740  -4.263  -8.986
  746   2HB   GLU   4           HB1      GLU   4  -8.283  -3.436 -10.475
  747   1HG   GLU   4           HG2      GLU   4  -6.266  -5.372  -9.913
  748   2HG   GLU   4           HG1      GLU   4  -7.830  -6.173  -9.762
  749    H    LYS   5           HN       LYS   5  -6.537  -1.929 -11.064
  750    HA   LYS   5           HA       LYS   5  -4.181  -3.187 -12.057
  751   1HB   LYS   5           HB2      LYS   5  -5.439  -0.495 -12.609
  752   2HB   LYS   5           HB1      LYS   5  -3.991  -1.049 -13.453
  753   1HG   LYS   5           HG2      LYS   5  -5.252  -3.129 -14.103
  754   2HG   LYS   5           HG1      LYS   5  -6.703  -2.401 -13.413
  755   1HD   LYS   5           HD2      LYS   5  -6.979  -0.995 -15.171
  756   2HD   LYS   5           HD1      LYS   5  -5.255  -0.630 -15.262
  757   1HE   LYS   5           HE2      LYS   5  -5.739  -3.383 -16.016
  758   2HE   LYS   5           HE1      LYS   5  -6.723  -2.296 -16.997
  759   1HZ   LYS   5           HZ2      LYS   5  -3.851  -1.783 -16.518
  760   2HZ   LYS   5           HZ1      LYS   5  -4.372  -2.786 -17.787
  761   3HZ   LYS   5           HZ3      LYS   5  -4.850  -1.157 -17.744
  762    H    ALA   6           HN       ALA   6  -4.580  -0.343  -9.967
  763    HA   ALA   6           HA       ALA   6  -1.728   0.287 -10.046
  764   1HB   ALA   6           HB1      ALA   6  -4.000   1.285  -8.309
  765   2HB   ALA   6           HB3      ALA   6  -2.348   1.894  -8.200
  766   3HB   ALA   6           HB2      ALA   6  -3.273   2.108  -9.687
  767    H    MET   7           HN       MET   7  -3.763  -0.438  -7.208
  768    HA   MET   7           HA       MET   7  -1.771  -1.113  -5.412
  769   1HB   MET   7           HB2      MET   7  -4.093  -1.022  -4.718
  770   2HB   MET   7           HB1      MET   7  -4.500  -2.393  -5.756
  771   1HG   MET   7           HG2      MET   7  -4.182  -2.972  -3.307
  772   2HG   MET   7           HG1      MET   7  -3.174  -3.895  -4.422
  773   1HE   MET   7           HE1      MET   7  -3.538  -2.696  -1.469
  774   2HE   MET   7           HE3      MET   7  -1.997  -3.456  -1.050
  775   3HE   MET   7           HE2      MET   7  -2.207  -1.717  -0.862
  776    H    VAL   8           HN       VAL   8  -3.456  -3.430  -7.551
  777    HA   VAL   8           HA       VAL   8  -1.886  -5.689  -6.864
  778    HB   VAL   8           HB       VAL   8  -3.060  -5.088  -9.595
  779   1HG1  VAL   8          HG13      VAL   8  -2.303  -7.640  -8.148
  780   2HG1  VAL   8          HG12      VAL   8  -3.252  -7.600  -9.636
  781   3HG1  VAL   8          HG11      VAL   8  -1.590  -7.009  -9.633
  782   1HG2  VAL   8          HG22      VAL   8  -4.712  -4.815  -7.743
  783   2HG2  VAL   8          HG21      VAL   8  -5.079  -6.208  -8.762
  784   3HG2  VAL   8          HG23      VAL   8  -4.322  -6.443  -7.187
  785    H    ALA   9           HN       ALA   9  -1.283  -3.083  -9.188
  786    HA   ALA   9           HA       ALA   9   0.946  -4.150 -10.546
  787   1HB   ALA   9           HB2      ALA   9  -0.107  -1.926 -11.031
  788   2HB   ALA   9           HB1      ALA   9   0.643  -1.290  -9.567
  789   3HB   ALA   9           HB3      ALA   9   1.649  -1.837 -10.909
  790    H    LEU  10           HN       LEU  10   0.787  -2.532  -7.376
  791    HA   LEU  10           HA       LEU  10   3.531  -2.457  -6.758
  792   1HB   LEU  10           HB2      LEU  10   1.152  -2.036  -5.359
  793   2HB   LEU  10           HB1      LEU  10   1.919  -3.369  -4.494
  794    HG   LEU  10           HG       LEU  10   3.741  -1.171  -5.269
  795   1HD1  LEU  10          HD13      LEU  10   1.706   0.097  -4.647
  796   2HD1  LEU  10          HD12      LEU  10   1.631  -0.784  -3.121
  797   3HD1  LEU  10          HD11      LEU  10   2.981   0.302  -3.446
  798   1HD2  LEU  10          HD21      LEU  10   3.901  -3.337  -3.648
  799   2HD2  LEU  10          HD23      LEU  10   4.879  -1.889  -3.409
  800   3HD2  LEU  10          HD22      LEU  10   3.404  -2.121  -2.471
  801    H    ILE  11           HN       ILE  11   1.212  -5.115  -6.131
  802    HA   ILE  11           HA       ILE  11   2.990  -6.999  -5.054
  803    HB   ILE  11           HB       ILE  11   0.499  -7.189  -6.714
  804   1HG1  ILE  11          HG12      ILE  11  -0.165  -8.554  -4.673
  805   2HG1  ILE  11          HG11      ILE  11   1.396  -8.118  -3.975
  806   1HG2  ILE  11          HG23      ILE  11   2.441  -9.442  -6.206
  807   2HG2  ILE  11          HG22      ILE  11   0.712  -9.752  -6.354
  808   3HG2  ILE  11          HG21      ILE  11   1.597  -9.033  -7.699
  809   1HD1  ILE  11          HD11      ILE  11  -0.339  -5.939  -5.079
  810   2HD1  ILE  11          HD13      ILE  11  -0.746  -6.629  -3.508
  811   3HD1  ILE  11          HD12      ILE  11   0.830  -5.878  -3.760
  812    H    ASP  12           HN       ASP  12   2.434  -6.134  -8.452
  813    HA   ASP  12           HA       ASP  12   3.962  -8.093  -9.748
  814   1HB   ASP  12           HB2      ASP  12   2.647  -6.100 -10.740
  815   2HB   ASP  12           HB1      ASP  12   4.126  -5.173 -10.507
  816    H    VAL  13           HN       VAL  13   5.112  -4.979  -8.433
  817    HA   VAL  13           HA       VAL  13   7.860  -5.309  -9.011
  818    HB   VAL  13           HB       VAL  13   6.463  -3.914  -6.712
  819   1HG1  VAL  13          HG13      VAL  13   9.277  -4.570  -7.052
  820   2HG1  VAL  13          HG12      VAL  13   9.026  -2.824  -7.038
  821   3HG1  VAL  13          HG11      VAL  13   8.468  -3.805  -5.683
  822   1HG2  VAL  13          HG21      VAL  13   7.439  -3.199  -9.442
  823   2HG2  VAL  13          HG23      VAL  13   6.011  -2.629  -8.575
  824   3HG2  VAL  13          HG22      VAL  13   7.602  -1.979  -8.179
  825    H    PHE  14           HN       PHE  14   5.920  -6.614  -6.360
  826    HA   PHE  14           HA       PHE  14   8.083  -7.593  -4.765
  827   1HB   PHE  14           HB2      PHE  14   5.549  -7.438  -4.205
  828   2HB   PHE  14           HB1      PHE  14   5.431  -9.009  -4.999
  829    HD1  PHE  14           HD2      PHE  14   7.479  -7.213  -2.419
  830    HD2  PHE  14           HD1      PHE  14   5.824 -10.947  -3.754
  831    HE1  PHE  14           HE2      PHE  14   8.312  -8.319  -0.361
  832    HE2  PHE  14           HE1      PHE  14   6.658 -12.052  -1.695
  833    HZ   PHE  14           HZ       PHE  14   7.902 -10.739   0.001
  834    H    HIS  15           HN       HIS  15   6.330  -9.003  -7.513
  835    HA   HIS  15           HA       HIS  15   7.690 -11.569  -7.307
  836   1HB   HIS  15           HB2      HIS  15   5.432 -11.133  -8.435
  837   2HB   HIS  15           HB1      HIS  15   6.349 -10.448  -9.778
  838    HD1  HIS  15           HD1      HIS  15   6.929 -12.107 -11.537
  839    HD2  HIS  15           HD2      HIS  15   6.545 -13.923  -7.805
  840    HE1  HIS  15           HE1      HIS  15   7.316 -14.584 -11.902
  841    H    GLN  16           HN       GLN  16   8.603  -8.495  -8.437
  842    HA   GLN  16           HA       GLN  16  10.490  -9.517 -10.457
  843   1HB   GLN  16           HB2      GLN  16   9.226  -7.232 -10.491
  844   2HB   GLN  16           HB1      GLN  16  10.484  -6.706  -9.373
  845   1HG   GLN  16           HG2      GLN  16  11.045  -6.230 -11.767
  846   2HG   GLN  16           HG1      GLN  16  12.221  -7.282 -10.978
  847   1HE2  GLN  16          HE22      GLN  16   9.560  -9.379 -13.285
  848   2HE2  GLN  16          HE21      GLN  16   8.987  -8.299 -12.108
  849    H    TYR  17           HN       TYR  17  10.743  -7.735  -7.360
  850    HA   TYR  17           HA       TYR  17  13.611  -8.214  -7.196
  851   1HB   TYR  17           HB2      TYR  17  11.575  -7.154  -5.221
  852   2HB   TYR  17           HB1      TYR  17  13.293  -7.304  -4.846
  853    HD1  TYR  17           HD2      TYR  17  10.821  -5.653  -7.068
  854    HD2  TYR  17           HD1      TYR  17  14.916  -5.795  -5.771
  855    HE1  TYR  17           HE2      TYR  17  11.262  -3.505  -8.228
  856    HE2  TYR  17           HE1      TYR  17  15.356  -3.649  -6.932
  857    HH   TYR  17           HH       TYR  17  14.436  -2.312  -8.736
  858    H    SER  18           HN       SER  18  10.738  -9.888  -6.131
  859    HA   SER  18           HA       SER  18  12.395 -11.694  -4.435
  860   1HB   SER  18           HB2      SER  18   9.987 -10.609  -3.867
  861   2HB   SER  18           HB1      SER  18   9.454 -12.089  -4.661
  862    HG   SER  18           HG       SER  18   9.747 -12.590  -2.532
  863    H    GLY  19           HN       GLY  19  11.129 -11.465  -7.561
  864   1HA   GLY  19           HA2      GLY  19  10.694 -14.355  -7.901
  865   2HA   GLY  19           HA1      GLY  19  10.518 -13.130  -9.157
  866    H    ARG  20           HN       ARG  20  13.224 -11.990  -8.446
  867    HA   ARG  20           HA       ARG  20  14.772 -13.440 -10.358
  868   1HB   ARG  20           HB2      ARG  20  15.691 -11.564  -8.151
  869   2HB   ARG  20           HB1      ARG  20  16.683 -12.089  -9.513
  870   1HG   ARG  20           HG2      ARG  20  15.326 -10.959 -11.089
  871   2HG   ARG  20           HG1      ARG  20  14.011 -10.753  -9.933
  872   1HD   ARG  20           HD2      ARG  20  14.868  -8.762  -9.326
  873   2HD   ARG  20           HD1      ARG  20  16.344  -9.572  -8.797
  874    HE   ARG  20           HE       ARG  20  17.285  -8.411 -10.624
  875   1HH1  ARG  20          HH21      ARG  20  14.206  -7.909 -11.426
  876   2HH1  ARG  20          HH22      ARG  20  14.316  -8.348 -13.099
  877   1HH2  ARG  20          HH11      ARG  20  17.451  -9.798 -12.789
  878   2HH2  ARG  20          HH12      ARG  20  16.151  -9.418 -13.870
  879    H    GLU  21           HN       GLU  21  17.259 -13.488  -8.560
  880    HA   GLU  21           HA       GLU  21  17.239 -16.266  -7.971
  881   1HB   GLU  21           HB2      GLU  21  19.286 -15.670  -6.547
  882   2HB   GLU  21           HB1      GLU  21  19.358 -15.207  -8.248
  883   1HG   GLU  21           HG2      GLU  21  18.089 -13.124  -6.677
  884   2HG   GLU  21           HG1      GLU  21  19.684 -13.510  -6.029
  885    H    GLY  22           HN       GLY  22  18.366 -14.918  -5.097
  886   1HA   GLY  22           HA2      GLY  22  17.582 -15.331  -2.904
  887   2HA   GLY  22           HA1      GLY  22  16.230 -14.344  -3.463
  888    H    ASP  23           HN       ASP  23  14.269 -15.331  -3.861
  889    HA   ASP  23           HA       ASP  23  13.926 -18.109  -4.432
  890   1HB   ASP  23           HB2      ASP  23  14.548 -17.667  -1.756
  891   2HB   ASP  23           HB1      ASP  23  12.790 -17.784  -1.760
  892    H    LYS  24           HN       LYS  24  12.032 -16.156  -2.135
  893    HA   LYS  24           HA       LYS  24  10.280 -14.720  -3.617
  894   1HB   LYS  24           HB2      LYS  24   8.365 -16.385  -4.069
  895   2HB   LYS  24           HB1      LYS  24   9.735 -16.432  -5.178
  896   1HG   LYS  24           HG2      LYS  24  10.392 -18.502  -4.480
  897   2HG   LYS  24           HG1      LYS  24   9.998 -18.164  -2.794
  898   1HD   LYS  24           HD2      LYS  24   8.539 -19.922  -3.928
  899   2HD   LYS  24           HD1      LYS  24   7.668 -18.594  -3.156
  900   1HE   LYS  24           HE2      LYS  24   6.899 -17.781  -5.138
  901   2HE   LYS  24           HE1      LYS  24   8.423 -18.095  -5.967
  902   1HZ   LYS  24           HZ1      LYS  24   6.961 -20.459  -5.170
  903   2HZ   LYS  24           HZ3      LYS  24   6.179 -19.511  -6.339
  904   3HZ   LYS  24           HZ2      LYS  24   7.743 -20.106  -6.637
  905    H    HIS  25           HN       HIS  25   8.139 -14.384  -2.529
  906    HA   HIS  25           HA       HIS  25   6.820 -14.225  -0.589
  907   1HB   HIS  25           HB2      HIS  25   6.966 -16.796  -0.873
  908   2HB   HIS  25           HB1      HIS  25   8.180 -16.731   0.406
  909    HD1  HIS  25           HD1      HIS  25   4.558 -16.737  -0.152
  910    HD2  HIS  25           HD2      HIS  25   7.126 -15.522   2.899
  911    HE1  HIS  25           HE1      HIS  25   3.125 -16.441   1.915
  912    H    LYS  26           HN       LYS  26   9.979 -13.661  -0.738
  913    HA   LYS  26           HA       LYS  26  10.059 -12.702   2.068
  914   1HB   LYS  26           HB2      LYS  26  12.359 -13.576   2.372
  915   2HB   LYS  26           HB1      LYS  26  11.196 -14.879   2.130
  916   1HG   LYS  26           HG2      LYS  26  11.842 -15.118  -0.189
  917   2HG   LYS  26           HG1      LYS  26  12.861 -13.679  -0.100
  918   1HD   LYS  26           HD2      LYS  26  13.453 -15.766   1.914
  919   2HD   LYS  26           HD1      LYS  26  13.800 -16.213   0.243
  920   1HE   LYS  26           HE2      LYS  26  15.743 -15.083   0.499
  921   2HE   LYS  26           HE1      LYS  26  14.765 -13.617   0.417
  922   1HZ   LYS  26           HZ2      LYS  26  15.397 -15.110   2.905
  923   2HZ   LYS  26           HZ1      LYS  26  16.172 -13.687   2.400
  924   3HZ   LYS  26           HZ3      LYS  26  14.525 -13.656   2.801
  925    H    LEU  27           HN       LEU  27  11.774 -11.071   2.390
  926    HA   LEU  27           HA       LEU  27  12.862  -9.901  -0.118
  927   1HB   LEU  27           HB2      LEU  27  10.680  -8.814   1.443
  928   2HB   LEU  27           HB1      LEU  27  12.060  -7.715   1.483
  929    HG   LEU  27           HG       LEU  27  10.523  -7.295  -0.451
  930   1HD1  LEU  27          HD12      LEU  27  13.072  -6.896  -0.436
  931   2HD1  LEU  27          HD11      LEU  27  13.179  -8.345  -1.436
  932   3HD1  LEU  27          HD13      LEU  27  12.275  -6.941  -2.009
  933   1HD2  LEU  27          HD23      LEU  27  10.210  -9.928  -0.647
  934   2HD2  LEU  27          HD22      LEU  27  10.099  -8.900  -2.076
  935   3HD2  LEU  27          HD21      LEU  27  11.588  -9.784  -1.738
  936    H    LYS  28           HN       LYS  28  13.897  -7.561   1.137
  937    HA   LYS  28           HA       LYS  28  15.469  -8.511   3.452
  938   1HB   LYS  28           HB2      LYS  28  16.492  -8.604   0.794
  939   2HB   LYS  28           HB1      LYS  28  17.321  -7.294   1.636
  940   1HG   LYS  28           HG2      LYS  28  18.115  -8.733   3.337
  941   2HG   LYS  28           HG1      LYS  28  16.964 -10.002   2.916
  942   1HD   LYS  28           HD2      LYS  28  18.970 -10.794   1.981
  943   2HD   LYS  28           HD1      LYS  28  18.177 -10.016   0.611
  944   1HE   LYS  28           HE2      LYS  28  20.148  -8.903   0.390
  945   2HE   LYS  28           HE1      LYS  28  19.531  -7.907   1.708
  946   1HZ   LYS  28           HZ2      LYS  28  20.553  -9.819   3.143
  947   2HZ   LYS  28           HZ1      LYS  28  21.528 -10.051   1.771
  948   3HZ   LYS  28           HZ3      LYS  28  21.527  -8.553   2.565
  949    H    LYS  29           HN       LYS  29  16.778  -6.694   4.384
  950    HA   LYS  29           HA       LYS  29  15.212  -4.249   4.414
  951   1HB   LYS  29           HB2      LYS  29  17.969  -4.730   5.588
  952   2HB   LYS  29           HB1      LYS  29  16.818  -3.477   6.061
  953   1HG   LYS  29           HG2      LYS  29  16.336  -6.462   6.301
  954   2HG   LYS  29           HG1      LYS  29  16.784  -5.395   7.634
  955   1HD   LYS  29           HD2      LYS  29  14.733  -4.012   7.082
  956   2HD   LYS  29           HD1      LYS  29  14.252  -5.299   5.977
  957   1HE   LYS  29           HE2      LYS  29  13.175  -6.067   7.857
  958   2HE   LYS  29           HE1      LYS  29  14.755  -6.788   8.163
  959   1HZ   LYS  29           HZ1      LYS  29  14.275  -4.042   9.069
  960   2HZ   LYS  29           HZ3      LYS  29  13.574  -5.309   9.953
  961   3HZ   LYS  29           HZ2      LYS  29  15.260  -5.250   9.746
  962    H    SER  30           HN       SER  30  18.084  -5.350   2.755
  963    HA   SER  30           HA       SER  30  18.896  -2.657   1.944
  964   1HB   SER  30           HB2      SER  30  19.877  -5.430   1.514
  965   2HB   SER  30           HB1      SER  30  20.232  -4.278   0.230
  966    HG   SER  30           HG       SER  30  20.658  -3.615   2.938
  967    H    GLU  31           HN       GLU  31  17.269  -5.432   0.404
  968    HA   GLU  31           HA       GLU  31  16.942  -4.046  -2.126
  969   1HB   GLU  31           HB2      GLU  31  16.864  -6.622  -1.614
  970   2HB   GLU  31           HB1      GLU  31  15.170  -6.310  -1.230
  971   1HG   GLU  31           HG2      GLU  31  14.615  -6.039  -3.408
  972   2HG   GLU  31           HG1      GLU  31  16.026  -5.029  -3.723
  973    H    LEU  32           HN       LEU  32  15.224  -4.197   0.895
  974    HA   LEU  32           HA       LEU  32  12.716  -3.142  -0.165
  975   1HB   LEU  32           HB2      LEU  32  12.624  -4.446   1.875
  976   2HB   LEU  32           HB1      LEU  32  13.805  -3.394   2.655
  977    HG   LEU  32           HG       LEU  32  12.247  -1.511   2.556
  978   1HD1  LEU  32          HD12      LEU  32  10.445  -3.505   1.151
  979   2HD1  LEU  32          HD11      LEU  32   9.896  -1.947   1.770
  980   3HD1  LEU  32          HD13      LEU  32  11.097  -2.011   0.479
  981   1HD2  LEU  32          HD21      LEU  32  11.692  -4.023   3.940
  982   2HD2  LEU  32          HD23      LEU  32  11.612  -2.369   4.550
  983   3HD2  LEU  32          HD22      LEU  32  10.230  -3.065   3.703
  984    H    LYS  33           HN       LYS  33  15.454  -1.810   1.710
  985    HA   LYS  33           HA       LYS  33  14.517   0.874   1.856
  986   1HB   LYS  33           HB2      LYS  33  16.643  -0.295   2.899
  987   2HB   LYS  33           HB1      LYS  33  17.431   0.264   1.426
  988   1HG   LYS  33           HG2      LYS  33  15.801   2.376   2.557
  989   2HG   LYS  33           HG1      LYS  33  16.947   1.771   3.755
  990   1HD   LYS  33           HD2      LYS  33  18.057   2.139   1.038
  991   2HD   LYS  33           HD1      LYS  33  17.580   3.628   1.861
  992   1HE   LYS  33           HE2      LYS  33  19.207   1.548   3.309
  993   2HE   LYS  33           HE1      LYS  33  19.996   2.709   2.239
  994   1HZ   LYS  33           HZ3      LYS  33  18.966   4.503   3.496
  995   2HZ   LYS  33           HZ2      LYS  33  18.231   3.376   4.535
  996   3HZ   LYS  33           HZ1      LYS  33  19.923   3.529   4.502
  997    H    GLU  34           HN       GLU  34  16.430  -0.818  -0.598
  998    HA   GLU  34           HA       GLU  34  16.681   1.490  -2.327
  999   1HB   GLU  34           HB2      GLU  34  17.983   0.109  -3.620
 1000   2HB   GLU  34           HB1      GLU  34  17.967  -0.881  -2.169
 1001   1HG   GLU  34           HG2      GLU  34  17.261  -2.518  -3.564
 1002   2HG   GLU  34           HG1      GLU  34  15.688  -1.748  -3.407
 1003    H    LEU  35           HN       LEU  35  14.367  -1.096  -1.930
 1004    HA   LEU  35           HA       LEU  35  12.910  -0.853  -4.362
 1005   1HB   LEU  35           HB2      LEU  35  12.643  -2.340  -2.045
 1006   2HB   LEU  35           HB1      LEU  35  11.246  -1.265  -1.971
 1007    HG   LEU  35           HG       LEU  35  10.631  -3.287  -3.185
 1008   1HD1  LEU  35          HD12      LEU  35  11.003  -0.824  -4.906
 1009   2HD1  LEU  35          HD11      LEU  35  10.054  -2.220  -5.417
 1010   3HD1  LEU  35          HD13      LEU  35   9.565  -1.291  -3.999
 1011   1HD2  LEU  35          HD21      LEU  35  13.294  -2.987  -4.232
 1012   2HD2  LEU  35          HD23      LEU  35  12.195  -4.355  -4.409
 1013   3HD2  LEU  35          HD22      LEU  35  12.151  -3.031  -5.574
 1014    H    ILE  36           HN       ILE  36  12.761   1.010  -1.356
 1015    HA   ILE  36           HA       ILE  36  10.475   2.596  -2.249
 1016    HB   ILE  36           HB       ILE  36  12.289   3.510  -0.054
 1017   1HG1  ILE  36          HG12      ILE  36  10.687   0.953  -0.099
 1018   2HG1  ILE  36          HG11      ILE  36  12.310   1.228   0.530
 1019   1HG2  ILE  36          HG22      ILE  36  10.211   4.725  -0.673
 1020   2HG2  ILE  36          HG21      ILE  36   9.277   3.270  -0.327
 1021   3HG2  ILE  36          HG23      ILE  36  10.141   4.093   0.972
 1022   1HD1  ILE  36          HD13      ILE  36  11.024   2.893   2.161
 1023   2HD1  ILE  36          HD12      ILE  36   9.663   1.833   1.790
 1024   3HD1  ILE  36          HD11      ILE  36  11.126   1.168   2.519
 1025    H    ASN  37           HN       ASN  37  13.892   3.423  -1.548
 1026    HA   ASN  37           HA       ASN  37  13.707   6.038  -2.694
 1027   1HB   ASN  37           HB2      ASN  37  15.478   5.368  -1.099
 1028   2HB   ASN  37           HB1      ASN  37  16.163   4.299  -2.324
 1029   1HD2  ASN  37          HD22      ASN  37  17.526   7.959  -2.337
 1030   2HD2  ASN  37          HD21      ASN  37  17.008   7.059  -0.994
 1031    H    ASN  38           HN       ASN  38  15.496   3.215  -4.007
 1032    HA   ASN  38           HA       ASN  38  16.062   4.275  -6.521
 1033   1HB   ASN  38           HB2      ASN  38  16.901   2.086  -5.753
 1034   2HB   ASN  38           HB1      ASN  38  15.284   1.406  -5.935
 1035   1HD2  ASN  38          HD22      ASN  38  16.433   2.708  -9.586
 1036   2HD2  ASN  38          HD21      ASN  38  16.099   3.791  -8.324
 1037    H    GLU  39           HN       GLU  39  13.172   2.268  -5.791
 1038    HA   GLU  39           HA       GLU  39  12.003   2.766  -8.378
 1039   1HB   GLU  39           HB2      GLU  39  10.566   1.898  -5.859
 1040   2HB   GLU  39           HB1      GLU  39  10.051   1.640  -7.525
 1041   1HG   GLU  39           HG2      GLU  39  12.501   0.456  -6.189
 1042   2HG   GLU  39           HG1      GLU  39  11.058  -0.415  -6.713
 1043    H    LEU  40           HN       LEU  40  10.444   3.695  -5.286
 1044    HA   LEU  40           HA       LEU  40   8.889   5.734  -6.499
 1045   1HB   LEU  40           HB2      LEU  40   9.736   5.400  -3.607
 1046   2HB   LEU  40           HB1      LEU  40   8.468   6.484  -4.166
 1047    HG   LEU  40           HG       LEU  40   8.499   3.473  -4.154
 1048   1HD1  LEU  40          HD13      LEU  40   7.490   4.878  -2.292
 1049   2HD1  LEU  40          HD12      LEU  40   6.309   5.452  -3.470
 1050   3HD1  LEU  40          HD11      LEU  40   6.379   3.740  -3.055
 1051   1HD2  LEU  40          HD22      LEU  40   6.998   5.316  -6.013
 1052   2HD2  LEU  40          HD21      LEU  40   7.833   3.808  -6.392
 1053   3HD2  LEU  40          HD23      LEU  40   6.298   3.772  -5.522
 1054    H    SER  41           HN       SER  41  10.766   6.935  -3.832
 1055    HA   SER  41           HA       SER  41  11.928   8.997  -3.709
 1056   1HB   SER  41           HB2      SER  41  13.785   7.559  -4.199
 1057   2HB   SER  41           HB1      SER  41  13.336   7.457  -5.901
 1058    HG   SER  41           HG       SER  41  14.758   9.368  -4.563
 1059    H    HIS  42           HN       HIS  42   9.552   9.265  -5.254
 1060    HA   HIS  42           HA       HIS  42  10.473  11.056  -7.467
 1061   1HB   HIS  42           HB2      HIS  42   8.662   8.962  -7.570
 1062   2HB   HIS  42           HB1      HIS  42   7.620  10.379  -7.425
 1063    HD1  HIS  42           HD1      HIS  42  10.487   9.082  -9.566
 1064    HD2  HIS  42           HD2      HIS  42   7.394  11.873  -9.761
 1065    HE1  HIS  42           HE1      HIS  42  10.483   9.983 -11.933
 1066    H    PHE  43           HN       PHE  43   8.764  10.883  -4.458
 1067    HA   PHE  43           HA       PHE  43   8.138  13.795  -4.721
 1068   1HB   PHE  43           HB2      PHE  43   6.221  13.102  -3.011
 1069   2HB   PHE  43           HB1      PHE  43   5.972  12.966  -4.752
 1070    HD1  PHE  43           HD2      PHE  43   7.830  10.888  -2.233
 1071    HD2  PHE  43           HD1      PHE  43   4.791  11.024  -5.268
 1072    HE1  PHE  43           HE2      PHE  43   7.483   8.444  -1.994
 1073    HE2  PHE  43           HE1      PHE  43   4.446   8.579  -5.031
 1074    HZ   PHE  43           HZ       PHE  43   5.791   7.289  -3.393
 1075    H    LEU  44           HN       LEU  44  10.463  12.392  -3.536
 1076    HA   LEU  44           HA       LEU  44  10.040  12.996  -0.644
 1077   1HB   LEU  44           HB2      LEU  44  11.042  10.740  -1.578
 1078   2HB   LEU  44           HB1      LEU  44  12.523  11.689  -1.716
 1079    HG   LEU  44           HG       LEU  44  12.366  10.525   0.475
 1080   1HD1  LEU  44          HD13      LEU  44  13.528  12.744   0.201
 1081   2HD1  LEU  44          HD12      LEU  44  12.048  13.528   0.758
 1082   3HD1  LEU  44          HD11      LEU  44  12.934  12.447   1.834
 1083   1HD2  LEU  44          HD21      LEU  44   9.764  10.848   0.437
 1084   2HD2  LEU  44          HD23      LEU  44  10.609  10.904   1.984
 1085   3HD2  LEU  44          HD22      LEU  44  10.122  12.402   1.190
 1086    H    GLU  45           HN       GLU  45  10.691  15.010  -0.065
 1087    HA   GLU  45           HA       GLU  45  13.267  16.013  -1.136
 1088   1HB   GLU  45           HB2      GLU  45  11.864  18.335  -1.157
 1089   2HB   GLU  45           HB1      GLU  45  12.083  17.326  -2.586
 1090   1HG   GLU  45           HG2      GLU  45   9.932  16.372  -2.390
 1091   2HG   GLU  45           HG1      GLU  45   9.768  16.867  -0.706
 1092    H    GLU  46           HN       GLU  46  10.552  17.056   0.946
 1093    HA   GLU  46           HA       GLU  46  12.587  17.860   2.978
 1094   1HB   GLU  46           HB2      GLU  46   9.868  18.902   2.253
 1095   2HB   GLU  46           HB1      GLU  46  10.444  19.098   3.909
 1096   1HG   GLU  46           HG2      GLU  46  12.520  20.159   3.027
 1097   2HG   GLU  46           HG1      GLU  46  11.857  20.040   1.397
 1098    H    ILE  47           HN       ILE  47   9.885  15.773   2.335
 1099    HA   ILE  47           HA       ILE  47   8.947  14.048   3.620
 1100    HB   ILE  47           HB       ILE  47  11.386  14.567   5.351
 1101   1HG1  ILE  47          HG12      ILE  47  10.962  12.340   3.351
 1102   2HG1  ILE  47          HG11      ILE  47  11.677  13.882   2.878
 1103   1HG2  ILE  47          HG23      ILE  47   9.473  13.333   6.451
 1104   2HG2  ILE  47          HG22      ILE  47   9.636  12.098   5.200
 1105   3HG2  ILE  47          HG21      ILE  47  10.965  12.399   6.320
 1106   1HD1  ILE  47          HD11      ILE  47  12.749  12.366   5.251
 1107   2HD1  ILE  47          HD13      ILE  47  13.268  11.954   3.617
 1108   3HD1  ILE  47          HD12      ILE  47  13.559  13.573   4.254
 1109    H    LYS  48           HN       LYS  48   7.317  14.043   5.143
 1110    HA   LYS  48           HA       LYS  48   7.203  16.407   6.970
 1111   1HB   LYS  48           HB2      LYS  48   5.367  15.876   5.143
 1112   2HB   LYS  48           HB1      LYS  48   4.805  14.716   6.346
 1113   1HG   LYS  48           HG2      LYS  48   4.715  16.535   8.033
 1114   2HG   LYS  48           HG1      LYS  48   5.212  17.687   6.795
 1115   1HD   LYS  48           HD2      LYS  48   3.177  17.606   5.702
 1116   2HD   LYS  48           HD1      LYS  48   2.854  15.948   6.210
 1117   1HE   LYS  48           HE2      LYS  48   2.974  18.107   8.289
 1118   2HE   LYS  48           HE1      LYS  48   1.520  17.950   7.304
 1119   1HZ   LYS  48           HZ3      LYS  48   2.570  15.471   8.374
 1120   2HZ   LYS  48           HZ2      LYS  48   1.968  16.556   9.534
 1121   3HZ   LYS  48           HZ1      LYS  48   0.967  16.019   8.270
 1122    H    GLU  49           HN       GLU  49   5.796  13.111   6.917
 1123    HA   GLU  49           HA       GLU  49   5.807  12.895   9.789
 1124   1HB   GLU  49           HB2      GLU  49   5.272  11.077   7.489
 1125   2HB   GLU  49           HB1      GLU  49   5.704  10.312   9.020
 1126   1HG   GLU  49           HG2      GLU  49   3.581  12.458   8.839
 1127   2HG   GLU  49           HG1      GLU  49   3.206  10.746   8.635
 1128    H    GLN  50           HN       GLN  50   8.007  13.462  10.358
 1129    HA   GLN  50           HA       GLN  50  10.306  12.106   9.334
 1130   1HB   GLN  50           HB2      GLN  50  10.407  14.234  10.624
 1131   2HB   GLN  50           HB1      GLN  50   9.928  13.352  12.076
 1132   1HG   GLN  50           HG2      GLN  50  11.954  12.211  12.219
 1133   2HG   GLN  50           HG1      GLN  50  12.289  12.385  10.496
 1134   1HE2  GLN  50          HE22      GLN  50  13.193  15.494  13.032
 1135   2HE2  GLN  50          HE21      GLN  50  12.087  14.305  13.531
 1136    H    GLU  51           HN       GLU  51   7.915  11.212  11.708
 1137    HA   GLU  51           HA       GLU  51   9.553   9.095  12.889
 1138   1HB   GLU  51           HB2      GLU  51   6.747  10.082  13.202
 1139   2HB   GLU  51           HB1      GLU  51   7.109   8.434  13.720
 1140   1HG   GLU  51           HG2      GLU  51   7.707   9.479  15.667
 1141   2HG   GLU  51           HG1      GLU  51   9.225   9.734  14.805
 1142    H    VAL  52           HN       VAL  52   7.099   9.347  10.357
 1143    HA   VAL  52           HA       VAL  52   6.739   6.486  10.067
 1144    HB   VAL  52           HB       VAL  52   6.214   8.726   8.088
 1145   1HG1  VAL  52          HG11      VAL  52   6.189   5.919   7.756
 1146   2HG1  VAL  52          HG13      VAL  52   4.500   6.410   7.889
 1147   3HG1  VAL  52          HG12      VAL  52   5.532   7.131   6.655
 1148   1HG2  VAL  52          HG21      VAL  52   5.037   8.362  10.537
 1149   2HG2  VAL  52          HG23      VAL  52   4.238   9.110   9.154
 1150   3HG2  VAL  52          HG22      VAL  52   3.987   7.399   9.499
 1151    H    VAL  53           HN       VAL  53   8.640   8.912   8.252
 1152    HA   VAL  53           HA       VAL  53   9.819   6.880   6.535
 1153    HB   VAL  53           HB       VAL  53  10.698   9.734   7.077
 1154   1HG1  VAL  53          HG11      VAL  53  11.966   7.610   5.674
 1155   2HG1  VAL  53          HG13      VAL  53  11.333   8.722   4.460
 1156   3HG1  VAL  53          HG12      VAL  53  12.434   9.310   5.707
 1157   1HG2  VAL  53          HG21      VAL  53   8.652   8.482   5.297
 1158   2HG2  VAL  53          HG23      VAL  53   8.633  10.057   6.092
 1159   3HG2  VAL  53          HG22      VAL  53   9.597   9.815   4.633
 1160    H    ASP  54           HN       ASP  54  10.584   8.304   9.621
 1161    HA   ASP  54           HA       ASP  54  13.349   7.355   9.625
 1162   1HB   ASP  54           HB2      ASP  54  12.682   9.364  10.914
 1163   2HB   ASP  54           HB1      ASP  54  11.621   8.364  11.907
 1164    H    LYS  55           HN       LYS  55  10.206   6.104  10.550
 1165    HA   LYS  55           HA       LYS  55  11.320   4.025  12.274
 1166   1HB   LYS  55           HB2      LYS  55   9.032   3.076  12.233
 1167   2HB   LYS  55           HB1      LYS  55   9.010   4.797  12.620
 1168   1HG   LYS  55           HG2      LYS  55   8.262   5.384  10.442
 1169   2HG   LYS  55           HG1      LYS  55   8.658   3.795   9.791
 1170   1HD   LYS  55           HD2      LYS  55   6.183   4.223  10.249
 1171   2HD   LYS  55           HD1      LYS  55   6.859   2.754  10.955
 1172   1HE   LYS  55           HE2      LYS  55   7.155   5.084  12.705
 1173   2HE   LYS  55           HE1      LYS  55   5.469   4.717  12.342
 1174   1HZ   LYS  55           HZ2      LYS  55   6.803   2.307  12.819
 1175   2HZ   LYS  55           HZ1      LYS  55   7.200   3.370  14.084
 1176   3HZ   LYS  55           HZ3      LYS  55   5.574   3.027  13.746
 1177    H    VAL  56           HN       VAL  56  10.223   4.228   8.893
 1178    HA   VAL  56           HA       VAL  56  10.803   1.391   8.433
 1179    HB   VAL  56           HB       VAL  56  10.480   2.161   5.984
 1180   1HG1  VAL  56          HG13      VAL  56   8.266   2.508   8.027
 1181   2HG1  VAL  56          HG12      VAL  56   8.012   2.292   6.295
 1182   3HG1  VAL  56          HG11      VAL  56   8.736   0.997   7.247
 1183   1HG2  VAL  56          HG22      VAL  56  10.693   4.673   7.149
 1184   2HG2  VAL  56          HG21      VAL  56  10.075   4.339   5.535
 1185   3HG2  VAL  56          HG23      VAL  56   8.959   4.489   6.892
 1186    H    MET  57           HN       MET  57  12.339   4.498   7.927
 1187    HA   MET  57           HA       MET  57  14.571   3.450   6.382
 1188   1HB   MET  57           HB2      MET  57  13.780   5.841   6.305
 1189   2HB   MET  57           HB1      MET  57  14.369   6.042   7.955
 1190   1HG   MET  57           HG2      MET  57  16.505   6.244   7.269
 1191   2HG   MET  57           HG1      MET  57  16.374   4.839   6.210
 1192   1HE   MET  57           HE3      MET  57  15.161   4.732   4.188
 1193   2HE   MET  57           HE2      MET  57  13.836   5.892   4.127
 1194   3HE   MET  57           HE1      MET  57  15.132   5.982   2.936
 1195    H    GLU  58           HN       GLU  58  13.789   3.828   9.771
 1196    HA   GLU  58           HA       GLU  58  16.563   3.462  10.660
 1197   1HB   GLU  58           HB2      GLU  58  13.889   3.588  12.049
 1198   2HB   GLU  58           HB1      GLU  58  15.311   3.005  12.911
 1199   1HG   GLU  58           HG2      GLU  58  16.505   5.087  12.422
 1200   2HG   GLU  58           HG1      GLU  58  15.132   5.677  11.485
 1201    H    THR  59           HN       THR  59  13.577   1.472  10.661
 1202    HA   THR  59           HA       THR  59  14.875  -0.917  11.600
 1203    HB   THR  59           HB       THR  59  12.525  -0.949   9.706
 1204    HG1  THR  59           HG1      THR  59  11.374  -0.686  11.855
 1205   1HG2  THR  59          HG22      THR  59  13.806  -2.932  11.052
 1206   2HG2  THR  59          HG21      THR  59  12.584  -2.478  12.240
 1207   3HG2  THR  59          HG23      THR  59  12.096  -2.991  10.626
 1208    H    LEU  60           HN       LEU  60  14.551   0.631   8.499
 1209    HA   LEU  60           HA       LEU  60  15.371  -1.573   6.845
 1210   1HB   LEU  60           HB2      LEU  60  15.079   1.381   6.576
 1211   2HB   LEU  60           HB1      LEU  60  16.140   0.590   5.415
 1212    HG   LEU  60           HG       LEU  60  13.322  -0.338   6.017
 1213   1HD1  LEU  60          HD13      LEU  60  14.399   1.699   4.113
 1214   2HD1  LEU  60          HD12      LEU  60  13.115   0.635   3.536
 1215   3HD1  LEU  60          HD11      LEU  60  12.846   1.656   4.950
 1216   1HD2  LEU  60          HD21      LEU  60  15.188  -1.876   5.009
 1217   2HD2  LEU  60          HD23      LEU  60  13.606  -1.836   4.229
 1218   3HD2  LEU  60          HD22      LEU  60  14.948  -0.918   3.548
 1219    H    ASP  61           HN       ASP  61  17.182   1.291   7.995
 1220    HA   ASP  61           HA       ASP  61  19.739   0.080   7.250
 1221   1HB   ASP  61           HB2      ASP  61  18.847   2.676   7.657
 1222   2HB   ASP  61           HB1      ASP  61  19.848   2.371   9.078
 1223    H    GLU  62           HN       GLU  62  17.668  -0.488   9.768
 1224    HA   GLU  62           HA       GLU  62  19.627  -0.601  11.937
 1225   1HB   GLU  62           HB2      GLU  62  17.290  -0.194  12.493
 1226   2HB   GLU  62           HB1      GLU  62  16.809  -1.695  11.699
 1227   1HG   GLU  62           HG2      GLU  62  17.957  -3.029  13.333
 1228   2HG   GLU  62           HG1      GLU  62  18.756  -1.611  14.016
 1229    H    ASP  63           HN       ASP  63  18.140  -2.884   9.686
 1230    HA   ASP  63           HA       ASP  63  19.877  -5.036  10.807
 1231   1HB   ASP  63           HB2      ASP  63  17.166  -4.996   9.902
 1232   2HB   ASP  63           HB1      ASP  63  18.091  -6.034   8.813
 1233    H    GLY  64           HN       GLY  64  18.573  -4.274   7.574
 1234   1HA   GLY  64           HA2      GLY  64  19.803  -3.846   5.579
 1235   2HA   GLY  64           HA1      GLY  64  21.299  -4.115   6.477
 1236    H    ASP  65           HN       ASP  65  21.144  -6.604   7.452
 1237    HA   ASP  65           HA       ASP  65  20.926  -8.263   4.991
 1238   1HB   ASP  65           HB2      ASP  65  23.074  -8.171   6.370
 1239   2HB   ASP  65           HB1      ASP  65  22.197  -9.055   7.621
 1240    H    GLY  66           HN       GLY  66  18.667  -7.430   6.870
 1241   1HA   GLY  66           HA2      GLY  66  17.851 -10.068   7.938
 1242   2HA   GLY  66           HA1      GLY  66  17.041  -8.536   8.265
 1243    H    GLU  67           HN       GLU  67  15.618 -10.830   7.430
 1244    HA   GLU  67           HA       GLU  67  14.968 -10.246   4.578
 1245   1HB   GLU  67           HB2      GLU  67  13.663 -12.416   4.754
 1246   2HB   GLU  67           HB1      GLU  67  15.410 -12.582   4.945
 1247   1HG   GLU  67           HG2      GLU  67  15.246 -12.827   7.294
 1248   2HG   GLU  67           HG1      GLU  67  13.595 -12.205   7.328
 1249    H    CYS  68           HN       CYS  68  12.795  -9.765   3.990
 1250    HA   CYS  68           HA       CYS  68  11.040  -9.004   6.298
 1251   1HB   CYS  68           HB2      CYS  68  10.812  -7.749   3.572
 1252   2HB   CYS  68           HB1      CYS  68  10.328  -7.096   5.137
 1253    HG   CYS  68           HG       CYS  68  12.520  -5.915   4.965
 1254    H    ASP  69           HN       ASP  69   8.640  -8.869   5.504
 1255    HA   ASP  69           HA       ASP  69   8.100 -11.365   3.947
 1256   1HB   ASP  69           HB2      ASP  69   6.561  -9.937   6.124
 1257   2HB   ASP  69           HB1      ASP  69   5.801 -11.148   5.090
 1258    H    PHE  70           HN       PHE  70   5.637 -11.090   3.013
 1259    HA   PHE  70           HA       PHE  70   5.899  -8.917   1.074
 1260   1HB   PHE  70           HB2      PHE  70   3.746  -9.842   0.155
 1261   2HB   PHE  70           HB1      PHE  70   5.048 -11.026   0.252
 1262    HD1  PHE  70           HD1      PHE  70   5.014 -12.810   1.946
 1263    HD2  PHE  70           HD2      PHE  70   1.806  -9.969   1.619
 1264    HE1  PHE  70           HE1      PHE  70   3.576 -14.271   3.342
 1265    HE2  PHE  70           HE2      PHE  70   0.370 -11.431   3.016
 1266    HZ   PHE  70           HZ       PHE  70   1.256 -13.582   3.875
 1267    H    GLN  71           HN       GLN  71   3.940  -9.601   3.927
 1268    HA   GLN  71           HA       GLN  71   2.193  -7.287   3.486
 1269   1HB   GLN  71           HB2      GLN  71   2.654  -9.004   5.951
 1270   2HB   GLN  71           HB1      GLN  71   1.400  -7.773   5.798
 1271   1HG   GLN  71           HG2      GLN  71   1.070  -9.319   3.511
 1272   2HG   GLN  71           HG1      GLN  71   1.454 -10.505   4.760
 1273   1HE2  GLN  71          HE22      GLN  71  -1.745  -8.102   5.705
 1274   2HE2  GLN  71          HE21      GLN  71  -0.308  -7.393   5.145
 1275    H    GLU  72           HN       GLU  72   5.264  -7.943   4.969
 1276    HA   GLU  72           HA       GLU  72   5.305  -5.543   6.622
 1277   1HB   GLU  72           HB2      GLU  72   7.238  -7.698   5.859
 1278   2HB   GLU  72           HB1      GLU  72   7.902  -6.175   6.450
 1279   1HG   GLU  72           HG2      GLU  72   5.825  -6.692   8.217
 1280   2HG   GLU  72           HG1      GLU  72   6.512  -8.290   7.917
 1281    H    PHE  73           HN       PHE  73   7.016  -6.515   3.625
 1282    HA   PHE  73           HA       PHE  73   8.085  -3.908   3.103
 1283   1HB   PHE  73           HB2      PHE  73   9.137  -5.082   1.478
 1284   2HB   PHE  73           HB1      PHE  73   8.160  -6.483   1.886
 1285    HD1  PHE  73           HD1      PHE  73   5.910  -6.791   0.740
 1286    HD2  PHE  73           HD2      PHE  73   8.790  -3.871  -0.541
 1287    HE1  PHE  73           HE1      PHE  73   4.753  -6.609  -1.447
 1288    HE2  PHE  73           HE2      PHE  73   7.634  -3.691  -2.728
 1289    HZ   PHE  73           HZ       PHE  73   5.615  -5.059  -3.180
 1290    H    MET  74           HN       MET  74   4.972  -5.356   2.599
 1291    HA   MET  74           HA       MET  74   4.003  -3.472   0.636
 1292   1HB   MET  74           HB2      MET  74   2.888  -5.636   2.323
 1293   2HB   MET  74           HB1      MET  74   1.745  -4.369   1.890
 1294   1HG   MET  74           HG2      MET  74   3.431  -6.009  -0.028
 1295   2HG   MET  74           HG1      MET  74   1.687  -6.128   0.194
 1296   1HE   MET  74           HE2      MET  74   0.581  -3.607   0.568
 1297   2HE   MET  74           HE1      MET  74   1.938  -2.488   0.668
 1298   3HE   MET  74           HE3      MET  74   0.761  -2.341  -0.645
 1299    H    ALA  75           HN       ALA  75   3.474  -3.758   4.169
 1300    HA   ALA  75           HA       ALA  75   2.055  -1.252   4.357
 1301   1HB   ALA  75           HB1      ALA  75   1.936  -3.078   6.074
 1302   2HB   ALA  75           HB3      ALA  75   3.596  -2.699   6.534
 1303   3HB   ALA  75           HB2      ALA  75   2.322  -1.502   6.766
 1304    H    PHE  76           HN       PHE  76   5.395  -2.104   4.145
 1305    HA   PHE  76           HA       PHE  76   6.458   0.306   5.377
 1306   1HB   PHE  76           HB2      PHE  76   7.498  -2.095   4.066
 1307   2HB   PHE  76           HB1      PHE  76   8.397  -0.647   3.619
 1308    HD1  PHE  76           HD2      PHE  76   6.777  -1.991   6.736
 1309    HD2  PHE  76           HD1      PHE  76  10.259  -0.225   4.944
 1310    HE1  PHE  76           HE2      PHE  76   7.929  -2.031   8.933
 1311    HE2  PHE  76           HE1      PHE  76  11.411  -0.264   7.141
 1312    HZ   PHE  76           HZ       PHE  76  10.246  -1.168   9.135
 1313    H    VAL  77           HN       VAL  77   5.585  -0.696   2.105
 1314    HA   VAL  77           HA       VAL  77   6.712   1.635   0.797
 1315    HB   VAL  77           HB       VAL  77   4.567  -0.315  -0.099
 1316   1HG1  VAL  77          HG12      VAL  77   5.765   2.086  -1.328
 1317   2HG1  VAL  77          HG11      VAL  77   5.789   0.651  -2.355
 1318   3HG1  VAL  77          HG13      VAL  77   4.259   1.253  -1.716
 1319   1HG2  VAL  77          HG21      VAL  77   7.342  -0.655   0.315
 1320   2HG2  VAL  77          HG23      VAL  77   6.251  -1.748  -0.537
 1321   3HG2  VAL  77          HG22      VAL  77   7.129  -0.506  -1.430
 1322    H    SER  78           HN       SER  78   3.687   0.926   2.399
 1323    HA   SER  78           HA       SER  78   2.248   3.169   1.213
 1324   1HB   SER  78           HB2      SER  78   1.622   1.524   3.680
 1325   2HB   SER  78           HB1      SER  78   0.512   2.631   2.875
 1326    HG   SER  78           HG       SER  78   1.170   0.076   2.258
 1327    H    MET  79           HN       MET  79   3.895   2.595   4.329
 1328    HA   MET  79           HA       MET  79   3.139   5.051   5.556
 1329   1HB   MET  79           HB2      MET  79   5.835   3.802   6.030
 1330   2HB   MET  79           HB1      MET  79   4.740   4.556   7.187
 1331   1HG   MET  79           HG2      MET  79   3.282   2.423   6.080
 1332   2HG   MET  79           HG1      MET  79   4.898   1.782   6.376
 1333   1HE   MET  79           HE1      MET  79   5.699   0.980   8.145
 1334   2HE   MET  79           HE3      MET  79   5.100   0.981   9.809
 1335   3HE   MET  79           HE2      MET  79   4.229   0.100   8.557
 1336    H    VAL  80           HN       VAL  80   5.945   4.256   3.503
 1337    HA   VAL  80           HA       VAL  80   7.012   6.962   3.710
 1338    HB   VAL  80           HB       VAL  80   8.500   6.088   1.795
 1339   1HG1  VAL  80          HG12      VAL  80   9.181   6.204   4.169
 1340   2HG1  VAL  80          HG11      VAL  80   8.434   4.632   4.454
 1341   3HG1  VAL  80          HG13      VAL  80   9.835   4.763   3.390
 1342   1HG2  VAL  80          HG22      VAL  80   6.561   4.056   1.803
 1343   2HG2  VAL  80          HG21      VAL  80   8.091   4.044   0.933
 1344   3HG2  VAL  80          HG23      VAL  80   7.990   3.330   2.540
 1345    H    THR  81           HN       THR  81   5.151   5.152   1.264
 1346    HA   THR  81           HA       THR  81   5.324   7.198  -0.751
 1347    HB   THR  81           HB       THR  81   3.117   5.154  -0.360
 1348    HG1  THR  81           HG1      THR  81   5.737   5.001  -1.246
 1349   1HG2  THR  81          HG22      THR  81   3.339   7.267  -2.172
 1350   2HG2  THR  81          HG21      THR  81   3.901   5.862  -3.077
 1351   3HG2  THR  81          HG23      THR  81   2.297   5.854  -2.344
 1352    H    THR  82           HN       THR  82   3.797   7.245   2.244
 1353    HA   THR  82           HA       THR  82   1.774   9.223   1.278
 1354    HB   THR  82           HB       THR  82   0.846   8.817   3.683
 1355    HG1  THR  82           HG1      THR  82   1.388   6.508   4.175
 1356   1HG2  THR  82          HG21      THR  82   0.145   7.879   1.262
 1357   2HG2  THR  82          HG23      THR  82   0.561   6.352   2.041
 1358   3HG2  THR  82          HG22      THR  82  -0.683   7.390   2.740
 1359    H    ALA  83           HN       ALA  83   4.543   8.733   3.366
 1360    HA   ALA  83           HA       ALA  83   4.326  10.960   5.081
 1361   1HB   ALA  83           HB3      ALA  83   6.668   9.514   3.863
 1362   2HB   ALA  83           HB2      ALA  83   6.937  10.970   4.822
 1363   3HB   ALA  83           HB1      ALA  83   6.150   9.569   5.549
 1364    H    CYS  84           HN       CYS  84   6.852  11.267   2.666
 1365    HA   CYS  84           HA       CYS  84   7.478  13.186   1.443
 1366   1HB   CYS  84           HB2      CYS  84   4.563  13.394   0.707
 1367   2HB   CYS  84           HB1      CYS  84   5.981  13.667  -0.306
 1368    HG   CYS  84           HG       CYS  84   5.113  10.809   0.638
 1369    H    HIS  85           HN       HIS  85   6.216  15.542   0.824
 1370    HA   HIS  85           HA       HIS  85   5.383  16.657   3.469
 1371   1HB   HIS  85           HB2      HIS  85   7.818  17.147   2.710
 1372   2HB   HIS  85           HB1      HIS  85   7.073  18.209   1.515
 1373    HD1  HIS  85           HD1      HIS  85   4.972  18.188   4.436
 1374    HD2  HIS  85           HD2      HIS  85   8.472  20.185   3.364
 1375    HE1  HIS  85           HE1      HIS  85   5.176  20.168   6.003
 1376    H    GLU  86           HN       GLU  86   5.459  17.196  -0.055
 1377    HA   GLU  86           HA       GLU  86   3.165  19.051   0.160
 1378   1HB   GLU  86           HB2      GLU  86   5.045  18.212  -2.027
 1379   2HB   GLU  86           HB1      GLU  86   3.486  18.915  -2.460
 1380   1HG   GLU  86           HG2      GLU  86   3.964  20.917  -1.181
 1381   2HG   GLU  86           HG1      GLU  86   5.449  20.204  -0.545
 1382    H    PHE  87           HN       PHE  87   2.785  16.257   0.918
 1383    HA   PHE  87           HA       PHE  87   1.046  14.689   0.645
 1384   1HB   PHE  87           HB2      PHE  87  -0.073  16.904  -0.360
 1385   2HB   PHE  87           HB1      PHE  87   0.086  16.000  -1.865
 1386    HD1  PHE  87           HD2      PHE  87  -0.088  13.283  -0.077
 1387    HD2  PHE  87           HD1      PHE  87  -2.576  16.733  -0.697
 1388    HE1  PHE  87           HE2      PHE  87  -2.090  11.948   0.526
 1389    HE2  PHE  87           HE1      PHE  87  -4.578  15.397  -0.094
 1390    HZ   PHE  87           HZ       PHE  87  -4.334  13.006   0.519
 1391    H    PHE  88           HN       PHE  88   0.058  14.004  -2.123
 1392    HA   PHE  88           HA       PHE  88   2.049  12.035  -2.754
 1393   1HB   PHE  88           HB2      PHE  88  -0.190  13.060  -4.522
 1394   2HB   PHE  88           HB1      PHE  88   0.664  11.525  -4.693
 1395    HD1  PHE  88           HD1      PHE  88   0.900  10.797  -1.774
 1396    HD2  PHE  88           HD2      PHE  88  -2.406  12.312  -4.065
 1397    HE1  PHE  88           HE1      PHE  88  -0.686   9.737  -0.188
 1398    HE2  PHE  88           HE2      PHE  88  -3.990  11.254  -2.478
 1399    HZ   PHE  88           HZ       PHE  88  -3.131   9.967  -0.540
 1400    H    GLU  89           HN       GLU  89   0.899  14.426  -5.126
 1401    HA   GLU  89           HA       GLU  89   3.743  14.759  -5.973
 1402   1HB   GLU  89           HB2      GLU  89   1.771  13.904  -7.545
 1403   2HB   GLU  89           HB1      GLU  89   1.469  15.634  -7.707
 1404   1HG   GLU  89           HG2      GLU  89   2.999  14.945  -9.468
 1405   2HG   GLU  89           HG1      GLU  89   3.883  15.942  -8.312
 1406    H    HIS  90           HN       HIS  90   0.823  16.771  -6.375
 1407    HA   HIS  90           HA       HIS  90   2.045  18.912  -4.766
 1408   1HB   HIS  90           HB2      HIS  90   2.164  20.543  -6.510
 1409   2HB   HIS  90           HB1      HIS  90   2.963  19.105  -7.147
 1410    HD1  HIS  90           HD1      HIS  90   1.644  17.689  -8.920
 1411    HD2  HIS  90           HD2      HIS  90  -0.240  21.246  -7.826
 1412    HE1  HIS  90           HE1      HIS  90  -0.176  18.091 -10.634
 1413    H    GLU  91           HN       GLU  91  -0.603  17.874  -6.878
 1414    HA   GLU  91           HA       GLU  91  -2.503  19.132  -4.976
 1415   1HB   GLU  91           HB2      GLU  91  -2.024  20.708  -6.933
 1416   2HB   GLU  91           HB1      GLU  91  -2.811  19.508  -7.962
 1417   1HG   GLU  91           HG2      GLU  91  -4.643  19.709  -5.965
 1418   2HG   GLU  91           HG1      GLU  91  -3.994  21.351  -5.963
   
  No H/Q in entry =        1418
  Start of MODEL   15
    1   1H    MET   0           HT3      MET   0  10.294   5.532 -13.943
    2   2H    MET   0           HT2      MET   0   9.059   6.523 -14.559
    3   3H    MET   0           HT1      MET   0   8.766   5.539 -13.206
    4    HA   MET   0           HA       MET   0   7.761   4.558 -15.150
    5   1HB   MET   0           HB2      MET   0   9.290   3.786 -16.981
    6   2HB   MET   0           HB1      MET   0   9.198   5.542 -16.853
    7   1HG   MET   0           HG2      MET   0  11.370   5.736 -16.195
    8   2HG   MET   0           HG1      MET   0  11.293   4.291 -15.190
    9   1HE   MET   0           HE3      MET   0  13.470   4.188 -15.710
   10   2HE   MET   0           HE2      MET   0  13.825   2.683 -16.554
   11   3HE   MET   0           HE1      MET   0  14.229   4.224 -17.307
   12    H    SER   1           HN       SER   1   8.115   3.538 -12.756
   13    HA   SER   1           HA       SER   1   9.520   0.948 -13.247
   14   1HB   SER   1           HB2      SER   1  10.406   0.924 -11.051
   15   2HB   SER   1           HB1      SER   1  10.695   2.565 -11.618
   16    HG   SER   1           HG       SER   1   8.630   3.072 -10.583
   17    H    GLU   2           HN       GLU   2   8.725  -0.578 -11.252
   18    HA   GLU   2           HA       GLU   2   5.845  -0.850 -11.681
   19   1HB   GLU   2           HB2      GLU   2   7.528  -2.453  -9.754
   20   2HB   GLU   2           HB1      GLU   2   6.062  -2.955 -10.594
   21   1HG   GLU   2           HG2      GLU   2   8.760  -2.385 -11.857
   22   2HG   GLU   2           HG1      GLU   2   8.001  -3.968 -11.675
   23    H    LEU   3           HN       LEU   3   7.982  -0.069  -8.948
   24    HA   LEU   3           HA       LEU   3   5.872   0.077  -6.991
   25   1HB   LEU   3           HB2      LEU   3   8.548   0.002  -6.809
   26   2HB   LEU   3           HB1      LEU   3   8.317   1.741  -6.661
   27    HG   LEU   3           HG       LEU   3   6.625   1.310  -4.861
   28   1HD1  LEU   3          HD11      LEU   3   7.457  -1.504  -5.487
   29   2HD1  LEU   3          HD13      LEU   3   7.005  -1.090  -3.834
   30   3HD1  LEU   3          HD12      LEU   3   5.849  -0.867  -5.146
   31   1HD2  LEU   3          HD22      LEU   3   9.490   1.043  -4.761
   32   2HD2  LEU   3          HD21      LEU   3   8.407   1.716  -3.542
   33   3HD2  LEU   3          HD23      LEU   3   8.772  -0.008  -3.541
   34    H    GLU   4           HN       GLU   4   7.435   2.529  -9.046
   35    HA   GLU   4           HA       GLU   4   6.016   4.730  -7.802
   36   1HB   GLU   4           HB2      GLU   4   7.213   4.706 -10.581
   37   2HB   GLU   4           HB1      GLU   4   6.952   6.099  -9.532
   38   1HG   GLU   4           HG2      GLU   4   8.629   5.347  -7.981
   39   2HG   GLU   4           HG1      GLU   4   8.769   3.796  -8.805
   40    H    LYS   5           HN       LYS   5   5.685   3.509 -11.161
   41    HA   LYS   5           HA       LYS   5   3.265   4.831 -11.706
   42   1HB   LYS   5           HB2      LYS   5   4.846   2.806 -12.951
   43   2HB   LYS   5           HB1      LYS   5   3.164   2.270 -12.970
   44   1HG   LYS   5           HG2      LYS   5   2.486   3.985 -14.333
   45   2HG   LYS   5           HG1      LYS   5   3.657   5.120 -13.662
   46   1HD   LYS   5           HD2      LYS   5   5.331   4.461 -15.100
   47   2HD   LYS   5           HD1      LYS   5   4.735   2.804 -15.199
   48   1HE   LYS   5           HE2      LYS   5   2.676   4.317 -16.310
   49   2HE   LYS   5           HE1      LYS   5   4.143   5.083 -16.920
   50   1HZ   LYS   5           HZ3      LYS   5   4.851   2.633 -17.337
   51   2HZ   LYS   5           HZ2      LYS   5   3.178   2.338 -17.309
   52   3HZ   LYS   5           HZ1      LYS   5   3.835   3.421 -18.441
   53    H    ALA   6           HN       ALA   6   3.791   1.789  -9.987
   54    HA   ALA   6           HA       ALA   6   0.930   1.189  -9.873
   55   1HB   ALA   6           HB2      ALA   6   2.738  -0.566  -9.864
   56   2HB   ALA   6           HB1      ALA   6   3.161  -0.035  -8.237
   57   3HB   ALA   6           HB3      ALA   6   1.570  -0.726  -8.552
   58    H    MET   7           HN       MET   7   3.249   1.623  -7.187
   59    HA   MET   7           HA       MET   7   1.336   2.111  -5.201
   60   1HB   MET   7           HB2      MET   7   3.715   1.791  -4.684
   61   2HB   MET   7           HB1      MET   7   4.102   3.337  -5.443
   62   1HG   MET   7           HG2      MET   7   3.895   3.425  -2.922
   63   2HG   MET   7           HG1      MET   7   2.853   4.553  -3.786
   64   1HE   MET   7           HE2      MET   7   3.074   3.499  -1.072
   65   2HE   MET   7           HE1      MET   7   1.389   3.608  -0.571
   66   3HE   MET   7           HE3      MET   7   2.205   2.039  -0.608
   67    H    VAL   8           HN       VAL   8   3.085   4.562  -7.107
   68    HA   VAL   8           HA       VAL   8   1.769   6.828  -6.074
   69    HB   VAL   8           HB       VAL   8   2.560   6.532  -8.981
   70   1HG1  VAL   8          HG13      VAL   8   1.382   8.606  -8.259
   71   2HG1  VAL   8          HG12      VAL   8   2.640   8.872  -7.052
   72   3HG1  VAL   8          HG11      VAL   8   3.041   8.921  -8.769
   73   1HG2  VAL   8          HG23      VAL   8   4.209   5.975  -6.800
   74   2HG2  VAL   8          HG22      VAL   8   4.754   6.419  -8.416
   75   3HG2  VAL   8          HG21      VAL   8   4.567   7.657  -7.177
   76    H    ALA   9           HN       ALA   9   0.660   4.456  -8.444
   77    HA   ALA   9           HA       ALA   9  -1.593   5.987  -9.396
   78   1HB   ALA   9           HB3      ALA   9  -0.890   3.059  -9.367
   79   2HB   ALA   9           HB2      ALA   9  -2.495   3.581  -9.877
   80   3HB   ALA   9           HB1      ALA   9  -1.066   4.140 -10.748
   81    H    LEU  10           HN       LEU  10  -1.206   3.620  -6.758
   82    HA   LEU  10           HA       LEU  10  -3.880   3.418  -5.913
   83   1HB   LEU  10           HB2      LEU  10  -1.282   2.893  -4.792
   84   2HB   LEU  10           HB1      LEU  10  -2.283   3.680  -3.573
   85    HG   LEU  10           HG       LEU  10  -3.480   1.470  -5.205
   86   1HD1  LEU  10          HD13      LEU  10  -1.476   1.174  -2.964
   87   2HD1  LEU  10          HD12      LEU  10  -2.668  -0.077  -3.315
   88   3HD1  LEU  10          HD11      LEU  10  -1.479   0.376  -4.537
   89   1HD2  LEU  10          HD23      LEU  10  -4.845   2.805  -3.618
   90   2HD2  LEU  10          HD22      LEU  10  -4.737   1.117  -3.118
   91   3HD2  LEU  10          HD21      LEU  10  -3.757   2.341  -2.310
   92    H    ILE  11           HN       ILE  11  -1.454   5.869  -4.958
   93    HA   ILE  11           HA       ILE  11  -3.045   7.433  -3.264
   94    HB   ILE  11           HB       ILE  11  -0.745   7.974  -5.091
   95   1HG1  ILE  11          HG12      ILE  11  -1.368   8.523  -2.174
   96   2HG1  ILE  11          HG11      ILE  11  -0.370   7.213  -2.807
   97   1HG2  ILE  11          HG22      ILE  11  -2.723  10.037  -4.251
   98   2HG2  ILE  11          HG21      ILE  11  -1.019  10.453  -4.070
   99   3HG2  ILE  11          HG23      ILE  11  -1.655  10.009  -5.653
  100   1HD1  ILE  11          HD12      ILE  11   0.298  10.079  -3.440
  101   2HD1  ILE  11          HD11      ILE  11   0.819   9.355  -1.921
  102   3HD1  ILE  11          HD13      ILE  11   1.357   8.671  -3.454
  103    H    ASP  12           HN       ASP  12  -2.905   7.396  -6.807
  104    HA   ASP  12           HA       ASP  12  -4.607   9.552  -7.390
  105   1HB   ASP  12           HB2      ASP  12  -3.367   7.962  -9.001
  106   2HB   ASP  12           HB1      ASP  12  -4.769   6.910  -8.849
  107    H    VAL  13           HN       VAL  13  -5.533   6.137  -6.853
  108    HA   VAL  13           HA       VAL  13  -8.303   6.345  -7.041
  109    HB   VAL  13           HB       VAL  13  -6.757   4.807  -4.922
  110   1HG1  VAL  13          HG13      VAL  13  -9.404   5.244  -4.848
  111   2HG1  VAL  13          HG12      VAL  13  -9.393   3.924  -6.016
  112   3HG1  VAL  13          HG11      VAL  13  -8.709   3.684  -4.409
  113   1HG2  VAL  13          HG23      VAL  13  -6.680   4.538  -7.685
  114   2HG2  VAL  13          HG22      VAL  13  -6.262   3.284  -6.518
  115   3HG2  VAL  13          HG21      VAL  13  -7.890   3.353  -7.193
  116    H    PHE  14           HN       PHE  14  -6.257   7.259  -4.274
  117    HA   PHE  14           HA       PHE  14  -8.436   7.989  -2.547
  118   1HB   PHE  14           HB2      PHE  14  -6.034   7.615  -1.832
  119   2HB   PHE  14           HB1      PHE  14  -5.650   9.183  -2.542
  120    HD1  PHE  14           HD1      PHE  14  -6.699  11.259  -1.645
  121    HD2  PHE  14           HD2      PHE  14  -7.231   7.441   0.247
  122    HE1  PHE  14           HE1      PHE  14  -7.505  12.390   0.409
  123    HE2  PHE  14           HE2      PHE  14  -8.036   8.572   2.302
  124    HZ   PHE  14           HZ       PHE  14  -8.175  11.047   2.382
  125    H    HIS  15           HN       HIS  15  -6.472   9.831  -4.872
  126    HA   HIS  15           HA       HIS  15  -8.029  12.275  -4.346
  127   1HB   HIS  15           HB2      HIS  15  -5.593  12.393  -4.843
  128   2HB   HIS  15           HB1      HIS  15  -5.906  11.716  -6.440
  129    HD1  HIS  15           HD1      HIS  15  -6.134  13.449  -8.202
  130    HD2  HIS  15           HD2      HIS  15  -7.364  14.888  -4.488
  131    HE1  HIS  15           HE1      HIS  15  -6.807  15.864  -8.557
  132    H    GLN  16           HN       GLN  16  -8.886   9.565  -5.788
  133    HA   GLN  16           HA       GLN  16 -10.072  10.858  -8.201
  134   1HB   GLN  16           HB2      GLN  16  -9.159   8.115  -7.544
  135   2HB   GLN  16           HB1      GLN  16 -10.636   8.217  -8.499
  136   1HG   GLN  16           HG2      GLN  16  -8.134   9.765  -9.205
  137   2HG   GLN  16           HG1      GLN  16  -8.454   8.146  -9.827
  138   1HE2  GLN  16          HE22      GLN  16 -10.744   9.273 -12.253
  139   2HE2  GLN  16          HE21      GLN  16  -9.852   7.977 -11.617
  140    H    TYR  17           HN       TYR  17 -10.889   8.739  -5.448
  141    HA   TYR  17           HA       TYR  17 -13.758   8.973  -6.003
  142   1HB   TYR  17           HB2      TYR  17 -12.122   7.660  -3.836
  143   2HB   TYR  17           HB1      TYR  17 -13.878   7.780  -3.712
  144    HD1  TYR  17           HD2      TYR  17 -11.248   6.803  -6.211
  145    HD2  TYR  17           HD1      TYR  17 -15.164   6.056  -4.607
  146    HE1  TYR  17           HE2      TYR  17 -11.490   4.844  -7.713
  147    HE2  TYR  17           HE1      TYR  17 -15.405   4.096  -6.108
  148    HH   TYR  17           HH       TYR  17 -13.816   3.577  -8.719
  149    H    SER  18           HN       SER  18 -11.380  10.481  -3.896
  150    HA   SER  18           HA       SER  18 -13.446  11.864  -2.325
  151   1HB   SER  18           HB2      SER  18 -11.107  11.112  -1.491
  152   2HB   SER  18           HB1      SER  18 -10.503  12.535  -2.335
  153    HG   SER  18           HG       SER  18 -11.023  13.002  -0.165
  154    H    GLY  19           HN       GLY  19 -12.409  12.256  -5.397
  155   1HA   GLY  19           HA2      GLY  19 -12.195  15.201  -5.308
  156   2HA   GLY  19           HA1      GLY  19 -11.925  14.196  -6.729
  157    H    ARG  20           HN       ARG  20 -14.090  12.823  -7.212
  158    HA   ARG  20           HA       ARG  20 -16.018  14.659  -8.167
  159   1HB   ARG  20           HB2      ARG  20 -17.525  12.558  -8.252
  160   2HB   ARG  20           HB1      ARG  20 -16.020  12.515  -9.173
  161   1HG   ARG  20           HG2      ARG  20 -15.080  10.942  -7.815
  162   2HG   ARG  20           HG1      ARG  20 -15.815  11.615  -6.359
  163   1HD   ARG  20           HD2      ARG  20 -17.389  10.012  -6.429
  164   2HD   ARG  20           HD1      ARG  20 -17.930  10.630  -7.989
  165    HE   ARG  20           HE       ARG  20 -16.081   9.112  -8.960
  166   1HH1  ARG  20          HH21      ARG  20 -16.378   8.544  -5.688
  167   2HH1  ARG  20          HH22      ARG  20 -16.701   6.848  -5.822
  168   1HH2  ARG  20          HH11      ARG  20 -17.058   6.921  -9.269
  169   2HH2  ARG  20          HH12      ARG  20 -17.085   5.928  -7.850
  170    H    GLU  21           HN       GLU  21 -15.575  13.357  -5.000
  171    HA   GLU  21           HA       GLU  21 -18.298  13.679  -4.071
  172   1HB   GLU  21           HB2      GLU  21 -15.730  12.912  -2.954
  173   2HB   GLU  21           HB1      GLU  21 -16.584  14.008  -1.871
  174   1HG   GLU  21           HG2      GLU  21 -17.975  11.647  -3.139
  175   2HG   GLU  21           HG1      GLU  21 -17.086  11.491  -1.624
  176    H    GLY  22           HN       GLY  22 -18.059  15.266  -1.792
  177   1HA   GLY  22           HA2      GLY  22 -18.064  17.938  -3.008
  178   2HA   GLY  22           HA1      GLY  22 -18.584  17.549  -1.370
  179    H    ASP  23           HN       ASP  23 -16.226  16.130  -0.589
  180    HA   ASP  23           HA       ASP  23 -14.516  18.404   0.066
  181   1HB   ASP  23           HB2      ASP  23 -13.655  15.612   0.661
  182   2HB   ASP  23           HB1      ASP  23 -13.620  17.040   1.687
  183    H    LYS  24           HN       LYS  24 -11.967  17.556  -0.013
  184    HA   LYS  24           HA       LYS  24 -11.363  16.336  -2.622
  185   1HB   LYS  24           HB2      LYS  24 -11.813  18.839  -2.985
  186   2HB   LYS  24           HB1      LYS  24 -10.331  19.123  -2.069
  187   1HG   LYS  24           HG2      LYS  24  -9.079  17.706  -3.661
  188   2HG   LYS  24           HG1      LYS  24 -10.557  17.447  -4.587
  189   1HD   LYS  24           HD2      LYS  24 -10.657  19.692  -5.290
  190   2HD   LYS  24           HD1      LYS  24  -9.574  20.236  -4.007
  191   1HE   LYS  24           HE2      LYS  24  -7.667  19.436  -5.091
  192   2HE   LYS  24           HE1      LYS  24  -8.580  18.266  -6.044
  193   1HZ   LYS  24           HZ1      LYS  24  -9.664  20.519  -6.905
  194   2HZ   LYS  24           HZ3      LYS  24  -8.116  21.097  -6.522
  195   3HZ   LYS  24           HZ2      LYS  24  -8.295  19.821  -7.629
  196    H    HIS  25           HN       HIS  25 -10.775  16.211   0.445
  197    HA   HIS  25           HA       HIS  25  -7.955  15.454   0.089
  198   1HB   HIS  25           HB2      HIS  25  -8.656  18.007   1.157
  199   2HB   HIS  25           HB1      HIS  25  -8.022  17.025   2.475
  200    HD1  HIS  25           HD1      HIS  25  -6.798  16.392  -1.001
  201    HD2  HIS  25           HD2      HIS  25  -5.530  18.449   2.396
  202    HE1  HIS  25           HE1      HIS  25  -4.368  16.989  -1.389
  203    H    LYS  26           HN       LYS  26 -10.796  14.494   1.091
  204    HA   LYS  26           HA       LYS  26  -9.661  12.816   3.243
  205   1HB   LYS  26           HB2      LYS  26 -11.592  13.313   4.748
  206   2HB   LYS  26           HB1      LYS  26 -10.561  14.721   4.485
  207   1HG   LYS  26           HG2      LYS  26 -12.457  14.754   2.395
  208   2HG   LYS  26           HG1      LYS  26 -13.364  14.390   3.864
  209   1HD   LYS  26           HD2      LYS  26 -13.233  16.808   3.593
  210   2HD   LYS  26           HD1      LYS  26 -12.255  16.331   4.979
  211   1HE   LYS  26           HE2      LYS  26 -10.248  16.731   3.878
  212   2HE   LYS  26           HE1      LYS  26 -10.957  16.487   2.283
  213   1HZ   LYS  26           HZ2      LYS  26 -12.250  18.563   2.684
  214   2HZ   LYS  26           HZ1      LYS  26 -11.309  18.822   4.073
  215   3HZ   LYS  26           HZ3      LYS  26 -10.571  18.795   2.546
  216    H    LEU  27           HN       LEU  27 -10.454  10.762   3.054
  217    HA   LEU  27           HA       LEU  27 -12.584  10.296   1.055
  218   1HB   LEU  27           HB2      LEU  27 -10.270   8.859   1.954
  219   2HB   LEU  27           HB1      LEU  27 -11.698   7.856   2.226
  220    HG   LEU  27           HG       LEU  27 -11.297   9.299  -0.389
  221   1HD1  LEU  27          HD13      LEU  27  -9.472   7.460   0.568
  222   2HD1  LEU  27          HD12      LEU  27 -10.589   6.452  -0.352
  223   3HD1  LEU  27          HD11      LEU  27  -9.768   7.802  -1.135
  224   1HD2  LEU  27          HD22      LEU  27 -12.892   6.923   0.593
  225   2HD2  LEU  27          HD21      LEU  27 -13.499   8.418  -0.115
  226   3HD2  LEU  27          HD23      LEU  27 -12.654   7.245  -1.124
  227    H    LYS  28           HN       LYS  28 -13.570   7.843   2.175
  228    HA   LYS  28           HA       LYS  28 -14.723   8.637   4.786
  229   1HB   LYS  28           HB2      LYS  28 -16.247   8.308   2.218
  230   2HB   LYS  28           HB1      LYS  28 -17.014   7.875   3.747
  231   1HG   LYS  28           HG2      LYS  28 -16.228  10.197   4.574
  232   2HG   LYS  28           HG1      LYS  28 -15.979  10.568   2.868
  233   1HD   LYS  28           HD2      LYS  28 -18.582   9.639   4.121
  234   2HD   LYS  28           HD1      LYS  28 -18.225  11.277   3.569
  235   1HE   LYS  28           HE2      LYS  28 -17.595   9.773   1.352
  236   2HE   LYS  28           HE1      LYS  28 -18.977   8.897   2.011
  237   1HZ   LYS  28           HZ1      LYS  28 -19.012  11.834   1.689
  238   2HZ   LYS  28           HZ3      LYS  28 -19.452  10.798   0.422
  239   3HZ   LYS  28           HZ2      LYS  28 -20.327  10.775   1.878
  240    H    LYS  29           HN       LYS  29 -15.780   6.806   5.864
  241    HA   LYS  29           HA       LYS  29 -14.374   4.317   5.398
  242   1HB   LYS  29           HB2      LYS  29 -16.822   4.764   7.130
  243   2HB   LYS  29           HB1      LYS  29 -15.626   3.477   7.285
  244   1HG   LYS  29           HG2      LYS  29 -13.907   5.046   7.913
  245   2HG   LYS  29           HG1      LYS  29 -14.950   6.417   7.539
  246   1HD   LYS  29           HD2      LYS  29 -15.461   6.369   9.752
  247   2HD   LYS  29           HD1      LYS  29 -16.500   5.011   9.316
  248   1HE   LYS  29           HE2      LYS  29 -15.268   3.791  10.769
  249   2HE   LYS  29           HE1      LYS  29 -13.994   3.843   9.551
  250   1HZ   LYS  29           HZ1      LYS  29 -14.350   6.011  11.528
  251   2HZ   LYS  29           HZ3      LYS  29 -13.411   4.641  11.869
  252   3HZ   LYS  29           HZ2      LYS  29 -12.985   5.661  10.579
  253    H    SER  30           HN       SER  30 -17.469   5.625   4.434
  254    HA   SER  30           HA       SER  30 -18.554   3.027   3.625
  255   1HB   SER  30           HB2      SER  30 -19.921   5.092   4.314
  256   2HB   SER  30           HB1      SER  30 -19.537   5.739   2.722
  257    HG   SER  30           HG       SER  30 -20.333   3.523   2.026
  258    H    GLU  31           HN       GLU  31 -16.912   5.752   2.059
  259    HA   GLU  31           HA       GLU  31 -17.204   4.542  -0.599
  260   1HB   GLU  31           HB2      GLU  31 -17.040   7.061  -0.130
  261   2HB   GLU  31           HB1      GLU  31 -15.324   6.789   0.180
  262   1HG   GLU  31           HG2      GLU  31 -14.914   6.819  -2.028
  263   2HG   GLU  31           HG1      GLU  31 -16.004   5.451  -2.252
  264    H    LEU  32           HN       LEU  32 -15.099   4.320   2.095
  265    HA   LEU  32           HA       LEU  32 -12.785   3.353   0.573
  266   1HB   LEU  32           HB2      LEU  32 -12.319   4.425   2.693
  267   2HB   LEU  32           HB1      LEU  32 -13.459   3.373   3.531
  268    HG   LEU  32           HG       LEU  32 -12.073   1.443   3.163
  269   1HD1  LEU  32          HD11      LEU  32 -10.600   3.300   1.300
  270   2HD1  LEU  32          HD13      LEU  32  -9.813   1.864   1.954
  271   3HD1  LEU  32          HD12      LEU  32 -11.263   1.701   0.962
  272   1HD2  LEU  32          HD22      LEU  32 -11.097   3.819   4.480
  273   2HD2  LEU  32          HD21      LEU  32 -10.872   2.133   4.942
  274   3HD2  LEU  32          HD23      LEU  32  -9.737   2.903   3.832
  275    H    LYS  33           HN       LYS  33 -15.372   2.018   2.599
  276    HA   LYS  33           HA       LYS  33 -14.663  -0.724   2.500
  277   1HB   LYS  33           HB2      LYS  33 -16.613   0.567   3.736
  278   2HB   LYS  33           HB1      LYS  33 -17.536   0.131   2.302
  279   1HG   LYS  33           HG2      LYS  33 -17.146  -2.212   2.658
  280   2HG   LYS  33           HG1      LYS  33 -15.962  -1.883   3.924
  281   1HD   LYS  33           HD2      LYS  33 -18.100  -2.528   4.935
  282   2HD   LYS  33           HD1      LYS  33 -17.756  -0.835   5.293
  283   1HE   LYS  33           HE2      LYS  33 -20.132  -1.288   4.532
  284   2HE   LYS  33           HE1      LYS  33 -19.268  -0.083   3.577
  285   1HZ   LYS  33           HZ1      LYS  33 -18.976  -2.827   2.693
  286   2HZ   LYS  33           HZ3      LYS  33 -20.534  -2.180   2.526
  287   3HZ   LYS  33           HZ2      LYS  33 -19.212  -1.410   1.786
  288    H    GLU  34           HN       GLU  34 -16.446   1.313   0.244
  289    HA   GLU  34           HA       GLU  34 -17.040  -0.882  -1.582
  290   1HB   GLU  34           HB2      GLU  34 -18.174   0.727  -2.860
  291   2HB   GLU  34           HB1      GLU  34 -18.279   1.414  -1.242
  292   1HG   GLU  34           HG2      GLU  34 -16.487   2.938  -1.666
  293   2HG   GLU  34           HG1      GLU  34 -16.074   2.141  -3.181
  294    H    LEU  35           HN       LEU  35 -14.692   1.717  -1.349
  295    HA   LEU  35           HA       LEU  35 -13.383   1.558  -3.814
  296   1HB   LEU  35           HB2      LEU  35 -12.888   2.782  -1.383
  297   2HB   LEU  35           HB1      LEU  35 -11.528   1.664  -1.536
  298    HG   LEU  35           HG       LEU  35 -10.955   3.806  -2.572
  299   1HD1  LEU  35          HD13      LEU  35 -11.416   1.439  -4.382
  300   2HD1  LEU  35          HD12      LEU  35 -10.678   2.917  -5.000
  301   3HD1  LEU  35          HD11      LEU  35  -9.900   2.023  -3.695
  302   1HD2  LEU  35          HD23      LEU  35 -13.685   3.654  -3.446
  303   2HD2  LEU  35          HD22      LEU  35 -12.562   5.006  -3.596
  304   3HD2  LEU  35          HD21      LEU  35 -12.647   3.785  -4.865
  305    H    ILE  36           HN       ILE  36 -12.824  -0.463  -0.929
  306    HA   ILE  36           HA       ILE  36 -10.899  -2.152  -2.342
  307    HB   ILE  36           HB       ILE  36 -12.147  -3.068   0.200
  308   1HG1  ILE  36          HG12      ILE  36 -10.682  -0.459  -0.144
  309   2HG1  ILE  36          HG11      ILE  36 -12.080  -0.823   0.862
  310   1HG2  ILE  36          HG21      ILE  36  -9.298  -2.776  -0.807
  311   2HG2  ILE  36          HG23      ILE  36  -9.766  -3.538   0.715
  312   3HG2  ILE  36          HG22      ILE  36 -10.258  -4.256  -0.819
  313   1HD1  ILE  36          HD13      ILE  36 -10.378  -2.447   2.080
  314   2HD1  ILE  36          HD12      ILE  36  -9.181  -1.347   1.395
  315   3HD1  ILE  36          HD11      ILE  36 -10.424  -0.731   2.483
  316    H    ASN  37           HN       ASN  37 -14.123  -2.757  -0.897
  317    HA   ASN  37           HA       ASN  37 -14.348  -5.389  -2.052
  318   1HB   ASN  37           HB2      ASN  37 -15.560  -4.471  -0.001
  319   2HB   ASN  37           HB1      ASN  37 -16.638  -3.658  -1.135
  320   1HD2  ASN  37          HD22      ASN  37 -18.599  -6.584  -1.240
  321   2HD2  ASN  37          HD21      ASN  37 -18.540  -4.909  -0.975
  322    H    ASN  38           HN       ASN  38 -14.389  -2.522  -3.664
  323    HA   ASN  38           HA       ASN  38 -16.472  -3.474  -5.585
  324   1HB   ASN  38           HB2      ASN  38 -16.760  -1.167  -4.568
  325   2HB   ASN  38           HB1      ASN  38 -15.299  -0.687  -5.431
  326   1HD2  ASN  38          HD22      ASN  38 -16.864  -0.870  -8.667
  327   2HD2  ASN  38          HD21      ASN  38 -15.369  -1.057  -7.885
  328    H    GLU  39           HN       GLU  39 -13.266  -1.882  -5.484
  329    HA   GLU  39           HA       GLU  39 -12.541  -3.471  -7.886
  330   1HB   GLU  39           HB2      GLU  39 -11.335  -1.281  -8.671
  331   2HB   GLU  39           HB1      GLU  39 -13.057  -1.477  -8.993
  332   1HG   GLU  39           HG2      GLU  39 -13.567   0.303  -7.711
  333   2HG   GLU  39           HG1      GLU  39 -12.635  -0.342  -6.359
  334    H    LEU  40           HN       LEU  40 -11.761  -3.920  -5.199
  335    HA   LEU  40           HA       LEU  40  -9.275  -2.701  -4.498
  336   1HB   LEU  40           HB2      LEU  40 -10.214  -3.918  -2.744
  337   2HB   LEU  40           HB1      LEU  40 -10.669  -5.262  -3.786
  338    HG   LEU  40           HG       LEU  40  -8.461  -6.120  -3.832
  339   1HD1  LEU  40          HD11      LEU  40  -7.739  -3.351  -3.512
  340   2HD1  LEU  40          HD13      LEU  40  -6.902  -4.315  -2.297
  341   3HD1  LEU  40          HD12      LEU  40  -6.722  -4.704  -4.008
  342   1HD2  LEU  40          HD21      LEU  40  -9.791  -6.023  -1.531
  343   2HD2  LEU  40          HD23      LEU  40  -8.160  -6.690  -1.606
  344   3HD2  LEU  40          HD22      LEU  40  -8.413  -5.038  -1.042
  345    H    SER  41           HN       SER  41  -9.484  -6.108  -5.484
  346    HA   SER  41           HA       SER  41  -7.709  -5.724  -7.757
  347   1HB   SER  41           HB2      SER  41  -5.996  -7.374  -6.594
  348   2HB   SER  41           HB1      SER  41  -5.879  -5.637  -6.327
  349    HG   SER  41           HG       SER  41  -5.837  -6.748  -4.357
  350    H    HIS  42           HN       HIS  42 -10.241  -6.860  -7.520
  351    HA   HIS  42           HA       HIS  42 -11.448  -8.836  -7.931
  352   1HB   HIS  42           HB2      HIS  42  -9.148  -8.725  -9.647
  353   2HB   HIS  42           HB1      HIS  42  -9.439 -10.406  -9.198
  354    HD1  HIS  42           HD1      HIS  42 -12.094  -7.736  -9.647
  355    HD2  HIS  42           HD2      HIS  42 -10.816 -11.257 -11.476
  356    HE1  HIS  42           HE1      HIS  42 -13.811  -8.282 -11.428
  357    H    PHE  43           HN       PHE  43  -9.659  -8.642  -5.487
  358    HA   PHE  43           HA       PHE  43  -9.249 -11.569  -5.041
  359   1HB   PHE  43           HB2      PHE  43  -7.941  -9.110  -3.886
  360   2HB   PHE  43           HB1      PHE  43  -7.860 -10.654  -3.043
  361    HD1  PHE  43           HD2      PHE  43  -7.658 -12.609  -5.207
  362    HD2  PHE  43           HD1      PHE  43  -5.831  -8.739  -4.831
  363    HE1  PHE  43           HE2      PHE  43  -5.821 -13.327  -6.713
  364    HE2  PHE  43           HE1      PHE  43  -3.996  -9.458  -6.336
  365    HZ   PHE  43           HZ       PHE  43  -3.991 -11.751  -7.276
  366    H    LEU  44           HN       LEU  44 -11.193 -12.274  -4.202
  367    HA   LEU  44           HA       LEU  44 -11.907 -11.594  -1.516
  368   1HB   LEU  44           HB2      LEU  44 -13.012  -9.892  -3.589
  369   2HB   LEU  44           HB1      LEU  44 -14.296 -10.756  -2.740
  370    HG   LEU  44           HG       LEU  44 -12.362  -9.854  -0.819
  371   1HD1  LEU  44          HD13      LEU  44 -13.049  -7.950  -2.997
  372   2HD1  LEU  44          HD12      LEU  44 -13.161  -7.331  -1.350
  373   3HD1  LEU  44          HD11      LEU  44 -11.636  -7.990  -1.943
  374   1HD2  LEU  44          HD22      LEU  44 -15.250  -9.189  -1.452
  375   2HD2  LEU  44          HD21      LEU  44 -14.649 -10.303  -0.226
  376   3HD2  LEU  44          HD23      LEU  44 -14.413  -8.566  -0.030
  377    H    GLU  45           HN       GLU  45 -11.977 -13.899  -1.413
  378    HA   GLU  45           HA       GLU  45 -14.538 -15.086  -1.868
  379   1HB   GLU  45           HB2      GLU  45 -13.842 -16.738  -3.633
  380   2HB   GLU  45           HB1      GLU  45 -13.951 -15.078  -4.221
  381   1HG   GLU  45           HG2      GLU  45 -11.640 -14.829  -4.362
  382   2HG   GLU  45           HG1      GLU  45 -11.331 -16.079  -3.159
  383    H    GLU  46           HN       GLU  46 -11.072 -15.528  -1.402
  384    HA   GLU  46           HA       GLU  46 -11.624 -18.046   0.096
  385   1HB   GLU  46           HB2      GLU  46  -9.183 -16.883  -1.217
  386   2HB   GLU  46           HB1      GLU  46  -8.990 -18.045   0.095
  387   1HG   GLU  46           HG2      GLU  46  -9.975 -19.774  -1.105
  388   2HG   GLU  46           HG1      GLU  46 -10.896 -18.677  -2.132
  389    H    ILE  47           HN       ILE  47  -9.498 -15.177   0.431
  390    HA   ILE  47           HA       ILE  47  -8.981 -13.906   2.334
  391    HB   ILE  47           HB       ILE  47 -11.289 -15.344   3.670
  392   1HG1  ILE  47          HG12      ILE  47 -11.301 -12.859   1.929
  393   2HG1  ILE  47          HG11      ILE  47 -12.039 -14.409   1.524
  394   1HG2  ILE  47          HG22      ILE  47  -9.724 -12.817   4.159
  395   2HG2  ILE  47          HG21      ILE  47 -11.382 -12.964   4.744
  396   3HG2  ILE  47          HG23      ILE  47 -10.149 -14.094   5.299
  397   1HD1  ILE  47          HD12      ILE  47 -13.312 -14.099   3.793
  398   2HD1  ILE  47          HD11      ILE  47 -12.885 -12.401   3.595
  399   3HD1  ILE  47          HD13      ILE  47 -13.862 -13.210   2.372
  400    H    LYS  48           HN       LYS  48  -7.070 -14.607   3.161
  401    HA   LYS  48           HA       LYS  48  -7.031 -17.214   4.606
  402   1HB   LYS  48           HB2      LYS  48  -5.038 -15.675   3.026
  403   2HB   LYS  48           HB1      LYS  48  -4.419 -16.523   4.442
  404   1HG   LYS  48           HG2      LYS  48  -6.096 -18.401   3.301
  405   2HG   LYS  48           HG1      LYS  48  -5.385 -17.610   1.894
  406   1HD   LYS  48           HD2      LYS  48  -3.847 -19.328   2.405
  407   2HD   LYS  48           HD1      LYS  48  -3.126 -17.888   3.126
  408   1HE   LYS  48           HE2      LYS  48  -4.579 -18.643   5.225
  409   2HE   LYS  48           HE1      LYS  48  -4.435 -20.224   4.458
  410   1HZ   LYS  48           HZ2      LYS  48  -1.932 -19.381   4.272
  411   2HZ   LYS  48           HZ1      LYS  48  -2.388 -18.563   5.688
  412   3HZ   LYS  48           HZ3      LYS  48  -2.513 -20.252   5.608
  413    H    GLU  49           HN       GLU  49  -6.041 -13.802   4.886
  414    HA   GLU  49           HA       GLU  49  -5.334 -14.204   7.724
  415   1HB   GLU  49           HB2      GLU  49  -4.940 -12.077   5.701
  416   2HB   GLU  49           HB1      GLU  49  -5.214 -11.510   7.348
  417   1HG   GLU  49           HG2      GLU  49  -3.131 -13.553   6.522
  418   2HG   GLU  49           HG1      GLU  49  -2.805 -11.868   6.924
  419    H    GLN  50           HN       GLN  50  -7.656 -14.877   8.151
  420    HA   GLN  50           HA       GLN  50  -9.865 -13.133   7.899
  421   1HB   GLN  50           HB2      GLN  50  -9.871 -15.567   8.661
  422   2HB   GLN  50           HB1      GLN  50  -9.406 -14.974  10.255
  423   1HG   GLN  50           HG2      GLN  50 -11.422 -13.511  10.265
  424   2HG   GLN  50           HG1      GLN  50 -11.904 -14.207   8.718
  425   1HE2  GLN  50          HE22      GLN  50 -12.719 -16.210  12.117
  426   2HE2  GLN  50          HE21      GLN  50 -12.084 -14.636  12.121
  427    H    GLU  51           HN       GLU  51  -7.129 -12.986  10.033
  428    HA   GLU  51           HA       GLU  51  -8.410 -11.213  11.970
  429   1HB   GLU  51           HB2      GLU  51  -6.028 -12.717  11.863
  430   2HB   GLU  51           HB1      GLU  51  -5.519 -11.031  11.945
  431   1HG   GLU  51           HG2      GLU  51  -7.185 -10.754  13.856
  432   2HG   GLU  51           HG1      GLU  51  -7.327 -12.512  13.864
  433    H    VAL  52           HN       VAL  52  -6.159 -10.818   9.233
  434    HA   VAL  52           HA       VAL  52  -5.752  -8.012   9.523
  435    HB   VAL  52           HB       VAL  52  -5.830  -9.639   6.966
  436   1HG1  VAL  52          HG12      VAL  52  -5.222  -6.845   7.598
  437   2HG1  VAL  52          HG11      VAL  52  -3.910  -7.655   6.743
  438   3HG1  VAL  52          HG13      VAL  52  -5.524  -7.601   6.035
  439   1HG2  VAL  52          HG21      VAL  52  -4.267 -10.292   8.985
  440   2HG2  VAL  52          HG23      VAL  52  -3.618 -10.240   7.346
  441   3HG2  VAL  52          HG22      VAL  52  -3.335  -8.894   8.449
  442    H    VAL  53           HN       VAL  53  -7.923  -9.675   7.211
  443    HA   VAL  53           HA       VAL  53  -9.326  -7.304   6.476
  444    HB   VAL  53           HB       VAL  53 -10.194 -10.208   6.401
  445   1HG1  VAL  53          HG11      VAL  53 -11.616  -7.713   5.803
  446   2HG1  VAL  53          HG13      VAL  53 -11.582  -8.833   4.441
  447   3HG1  VAL  53          HG12      VAL  53 -12.250  -9.349   5.989
  448   1HG2  VAL  53          HG23      VAL  53  -8.183  -9.550   5.044
  449   2HG2  VAL  53          HG22      VAL  53  -9.544 -10.085   4.057
  450   3HG2  VAL  53          HG21      VAL  53  -9.187  -8.365   4.210
  451    H    ASP  54           HN       ASP  54  -9.702  -9.491   9.187
  452    HA   ASP  54           HA       ASP  54 -12.352  -8.566   9.912
  453   1HB   ASP  54           HB2      ASP  54 -11.609 -10.703  10.764
  454   2HB   ASP  54           HB1      ASP  54 -10.187  -9.968  11.505
  455    H    LYS  55           HN       LYS  55  -9.103  -7.406  10.398
  456    HA   LYS  55           HA       LYS  55  -9.829  -5.607  12.584
  457   1HB   LYS  55           HB2      LYS  55  -7.561  -6.399  12.546
  458   2HB   LYS  55           HB1      LYS  55  -7.352  -5.902  10.869
  459   1HG   LYS  55           HG2      LYS  55  -8.175  -3.584  12.247
  460   2HG   LYS  55           HG1      LYS  55  -6.971  -4.354  13.280
  461   1HD   LYS  55           HD2      LYS  55  -5.706  -4.651  10.949
  462   2HD   LYS  55           HD1      LYS  55  -6.666  -3.232  10.533
  463   1HE   LYS  55           HE2      LYS  55  -5.110  -1.986  11.589
  464   2HE   LYS  55           HE1      LYS  55  -5.682  -2.692  13.100
  465   1HZ   LYS  55           HZ2      LYS  55  -3.863  -4.332  11.541
  466   2HZ   LYS  55           HZ1      LYS  55  -3.185  -2.930  12.220
  467   3HZ   LYS  55           HZ3      LYS  55  -3.934  -4.078  13.219
  468    H    VAL  56           HN       VAL  56  -8.770  -5.051   9.180
  469    HA   VAL  56           HA       VAL  56  -9.483  -2.272   9.242
  470    HB   VAL  56           HB       VAL  56  -9.310  -2.426   6.770
  471   1HG1  VAL  56          HG13      VAL  56  -7.287  -2.305   8.295
  472   2HG1  VAL  56          HG12      VAL  56  -7.131  -4.049   8.096
  473   3HG1  VAL  56          HG11      VAL  56  -6.975  -2.986   6.699
  474   1HG2  VAL  56          HG21      VAL  56  -9.140  -5.387   7.373
  475   2HG2  VAL  56          HG23      VAL  56 -10.326  -4.571   6.354
  476   3HG2  VAL  56          HG22      VAL  56  -8.643  -4.684   5.835
  477    H    MET  57           HN       MET  57 -11.153  -5.143   7.969
  478    HA   MET  57           HA       MET  57 -13.513  -3.817   7.083
  479   1HB   MET  57           HB2      MET  57 -12.824  -6.225   6.628
  480   2HB   MET  57           HB1      MET  57 -13.376  -6.600   8.262
  481   1HG   MET  57           HG2      MET  57 -15.493  -6.733   7.523
  482   2HG   MET  57           HG1      MET  57 -15.407  -5.060   6.975
  483   1HE   MET  57           HE1      MET  57 -13.020  -5.173   5.075
  484   2HE   MET  57           HE3      MET  57 -13.708  -5.477   3.474
  485   3HE   MET  57           HE2      MET  57 -14.481  -4.331   4.565
  486    H    GLU  58           HN       GLU  58 -12.355  -4.642  10.259
  487    HA   GLU  58           HA       GLU  58 -14.901  -4.586  11.622
  488   1HB   GLU  58           HB2      GLU  58 -12.097  -4.779  12.338
  489   2HB   GLU  58           HB1      GLU  58 -12.927  -3.648  13.406
  490   1HG   GLU  58           HG2      GLU  58 -14.666  -5.346  13.855
  491   2HG   GLU  58           HG1      GLU  58 -13.823  -6.482  12.802
  492    H    THR  59           HN       THR  59 -12.326  -2.092  11.328
  493    HA   THR  59           HA       THR  59 -13.864  -0.007  12.544
  494    HB   THR  59           HB       THR  59 -11.953   0.682  10.354
  495    HG1  THR  59           HG1      THR  59 -11.285  -0.686  12.739
  496   1HG2  THR  59          HG23      THR  59 -12.923   1.748  12.909
  497   2HG2  THR  59          HG22      THR  59 -11.174   1.881  12.714
  498   3HG2  THR  59          HG21      THR  59 -12.252   2.599  11.517
  499    H    LEU  60           HN       LEU  60 -13.755  -1.345   9.330
  500    HA   LEU  60           HA       LEU  60 -15.113   0.723   7.909
  501   1HB   LEU  60           HB2      LEU  60 -14.566  -2.177   7.540
  502   2HB   LEU  60           HB1      LEU  60 -15.902  -1.514   6.607
  503    HG   LEU  60           HG       LEU  60 -13.140  -0.274   6.700
  504   1HD1  LEU  60          HD11      LEU  60 -13.619  -2.689   5.591
  505   2HD1  LEU  60          HD13      LEU  60 -14.130  -1.656   4.258
  506   3HD1  LEU  60          HD12      LEU  60 -12.489  -1.528   4.892
  507   1HD2  LEU  60          HD23      LEU  60 -15.739   0.381   5.447
  508   2HD2  LEU  60          HD22      LEU  60 -14.384   1.438   5.847
  509   3HD2  LEU  60          HD21      LEU  60 -14.351   0.485   4.364
  510    H    ASP  61           HN       ASP  61 -16.364  -2.250   9.430
  511    HA   ASP  61           HA       ASP  61 -19.140  -1.432   9.050
  512   1HB   ASP  61           HB2      ASP  61 -17.761  -3.838   9.649
  513   2HB   ASP  61           HB1      ASP  61 -18.832  -3.516  11.012
  514    H    GLU  62           HN       GLU  62 -16.751  -0.509  11.200
  515    HA   GLU  62           HA       GLU  62 -18.276  -0.423  13.654
  516   1HB   GLU  62           HB2      GLU  62 -15.694  -0.217  13.277
  517   2HB   GLU  62           HB1      GLU  62 -16.046   1.495  13.037
  518   1HG   GLU  62           HG2      GLU  62 -16.361   1.827  15.245
  519   2HG   GLU  62           HG1      GLU  62 -17.437   0.434  15.365
  520    H    ASP  63           HN       ASP  63 -17.156   2.323  11.670
  521    HA   ASP  63           HA       ASP  63 -19.418   3.922  12.671
  522   1HB   ASP  63           HB2      ASP  63 -16.796   4.462  11.589
  523   2HB   ASP  63           HB1      ASP  63 -18.015   5.366  10.691
  524    H    GLY  64           HN       GLY  64 -18.171   2.831   9.518
  525   1HA   GLY  64           HA2      GLY  64 -19.489   2.136   7.655
  526   2HA   GLY  64           HA1      GLY  64 -20.934   2.687   8.506
  527    H    ASP  65           HN       ASP  65 -20.486   5.294   9.030
  528    HA   ASP  65           HA       ASP  65 -19.857   6.486   6.357
  529   1HB   ASP  65           HB2      ASP  65 -22.343   6.388   7.158
  530   2HB   ASP  65           HB1      ASP  65 -21.867   7.691   8.248
  531    H    GLY  66           HN       GLY  66 -17.676   6.794   7.323
  532   1HA   GLY  66           HA2      GLY  66 -17.636   9.215   9.055
  533   2HA   GLY  66           HA1      GLY  66 -16.522   7.881   9.342
  534    H    GLU  67           HN       GLU  67 -14.813   9.535   8.975
  535    HA   GLU  67           HA       GLU  67 -14.375   9.995   6.051
  536   1HB   GLU  67           HB2      GLU  67 -13.744  11.736   8.437
  537   2HB   GLU  67           HB1      GLU  67 -12.920  11.953   6.893
  538   1HG   GLU  67           HG2      GLU  67 -14.930  12.503   5.768
  539   2HG   GLU  67           HG1      GLU  67 -15.933  11.859   7.068
  540    H    CYS  68           HN       CYS  68 -12.486   9.174   5.242
  541    HA   CYS  68           HA       CYS  68 -10.587   7.962   7.200
  542   1HB   CYS  68           HB2      CYS  68 -11.100   7.407   4.264
  543   2HB   CYS  68           HB1      CYS  68  -9.774   6.683   5.172
  544    HG   CYS  68           HG       CYS  68 -11.411   5.006   5.953
  545    H    ASP  69           HN       ASP  69  -8.228   7.913   6.058
  546    HA   ASP  69           HA       ASP  69  -7.745  10.617   4.878
  547   1HB   ASP  69           HB2      ASP  69  -5.845   9.451   6.902
  548   2HB   ASP  69           HB1      ASP  69  -6.022  11.128   6.391
  549    H    PHE  70           HN       PHE  70  -5.790  10.732   3.607
  550    HA   PHE  70           HA       PHE  70  -5.318   8.616   1.871
  551   1HB   PHE  70           HB2      PHE  70  -3.350   9.767   1.145
  552   2HB   PHE  70           HB1      PHE  70  -4.523  10.987   1.614
  553    HD1  PHE  70           HD1      PHE  70  -4.231  10.852   4.632
  554    HD2  PHE  70           HD2      PHE  70  -1.302  10.865   1.488
  555    HE1  PHE  70           HE1      PHE  70  -2.578  11.844   6.176
  556    HE2  PHE  70           HE2      PHE  70   0.352  11.857   3.041
  557    HZ   PHE  70           HZ       PHE  70  -0.284  12.348   5.384
  558    H    GLN  71           HN       GLN  71  -4.041   9.031   5.087
  559    HA   GLN  71           HA       GLN  71  -1.956   7.008   4.761
  560   1HB   GLN  71           HB2      GLN  71  -2.992   8.731   6.951
  561   2HB   GLN  71           HB1      GLN  71  -2.280   7.195   7.445
  562   1HG   GLN  71           HG2      GLN  71  -0.580   8.280   5.455
  563   2HG   GLN  71           HG1      GLN  71  -0.946   9.589   6.580
  564   1HE2  GLN  71          HE22      GLN  71   1.482   6.575   7.766
  565   2HE2  GLN  71          HE21      GLN  71   0.868   6.653   6.186
  566    H    GLU  72           HN       GLU  72  -5.064   7.144   6.523
  567    HA   GLU  72           HA       GLU  72  -5.086   4.440   7.359
  568   1HB   GLU  72           HB2      GLU  72  -6.993   6.653   7.131
  569   2HB   GLU  72           HB1      GLU  72  -7.759   5.086   6.881
  570   1HG   GLU  72           HG2      GLU  72  -5.926   4.855   9.068
  571   2HG   GLU  72           HG1      GLU  72  -6.941   6.269   9.344
  572    H    PHE  73           HN       PHE  73  -6.761   5.838   4.514
  573    HA   PHE  73           HA       PHE  73  -7.608   3.375   3.410
  574   1HB   PHE  73           HB2      PHE  73  -8.578   5.147   2.291
  575   2HB   PHE  73           HB1      PHE  73  -7.120   6.130   2.365
  576    HD1  PHE  73           HD2      PHE  73  -5.183   5.579   0.817
  577    HD2  PHE  73           HD1      PHE  73  -9.079   3.825   0.376
  578    HE1  PHE  73           HE2      PHE  73  -4.630   4.936  -1.513
  579    HE2  PHE  73           HE1      PHE  73  -8.526   3.183  -1.953
  580    HZ   PHE  73           HZ       PHE  73  -6.301   3.740  -2.899
  581    H    MET  74           HN       MET  74  -4.439   4.710   3.676
  582    HA   MET  74           HA       MET  74  -3.294   3.217   1.443
  583   1HB   MET  74           HB2      MET  74  -2.462   5.309   3.129
  584   2HB   MET  74           HB1      MET  74  -1.376   3.970   3.478
  585   1HG   MET  74           HG2      MET  74  -0.545   5.399   1.611
  586   2HG   MET  74           HG1      MET  74  -0.836   3.733   1.109
  587   1HE   MET  74           HE2      MET  74  -1.746   3.055  -0.526
  588   2HE   MET  74           HE1      MET  74  -3.502   3.147  -0.401
  589   3HE   MET  74           HE3      MET  74  -2.670   3.875  -1.779
  590    H    ALA  75           HN       ALA  75  -2.823   2.998   4.965
  591    HA   ALA  75           HA       ALA  75  -1.551   0.436   4.851
  592   1HB   ALA  75           HB3      ALA  75  -2.999   1.843   7.119
  593   2HB   ALA  75           HB2      ALA  75  -2.008   0.400   7.314
  594   3HB   ALA  75           HB1      ALA  75  -1.269   1.910   6.782
  595    H    PHE  76           HN       PHE  76  -4.817   1.407   4.604
  596    HA   PHE  76           HA       PHE  76  -5.975  -1.102   5.555
  597   1HB   PHE  76           HB2      PHE  76  -6.950   1.501   4.565
  598   2HB   PHE  76           HB1      PHE  76  -7.955   0.128   4.106
  599    HD1  PHE  76           HD1      PHE  76  -6.047   1.319   7.116
  600    HD2  PHE  76           HD2      PHE  76  -9.645  -0.467   5.593
  601    HE1  PHE  76           HE1      PHE  76  -6.979   1.237   9.414
  602    HE2  PHE  76           HE2      PHE  76 -10.577  -0.550   7.889
  603    HZ   PHE  76           HZ       PHE  76  -9.245   0.302   9.800
  604    H    VAL  77           HN       VAL  77  -5.069   0.332   2.454
  605    HA   VAL  77           HA       VAL  77  -6.368  -1.728   0.860
  606    HB   VAL  77           HB       VAL  77  -4.245   0.340   0.231
  607   1HG1  VAL  77          HG11      VAL  77  -5.204  -1.989  -1.309
  608   2HG1  VAL  77          HG13      VAL  77  -5.263  -0.458  -2.183
  609   3HG1  VAL  77          HG12      VAL  77  -3.736  -1.031  -1.512
  610   1HG2  VAL  77          HG23      VAL  77  -6.977   0.575   0.600
  611   2HG2  VAL  77          HG22      VAL  77  -5.983   1.685  -0.343
  612   3HG2  VAL  77          HG21      VAL  77  -6.843   0.372  -1.147
  613    H    SER  78           HN       SER  78  -3.204  -1.338   2.354
  614    HA   SER  78           HA       SER  78  -1.999  -3.528   0.841
  615   1HB   SER  78           HB2      SER  78  -0.267  -3.299   2.799
  616   2HB   SER  78           HB1      SER  78  -0.393  -2.014   1.600
  617    HG   SER  78           HG       SER  78  -0.443  -1.258   3.790
  618    H    MET  79           HN       MET  79  -3.588  -3.179   3.975
  619    HA   MET  79           HA       MET  79  -2.863  -5.737   5.016
  620   1HB   MET  79           HB2      MET  79  -5.300  -4.012   5.531
  621   2HB   MET  79           HB1      MET  79  -4.818  -5.389   6.512
  622   1HG   MET  79           HG2      MET  79  -2.592  -3.571   6.090
  623   2HG   MET  79           HG1      MET  79  -3.962  -2.748   6.834
  624   1HE   MET  79           HE3      MET  79  -3.772  -2.246   8.772
  625   2HE   MET  79           HE2      MET  79  -4.805  -3.432   9.562
  626   3HE   MET  79           HE1      MET  79  -3.197  -3.110  10.203
  627    H    VAL  80           HN       VAL  80  -5.680  -4.671   3.106
  628    HA   VAL  80           HA       VAL  80  -6.835  -7.346   3.110
  629    HB   VAL  80           HB       VAL  80  -8.400  -6.270   1.412
  630   1HG1  VAL  80          HG13      VAL  80  -7.995  -5.656   4.267
  631   2HG1  VAL  80          HG12      VAL  80  -9.039  -4.518   3.416
  632   3HG1  VAL  80          HG11      VAL  80  -9.440  -6.234   3.436
  633   1HG2  VAL  80          HG21      VAL  80  -6.357  -4.309   1.425
  634   2HG2  VAL  80          HG23      VAL  80  -7.903  -4.238   0.583
  635   3HG2  VAL  80          HG22      VAL  80  -7.755  -3.578   2.210
  636    H    THR  81           HN       THR  81  -5.017  -5.378   0.757
  637    HA   THR  81           HA       THR  81  -5.366  -7.152  -1.456
  638    HB   THR  81           HB       THR  81  -2.948  -5.415  -0.885
  639    HG1  THR  81           HG1      THR  81  -5.052  -4.583  -2.499
  640   1HG2  THR  81          HG23      THR  81  -3.365  -7.223  -2.909
  641   2HG2  THR  81          HG22      THR  81  -3.985  -5.736  -3.622
  642   3HG2  THR  81          HG21      THR  81  -2.323  -5.804  -3.032
  643    H    THR  82           HN       THR  82  -3.687  -7.585   1.455
  644    HA   THR  82           HA       THR  82  -1.977  -9.710   0.233
  645    HB   THR  82           HB       THR  82  -1.666  -7.917   2.624
  646    HG1  THR  82           HG1      THR  82   0.281  -8.913   0.851
  647   1HG2  THR  82          HG21      THR  82  -1.019 -10.763   2.593
  648   2HG2  THR  82          HG23      THR  82   0.411  -9.763   2.831
  649   3HG2  THR  82          HG22      THR  82  -0.961  -9.618   3.929
  650    H    ALA  83           HN       ALA  83  -4.510  -9.031   2.543
  651    HA   ALA  83           HA       ALA  83  -4.376 -11.520   3.976
  652   1HB   ALA  83           HB3      ALA  83  -6.298  -9.276   3.713
  653   2HB   ALA  83           HB2      ALA  83  -6.978 -10.820   4.227
  654   3HB   ALA  83           HB1      ALA  83  -5.683 -10.070   5.162
  655    H    CYS  84           HN       CYS  84  -6.479 -10.474   1.270
  656    HA   CYS  84           HA       CYS  84  -8.099 -12.654   0.928
  657   1HB   CYS  84           HB2      CYS  84  -7.731 -10.585  -0.622
  658   2HB   CYS  84           HB1      CYS  84  -6.635 -11.656  -1.497
  659    HG   CYS  84           HG       CYS  84  -9.126 -13.200  -1.128
  660    H    HIS  85           HN       HIS  85  -5.086 -12.584  -1.014
  661    HA   HIS  85           HA       HIS  85  -5.107 -15.540  -0.960
  662   1HB   HIS  85           HB2      HIS  85  -3.269 -15.318  -2.641
  663   2HB   HIS  85           HB1      HIS  85  -4.750 -14.494  -3.125
  664    HD1  HIS  85           HD1      HIS  85  -2.675 -13.232  -4.590
  665    HD2  HIS  85           HD2      HIS  85  -3.136 -12.254  -0.564
  666    HE1  HIS  85           HE1      HIS  85  -1.514 -11.009  -4.257
  667    H    GLU  86           HN       GLU  86  -2.975 -16.671  -0.609
  668    HA   GLU  86           HA       GLU  86  -1.799 -15.747   1.895
  669   1HB   GLU  86           HB2      GLU  86  -2.211 -18.196   1.139
  670   2HB   GLU  86           HB1      GLU  86  -0.723 -18.005   0.211
  671   1HG   GLU  86           HG2      GLU  86  -0.823 -17.274   3.133
  672   2HG   GLU  86           HG1      GLU  86  -0.534 -18.940   2.625
  673    H    PHE  87           HN       PHE  87  -0.865 -15.801  -1.507
  674    HA   PHE  87           HA       PHE  87   1.294 -13.904  -0.886
  675   1HB   PHE  87           HB2      PHE  87   1.920 -16.618  -1.043
  676   2HB   PHE  87           HB1      PHE  87   2.361 -15.980  -2.626
  677    HD1  PHE  87           HD2      PHE  87   3.212 -13.279  -2.141
  678    HD2  PHE  87           HD1      PHE  87   3.860 -16.770   0.268
  679    HE1  PHE  87           HE2      PHE  87   5.247 -12.237  -1.186
  680    HE2  PHE  87           HE1      PHE  87   5.892 -15.723   1.234
  681    HZ   PHE  87           HZ       PHE  87   6.585 -13.456   0.507
  682    H    PHE  88           HN       PHE  88   0.938 -15.991  -3.760
  683    HA   PHE  88           HA       PHE  88  -0.264 -13.732  -5.246
  684   1HB   PHE  88           HB2      PHE  88   2.278 -15.083  -6.202
  685   2HB   PHE  88           HB1      PHE  88   1.447 -13.725  -6.957
  686    HD1  PHE  88           HD2      PHE  88   0.939 -11.738  -5.126
  687    HD2  PHE  88           HD1      PHE  88   4.199 -14.529  -5.025
  688    HE1  PHE  88           HE2      PHE  88   2.248 -10.160  -3.730
  689    HE2  PHE  88           HE1      PHE  88   5.509 -12.951  -3.633
  690    HZ   PHE  88           HZ       PHE  88   4.534 -10.766  -2.985
  691    H    GLU  89           HN       GLU  89  -2.087 -15.143  -5.457
  692    HA   GLU  89           HA       GLU  89  -1.761 -17.803  -6.599
  693   1HB   GLU  89           HB2      GLU  89  -4.331 -16.214  -6.475
  694   2HB   GLU  89           HB1      GLU  89  -4.130 -17.965  -6.484
  695   1HG   GLU  89           HG2      GLU  89  -2.928 -16.307  -4.279
  696   2HG   GLU  89           HG1      GLU  89  -4.620 -16.802  -4.212
  697    H    HIS  90           HN       HIS  90  -1.313 -14.868  -7.961
  698    HA   HIS  90           HA       HIS  90  -2.856 -14.892 -10.345
  699   1HB   HIS  90           HB2      HIS  90  -0.963 -13.224  -9.294
  700   2HB   HIS  90           HB1      HIS  90  -0.053 -13.975 -10.606
  701    HD1  HIS  90           HD1      HIS  90  -1.089 -10.962 -10.609
  702    HD2  HIS  90           HD2      HIS  90  -2.923 -14.165 -12.545
  703    HE1  HIS  90           HE1      HIS  90  -2.484  -9.968 -12.474
  704    H    GLU  91           HN       GLU  91  -0.086 -16.781  -9.370
  705    HA   GLU  91           HA       GLU  91   0.241 -17.819 -12.139
  706   1HB   GLU  91           HB2      GLU  91   2.321 -17.211 -11.051
  707   2HB   GLU  91           HB1      GLU  91   1.905 -18.166  -9.629
  708   1HG   GLU  91           HG2      GLU  91   1.669 -19.947 -11.782
  709   2HG   GLU  91           HG1      GLU  91   3.138 -19.027 -12.113
  710   1H    MET   0           HT3      MET   0 -10.796  -3.758 -14.037
  711   2H    MET   0           HT2      MET   0  -9.593  -4.662 -14.827
  712   3H    MET   0           HT1      MET   0  -9.236  -3.850 -13.377
  713    HA   MET   0           HA       MET   0  -8.320  -2.634 -15.232
  714   1HB   MET   0           HB2      MET   0  -9.930  -1.650 -16.881
  715   2HB   MET   0           HB1      MET   0  -9.835  -3.408 -16.974
  716   1HG   MET   0           HG2      MET   0 -11.974  -3.691 -16.245
  717   2HG   MET   0           HG1      MET   0 -11.849  -2.378 -15.074
  718   1HE   MET   0           HE3      MET   0 -14.048  -2.222 -15.482
  719   2HE   MET   0           HE2      MET   0 -14.438  -0.627 -16.118
  720   3HE   MET   0           HE1      MET   0 -14.876  -2.066 -17.037
  721    H    SER   1           HN       SER   1  -8.565  -1.917 -12.715
  722    HA   SER   1           HA       SER   1  -9.986   0.708 -12.820
  723   1HB   SER   1           HB2      SER   1 -10.772   0.459 -10.599
  724   2HB   SER   1           HB1      SER   1 -11.088  -1.102 -11.350
  725    HG   SER   1           HG       SER   1  -8.981  -1.724 -10.480
  726    H    GLU   2           HN       GLU   2  -9.101   1.981 -10.690
  727    HA   GLU   2           HA       GLU   2  -6.241   2.314 -11.211
  728   1HB   GLU   2           HB2      GLU   2  -7.832   3.663  -9.028
  729   2HB   GLU   2           HB1      GLU   2  -6.404   4.269  -9.867
  730   1HG   GLU   2           HG2      GLU   2  -9.157   3.848 -11.066
  731   2HG   GLU   2           HG1      GLU   2  -8.389   5.399 -10.725
  732    H    LEU   3           HN       LEU   3  -8.253   1.198  -8.504
  733    HA   LEU   3           HA       LEU   3  -6.059   0.822  -6.675
  734   1HB   LEU   3           HB2      LEU   3  -8.724   0.863  -6.364
  735   2HB   LEU   3           HB1      LEU   3  -8.489  -0.880  -6.442
  736    HG   LEU   3           HG       LEU   3  -6.718  -0.665  -4.682
  737   1HD1  LEU   3          HD11      LEU   3  -7.573   2.201  -4.919
  738   2HD1  LEU   3          HD13      LEU   3  -7.047   1.589  -3.351
  739   3HD1  LEU   3          HD12      LEU   3  -5.952   1.533  -4.732
  740   1HD2  LEU   3          HD22      LEU   3  -9.575  -0.425  -4.419
  741   2HD2  LEU   3          HD21      LEU   3  -8.439  -1.238  -3.343
  742   3HD2  LEU   3          HD23      LEU   3  -8.800   0.473  -3.113
  743    H    GLU   4           HN       GLU   4  -7.717  -1.366  -8.941
  744    HA   GLU   4           HA       GLU   4  -6.249  -3.698  -8.045
  745   1HB   GLU   4           HB2      GLU   4  -7.567  -3.337 -10.743
  746   2HB   GLU   4           HB1      GLU   4  -7.261  -4.847  -9.886
  747   1HG   GLU   4           HG2      GLU   4  -8.866  -4.299  -8.180
  748   2HG   GLU   4           HG1      GLU   4  -9.042  -2.658  -8.798
  749    H    LYS   5           HN       LYS   5  -6.063  -2.074 -11.239
  750    HA   LYS   5           HA       LYS   5  -3.674  -3.310 -12.052
  751   1HB   LYS   5           HB2      LYS   5  -5.305  -1.153 -12.967
  752   2HB   LYS   5           HB1      LYS   5  -3.625  -0.613 -12.995
  753   1HG   LYS   5           HG2      LYS   5  -3.013  -2.148 -14.588
  754   2HG   LYS   5           HG1      LYS   5  -4.156  -3.359 -14.010
  755   1HD   LYS   5           HD2      LYS   5  -5.890  -2.534 -15.279
  756   2HD   LYS   5           HD1      LYS   5  -5.296  -0.876 -15.200
  757   1HE   LYS   5           HE2      LYS   5  -3.290  -2.233 -16.579
  758   2HE   LYS   5           HE1      LYS   5  -4.784  -2.926 -17.213
  759   1HZ   LYS   5           HZ3      LYS   5  -5.507  -0.445 -17.292
  760   2HZ   LYS   5           HZ2      LYS   5  -3.833  -0.149 -17.306
  761   3HZ   LYS   5           HZ1      LYS   5  -4.543  -1.090 -18.531
  762    H    ALA   6           HN       ALA   6  -4.117  -0.505  -9.948
  763    HA   ALA   6           HA       ALA   6  -1.253   0.089  -9.893
  764   1HB   ALA   6           HB2      ALA   6  -3.053   1.824  -9.587
  765   2HB   ALA   6           HB1      ALA   6  -3.408   1.097  -8.020
  766   3HB   ALA   6           HB3      ALA   6  -1.829   1.825  -8.318
  767    H    MET   7           HN       MET   7  -3.450  -0.678  -7.177
  768    HA   MET   7           HA       MET   7  -1.452  -1.398  -5.355
  769   1HB   MET   7           HB2      MET   7  -3.805  -1.154  -4.696
  770   2HB   MET   7           HB1      MET   7  -4.225  -2.598  -5.620
  771   1HG   MET   7           HG2      MET   7  -3.907  -2.991  -3.141
  772   2HG   MET   7           HG1      MET   7  -2.907  -4.003  -4.185
  773   1HE   MET   7           HE2      MET   7  -3.007  -3.284  -1.353
  774   2HE   MET   7           HE1      MET   7  -1.302  -3.450  -0.945
  775   3HE   MET   7           HE3      MET   7  -2.113  -1.890  -0.754
  776    H    VAL   8           HN       VAL   8  -3.289  -3.606  -7.465
  777    HA   VAL   8           HA       VAL   8  -1.931  -5.975  -6.780
  778    HB   VAL   8           HB       VAL   8  -2.851  -5.328  -9.590
  779   1HG1  VAL   8          HG13      VAL   8  -1.646  -7.471  -9.183
  780   2HG1  VAL   8          HG12      VAL   8  -2.847  -7.885  -7.960
  781   3HG1  VAL   8          HG11      VAL   8  -3.328  -7.727  -9.649
  782   1HG2  VAL   8          HG23      VAL   8  -4.401  -5.049  -7.286
  783   2HG2  VAL   8          HG22      VAL   8  -5.017  -5.295  -8.919
  784   3HG2  VAL   8          HG21      VAL   8  -4.778  -6.675  -7.850
  785    H    ALA   9           HN       ALA   9  -0.925  -3.327  -8.888
  786    HA   ALA   9           HA       ALA   9   1.279  -4.721 -10.122
  787   1HB   ALA   9           HB3      ALA   9   0.585  -1.821  -9.704
  788   2HB   ALA   9           HB2      ALA   9   2.164  -2.274 -10.347
  789   3HB   ALA   9           HB1      ALA   9   0.696  -2.726 -11.213
  790    H    LEU  10           HN       LEU  10   1.015  -2.695  -7.200
  791    HA   LEU  10           HA       LEU  10   3.725  -2.589  -6.460
  792   1HB   LEU  10           HB2      LEU  10   1.182  -2.213  -5.165
  793   2HB   LEU  10           HB1      LEU  10   2.235  -3.141  -4.099
  794    HG   LEU  10           HG       LEU  10   3.361  -0.743  -5.498
  795   1HD1  LEU  10          HD13      LEU  10   1.459  -0.732  -3.150
  796   2HD1  LEU  10          HD12      LEU  10   2.636   0.557  -3.397
  797   3HD1  LEU  10          HD11      LEU  10   1.394   0.253  -4.611
  798   1HD2  LEU  10          HD23      LEU  10   4.794  -2.256  -4.152
  799   2HD2  LEU  10          HD22      LEU  10   4.709  -0.645  -3.441
  800   3HD2  LEU  10          HD21      LEU  10   3.766  -1.964  -2.750
  801    H    ILE  11           HN       ILE  11   1.339  -5.148  -5.702
  802    HA   ILE  11           HA       ILE  11   3.004  -6.900  -4.288
  803    HB   ILE  11           HB       ILE  11   0.622  -7.224  -6.060
  804   1HG1  ILE  11          HG12      ILE  11   1.374  -8.122  -3.264
  805   2HG1  ILE  11          HG11      ILE  11   0.352  -6.749  -3.686
  806   1HG2  ILE  11          HG22      ILE  11   2.633  -9.367  -5.569
  807   2HG2  ILE  11          HG21      ILE  11   0.938  -9.808  -5.366
  808   3HG2  ILE  11          HG23      ILE  11   1.504  -9.171  -6.909
  809   1HD1  ILE  11          HD12      ILE  11  -0.349  -9.520  -4.635
  810   2HD1  ILE  11          HD11      ILE  11  -0.801  -8.987  -3.017
  811   3HD1  ILE  11          HD13      ILE  11  -1.405  -8.123  -4.429
  812    H    ASP  12           HN       ASP  12   2.705  -6.431  -7.790
  813    HA   ASP  12           HA       ASP  12   4.376  -8.492  -8.711
  814   1HB   ASP  12           HB2      ASP  12   3.066  -6.723 -10.054
  815   2HB   ASP  12           HB1      ASP  12   4.476  -5.690  -9.838
  816    H    VAL  13           HN       VAL  13   5.330  -5.166  -7.800
  817    HA   VAL  13           HA       VAL  13   8.089  -5.337  -8.135
  818    HB   VAL  13           HB       VAL  13   6.642  -4.079  -5.776
  819   1HG1  VAL  13          HG13      VAL  13   9.287  -4.509  -5.874
  820   2HG1  VAL  13          HG12      VAL  13   9.227  -3.057  -6.872
  821   3HG1  VAL  13          HG11      VAL  13   8.615  -3.017  -5.218
  822   1HG2  VAL  13          HG23      VAL  13   6.441  -3.473  -8.479
  823   2HG2  VAL  13          HG22      VAL  13   6.078  -2.373  -7.148
  824   3HG2  VAL  13          HG21      VAL  13   7.674  -2.352  -7.900
  825    H    PHE  14           HN       PHE  14   6.166  -6.591  -5.411
  826    HA   PHE  14           HA       PHE  14   8.419  -7.518  -3.889
  827   1HB   PHE  14           HB2      PHE  14   6.053  -7.246  -3.025
  828   2HB   PHE  14           HB1      PHE  14   5.634  -8.717  -3.904
  829    HD1  PHE  14           HD1      PHE  14   6.720 -10.882  -3.317
  830    HD2  PHE  14           HD2      PHE  14   7.343  -7.322  -0.997
  831    HE1  PHE  14           HE1      PHE  14   7.616 -12.252  -1.457
  832    HE2  PHE  14           HE2      PHE  14   8.238  -8.693   0.865
  833    HZ   PHE  14           HZ       PHE  14   8.375 -11.157   0.635
  834    H    HIS  15           HN       HIS  15   6.351  -9.069  -6.331
  835    HA   HIS  15           HA       HIS  15   7.927 -11.553  -6.180
  836   1HB   HIS  15           HB2      HIS  15   5.470 -11.619  -6.578
  837   2HB   HIS  15           HB1      HIS  15   5.712 -10.751  -8.093
  838    HD1  HIS  15           HD1      HIS  15   5.858 -12.256 -10.062
  839    HD2  HIS  15           HD2      HIS  15   7.250 -14.133  -6.613
  840    HE1  HIS  15           HE1      HIS  15   6.510 -14.606 -10.741
  841    H    GLN  16           HN       GLN  16   8.724  -8.685  -7.316
  842    HA   GLN  16           HA       GLN  16   9.798  -9.667  -9.921
  843   1HB   GLN  16           HB2      GLN  16   8.918  -7.029  -8.891
  844   2HB   GLN  16           HB1      GLN  16  10.350  -7.007  -9.918
  845   1HG   GLN  16           HG2      GLN  16   7.817  -8.469 -10.694
  846   2HG   GLN  16           HG1      GLN  16   8.111  -6.784 -11.127
  847   1HE2  GLN  16          HE22      GLN  16  10.290  -7.596 -13.772
  848   2HE2  GLN  16          HE21      GLN  16   9.427  -6.392 -12.942
  849    H    TYR  17           HN       TYR  17  10.739  -7.897  -6.969
  850    HA   TYR  17           HA       TYR  17  13.580  -8.053  -7.677
  851   1HB   TYR  17           HB2      TYR  17  12.045  -7.020  -5.292
  852   2HB   TYR  17           HB1      TYR  17  13.804  -7.149  -5.263
  853    HD1  TYR  17           HD2      TYR  17  11.068  -5.884  -7.501
  854    HD2  TYR  17           HD1      TYR  17  15.052  -5.322  -5.997
  855    HE1  TYR  17           HE2      TYR  17  11.245  -3.755  -8.761
  856    HE2  TYR  17           HE1      TYR  17  15.229  -3.194  -7.256
  857    HH   TYR  17           HH       TYR  17  13.525  -2.364  -9.709
  858    H    SER  18           HN       SER  18  11.296  -9.816  -5.665
  859    HA   SER  18           HA       SER  18  13.428 -11.372  -4.371
  860   1HB   SER  18           HB2      SER  18  11.131 -10.737  -3.346
  861   2HB   SER  18           HB1      SER  18  10.487 -12.049  -4.329
  862    HG   SER  18           HG       SER  18  11.103 -12.776  -2.260
  863    H    GLY  19           HN       GLY  19  12.252 -11.389  -7.418
  864   1HA   GLY  19           HA2      GLY  19  12.039 -14.324  -7.682
  865   2HA   GLY  19           HA1      GLY  19  11.707 -13.155  -8.955
  866    H    ARG  20           HN       ARG  20  13.853 -11.724  -9.365
  867    HA   ARG  20           HA       ARG  20  15.732 -13.422 -10.623
  868   1HB   ARG  20           HB2      ARG  20  17.238 -11.322 -10.516
  869   2HB   ARG  20           HB1      ARG  20  15.695 -11.173 -11.358
  870   1HG   ARG  20           HG2      ARG  20  14.816  -9.780  -9.775
  871   2HG   ARG  20           HG1      ARG  20  15.613 -10.624  -8.447
  872   1HD   ARG  20           HD2      ARG  20  17.187  -9.017  -8.390
  873   2HD   ARG  20           HD1      ARG  20  17.655  -9.436 -10.039
  874    HE   ARG  20           HE       ARG  20  15.768  -7.818 -10.729
  875   1HH1  ARG  20          HH21      ARG  20  16.215  -7.656  -7.427
  876   2HH1  ARG  20          HH22      ARG  20  16.533  -5.954  -7.368
  877   1HH2  ARG  20          HH11      ARG  20  16.730  -5.601 -10.810
  878   2HH2  ARG  20          HH12      ARG  20  16.825  -4.791  -9.282
  879    H    GLU  21           HN       GLU  21  15.433 -12.521  -7.303
  880    HA   GLU  21           HA       GLU  21  18.195 -12.941  -6.542
  881   1HB   GLU  21           HB2      GLU  21  15.678 -12.325  -5.228
  882   2HB   GLU  21           HB1      GLU  21  16.579 -13.542  -4.325
  883   1HG   GLU  21           HG2      GLU  21  17.915 -11.040  -5.356
  884   2HG   GLU  21           HG1      GLU  21  17.095 -11.072  -3.794
  885    H    GLY  22           HN       GLY  22  18.055 -14.796  -4.466
  886   1HA   GLY  22           HA2      GLY  22  18.002 -17.299  -6.002
  887   2HA   GLY  22           HA1      GLY  22  18.594 -17.111  -4.353
  888    H    ASP  23           HN       ASP  23  16.276 -15.808  -3.300
  889    HA   ASP  23           HA       ASP  23  14.593 -18.151  -2.854
  890   1HB   ASP  23           HB2      ASP  23  13.765 -15.456  -1.879
  891   2HB   ASP  23           HB1      ASP  23  13.774 -17.002  -1.037
  892    H    LYS  24           HN       LYS  24  12.044 -17.310  -2.710
  893    HA   LYS  24           HA       LYS  24  11.327 -15.782  -5.121
  894   1HB   LYS  24           HB2      LYS  24  11.756 -18.221  -5.809
  895   2HB   LYS  24           HB1      LYS  24  10.316 -18.619  -4.869
  896   1HG   LYS  24           HG2      LYS  24   8.997 -17.022  -6.217
  897   2HG   LYS  24           HG1      LYS  24  10.434 -16.648  -7.169
  898   1HD   LYS  24           HD2      LYS  24  10.497 -18.789  -8.146
  899   2HD   LYS  24           HD1      LYS  24   9.471 -19.489  -6.892
  900   1HE   LYS  24           HE2      LYS  24   7.519 -18.570  -7.783
  901   2HE   LYS  24           HE1      LYS  24   8.389 -17.289  -8.626
  902   1HZ   LYS  24           HZ1      LYS  24   9.431 -19.418  -9.804
  903   2HZ   LYS  24           HZ3      LYS  24   7.899 -20.042  -9.428
  904   3HZ   LYS  24           HZ2      LYS  24   8.033 -18.639 -10.375
  905    H    HIS  25           HN       HIS  25  10.876 -16.037  -2.039
  906    HA   HIS  25           HA       HIS  25   8.044 -15.252  -2.171
  907   1HB   HIS  25           HB2      HIS  25   8.789 -17.914  -1.458
  908   2HB   HIS  25           HB1      HIS  25   8.218 -17.104  -0.001
  909    HD1  HIS  25           HD1      HIS  25   6.839 -16.055  -3.316
  910    HD2  HIS  25           HD2      HIS  25   5.721 -18.514  -0.142
  911    HE1  HIS  25           HE1      HIS  25   4.394 -16.609  -3.663
  912    H    LYS  26           HN       LYS  26  10.929 -14.409  -1.190
  913    HA   LYS  26           HA       LYS  26   9.895 -13.013   1.204
  914   1HB   LYS  26           HB2      LYS  26  11.889 -13.684   2.547
  915   2HB   LYS  26           HB1      LYS  26  10.845 -15.052   2.160
  916   1HG   LYS  26           HG2      LYS  26  12.646 -14.822  -0.001
  917   2HG   LYS  26           HG1      LYS  26  13.618 -14.637   1.459
  918   1HD   LYS  26           HD2      LYS  26  13.472 -17.004   0.898
  919   2HD   LYS  26           HD1      LYS  26  12.558 -16.705   2.375
  920   1HE   LYS  26           HE2      LYS  26  10.503 -16.975   1.326
  921   2HE   LYS  26           HE1      LYS  26  11.140 -16.534  -0.259
  922   1HZ   LYS  26           HZ2      LYS  26  12.446 -18.637  -0.177
  923   2HZ   LYS  26           HZ1      LYS  26  11.570 -19.069   1.213
  924   3HZ   LYS  26           HZ3      LYS  26  10.763 -18.858  -0.263
  925    H    LEU  27           HN       LEU  27  10.683 -10.949   1.234
  926    HA   LEU  27           HA       LEU  27  12.721 -10.233  -0.788
  927   1HB   LEU  27           HB2      LEU  27  10.454  -8.925   0.385
  928   2HB   LEU  27           HB1      LEU  27  11.893  -7.958   0.712
  929    HG   LEU  27           HG       LEU  27  11.375  -9.073  -2.039
  930   1HD1  LEU  27          HD13      LEU  27   9.595  -7.374  -0.782
  931   2HD1  LEU  27          HD12      LEU  27  10.668  -6.253  -1.621
  932   3HD1  LEU  27          HD11      LEU  27   9.815  -7.502  -2.527
  933   1HD2  LEU  27          HD22      LEU  27  13.013  -6.826  -0.846
  934   2HD2  LEU  27          HD21      LEU  27  13.587  -8.221  -1.759
  935   3HD2  LEU  27          HD23      LEU  27  12.697  -6.936  -2.577
  936    H    LYS  28           HN       LYS  28  13.759  -7.931   0.579
  937    HA   LYS  28           HA       LYS  28  15.027  -9.036   3.019
  938   1HB   LYS  28           HB2      LYS  28  16.436  -8.388   0.445
  939   2HB   LYS  28           HB1      LYS  28  17.270  -8.144   1.979
  940   1HG   LYS  28           HG2      LYS  28  16.518 -10.551   2.549
  941   2HG   LYS  28           HG1      LYS  28  16.192 -10.712   0.823
  942   1HD   LYS  28           HD2      LYS  28  18.850  -9.934   2.062
  943   2HD   LYS  28           HD1      LYS  28  18.467 -11.492   1.329
  944   1HE   LYS  28           HE2      LYS  28  17.742  -9.731  -0.656
  945   2HE   LYS  28           HE1      LYS  28  19.152  -8.936   0.045
  946   1HZ   LYS  28           HZ1      LYS  28  19.169 -11.811  -0.638
  947   2HZ   LYS  28           HZ3      LYS  28  19.554 -10.626  -1.788
  948   3HZ   LYS  28           HZ2      LYS  28  20.493 -10.776  -0.380
  949    H    LYS  29           HN       LYS  29  16.133  -7.345   4.265
  950    HA   LYS  29           HA       LYS  29  14.714  -4.825   4.172
  951   1HB   LYS  29           HB2      LYS  29  17.235  -5.470   5.725
  952   2HB   LYS  29           HB1      LYS  29  16.049  -4.216   6.091
  953   1HG   LYS  29           HG2      LYS  29  14.358  -5.857   6.597
  954   2HG   LYS  29           HG1      LYS  29  15.381  -7.168   6.011
  955   1HD   LYS  29           HD2      LYS  29  15.991  -7.389   8.186
  956   2HD   LYS  29           HD1      LYS  29  17.011  -5.982   7.874
  957   1HE   LYS  29           HE2      LYS  29  15.848  -4.956   9.521
  958   2HE   LYS  29           HE1      LYS  29  14.521  -4.863   8.365
  959   1HZ   LYS  29           HZ1      LYS  29  14.961  -7.257  10.041
  960   2HZ   LYS  29           HZ3      LYS  29  14.041  -5.942  10.591
  961   3HZ   LYS  29           HZ2      LYS  29  13.555  -6.797   9.206
  962    H    SER  30           HN       SER  30  17.760  -5.992   2.914
  963    HA   SER  30           HA       SER  30  18.813  -3.310   2.384
  964   1HB   SER  30           HB2      SER  30  20.206  -5.437   2.750
  965   2HB   SER  30           HB1      SER  30  19.748  -5.888   1.111
  966    HG   SER  30           HG       SER  30  20.515  -3.600   0.657
  967    H    GLU  31           HN       GLU  31  17.097  -5.828   0.570
  968    HA   GLU  31           HA       GLU  31  17.272  -4.302  -1.930
  969   1HB   GLU  31           HB2      GLU  31  17.125  -6.861  -1.766
  970   2HB   GLU  31           HB1      GLU  31  15.425  -6.635  -1.349
  971   1HG   GLU  31           HG2      GLU  31  14.917  -6.397  -3.523
  972   2HG   GLU  31           HG1      GLU  31  15.998  -5.006  -3.625
  973    H    LEU  32           HN       LEU  32  15.291  -4.420   0.864
  974    HA   LEU  32           HA       LEU  32  12.911  -3.282  -0.421
  975   1HB   LEU  32           HB2      LEU  32  12.539  -4.609   1.569
  976   2HB   LEU  32           HB1      LEU  32  13.718  -3.662   2.479
  977    HG   LEU  32           HG       LEU  32  12.319  -1.707   2.413
  978   1HD1  LEU  32          HD11      LEU  32  10.760  -3.328   0.405
  979   2HD1  LEU  32          HD13      LEU  32  10.008  -1.985   1.265
  980   3HD1  LEU  32          HD12      LEU  32  11.412  -1.698   0.235
  981   1HD2  LEU  32          HD22      LEU  32  11.400  -4.230   3.470
  982   2HD2  LEU  32          HD21      LEU  32  11.198  -2.614   4.146
  983   3HD2  LEU  32          HD23      LEU  32  10.014  -3.246   3.002
  984    H    LYS  33           HN       LYS  33  15.589  -2.197   1.634
  985    HA   LYS  33           HA       LYS  33  14.880   0.534   1.907
  986   1HB   LYS  33           HB2      LYS  33  16.882  -0.890   2.884
  987   2HB   LYS  33           HB1      LYS  33  17.740  -0.278   1.475
  988   1HG   LYS  33           HG2      LYS  33  17.371   2.002   2.132
  989   2HG   LYS  33           HG1      LYS  33  16.244   1.517   3.400
  990   1HD   LYS  33           HD2      LYS  33  18.427   2.040   4.386
  991   2HD   LYS  33           HD1      LYS  33  18.095   0.315   4.548
  992   1HE   LYS  33           HE2      LYS  33  20.436   0.867   3.742
  993   2HE   LYS  33           HE1      LYS  33  19.528  -0.215   2.686
  994   1HZ   LYS  33           HZ1      LYS  33  19.201   2.616   2.160
  995   2HZ   LYS  33           HZ3      LYS  33  20.748   1.999   1.845
  996   3HZ   LYS  33           HZ2      LYS  33  19.392   1.322   1.077
  997    H    GLU  34           HN       GLU  34  16.557  -1.203  -0.662
  998    HA   GLU  34           HA       GLU  34  17.073   1.201  -2.229
  999   1HB   GLU  34           HB2      GLU  34  18.146  -0.235  -3.748
 1000   2HB   GLU  34           HB1      GLU  34  18.323  -1.115  -2.232
 1001   1HG   GLU  34           HG2      GLU  34  16.510  -2.583  -2.758
 1002   2HG   GLU  34           HG1      GLU  34  16.031  -1.608  -4.143
 1003    H    LEU  35           HN       LEU  35  14.734  -1.417  -2.213
 1004    HA   LEU  35           HA       LEU  35  13.316  -0.962  -4.576
 1005   1HB   LEU  35           HB2      LEU  35  12.927  -2.476  -2.295
 1006   2HB   LEU  35           HB1      LEU  35  11.564  -1.353  -2.249
 1007    HG   LEU  35           HG       LEU  35  10.941  -3.354  -3.514
 1008   1HD1  LEU  35          HD13      LEU  35  11.327  -0.783  -5.038
 1009   2HD1  LEU  35          HD12      LEU  35  10.560  -2.176  -5.800
 1010   3HD1  LEU  35          HD11      LEU  35   9.841  -1.453  -4.362
 1011   1HD2  LEU  35          HD23      LEU  35  13.629  -3.086  -4.485
 1012   2HD2  LEU  35          HD22      LEU  35  12.498  -4.415  -4.748
 1013   3HD2  LEU  35          HD21      LEU  35  12.527  -3.049  -5.862
 1014    H    ILE  36           HN       ILE  36  12.891   0.688  -1.443
 1015    HA   ILE  36           HA       ILE  36  10.907   2.529  -2.549
 1016    HB   ILE  36           HB       ILE  36  12.269   3.132   0.026
 1017   1HG1  ILE  36          HG12      ILE  36  10.786   0.578  -0.568
 1018   2HG1  ILE  36          HG11      ILE  36  12.227   0.824   0.411
 1019   1HG2  ILE  36          HG21      ILE  36   9.378   2.954  -0.878
 1020   2HG2  ILE  36          HG23      ILE  36   9.914   3.526   0.701
 1021   3HG2  ILE  36          HG22      ILE  36  10.338   4.428  -0.753
 1022   1HD1  ILE  36          HD13      ILE  36  10.584   2.280   1.893
 1023   2HD1  ILE  36          HD12      ILE  36   9.356   1.267   1.134
 1024   3HD1  ILE  36          HD11      ILE  36  10.647   0.528   2.081
 1025    H    ASN  37           HN       ASN  37  14.193   2.964  -1.192
 1026    HA   ASN  37           HA       ASN  37  14.369   5.720  -2.021
 1027   1HB   ASN  37           HB2      ASN  37  15.670   4.565  -0.156
 1028   2HB   ASN  37           HB1      ASN  37  16.695   3.898  -1.427
 1029   1HD2  ASN  37          HD22      ASN  37  18.655   6.824  -1.261
 1030   2HD2  ASN  37          HD21      ASN  37  18.606   5.128  -1.203
 1031    H    ASN  38           HN       ASN  38  14.333   3.071  -3.973
 1032    HA   ASN  38           HA       ASN  38  16.330   4.261  -5.853
 1033   1HB   ASN  38           HB2      ASN  38  16.661   1.849  -5.143
 1034   2HB   ASN  38           HB1      ASN  38  15.162   1.471  -5.992
 1035   1HD2  ASN  38          HD22      ASN  38  16.581   2.055  -9.250
 1036   2HD2  ASN  38          HD21      ASN  38  15.123   2.139  -8.384
 1037    H    GLU  39           HN       GLU  39  13.130   2.654  -5.806
 1038    HA   GLU  39           HA       GLU  39  12.297   4.525  -7.957
 1039   1HB   GLU  39           HB2      GLU  39  11.057   2.444  -8.953
 1040   2HB   GLU  39           HB1      GLU  39  12.765   2.684  -9.323
 1041   1HG   GLU  39           HG2      GLU  39  13.325   0.763  -8.294
 1042   2HG   GLU  39           HG1      GLU  39  12.456   1.234  -6.833
 1043    H    LEU  40           HN       LEU  40  11.642   4.638  -5.204
 1044    HA   LEU  40           HA       LEU  40   9.188   3.332  -4.545
 1045   1HB   LEU  40           HB2      LEU  40  10.205   4.328  -2.699
 1046   2HB   LEU  40           HB1      LEU  40  10.617   5.792  -3.586
 1047    HG   LEU  40           HG       LEU  40   8.411   6.642  -3.429
 1048   1HD1  LEU  40          HD11      LEU  40   7.700   3.850  -3.420
 1049   2HD1  LEU  40          HD13      LEU  40   6.920   4.654  -2.059
 1050   3HD1  LEU  40          HD12      LEU  40   6.663   5.249  -3.698
 1051   1HD2  LEU  40          HD21      LEU  40   9.843   6.267  -1.224
 1052   2HD2  LEU  40          HD23      LEU  40   8.211   6.930  -1.139
 1053   3HD2  LEU  40          HD22      LEU  40   8.487   5.223  -0.796
 1054    H    SER  41           HN       SER  41   9.356   6.836  -5.115
 1055    HA   SER  41           HA       SER  41   7.480   6.727  -7.336
 1056   1HB   SER  41           HB2      SER  41   5.825   8.214  -5.903
 1057   2HB   SER  41           HB1      SER  41   5.719   6.457  -5.843
 1058    HG   SER  41           HG       SER  41   5.768   7.317  -3.754
 1059    H    HIS  42           HN       HIS  42  10.023   7.835  -7.075
 1060    HA   HIS  42           HA       HIS  42  11.214   9.850  -7.295
 1061   1HB   HIS  42           HB2      HIS  42   8.840   9.942  -8.904
 1062   2HB   HIS  42           HB1      HIS  42   9.156  11.556  -8.267
 1063    HD1  HIS  42           HD1      HIS  42  11.781   8.970  -9.161
 1064    HD2  HIS  42           HD2      HIS  42  10.431  12.684 -10.483
 1065    HE1  HIS  42           HE1      HIS  42  13.416   9.734 -10.937
 1066    H    PHE  43           HN       PHE  43   9.539   9.353  -4.814
 1067    HA   PHE  43           HA       PHE  43   9.153  12.200  -3.994
 1068   1HB   PHE  43           HB2      PHE  43   7.895   9.612  -3.092
 1069   2HB   PHE  43           HB1      PHE  43   7.853  11.042  -2.063
 1070    HD1  PHE  43           HD2      PHE  43   7.558  13.245  -3.958
 1071    HD2  PHE  43           HD1      PHE  43   5.742   9.352  -3.979
 1072    HE1  PHE  43           HE2      PHE  43   5.656  14.136  -5.280
 1073    HE2  PHE  43           HE1      PHE  43   3.843  10.244  -5.300
 1074    HZ   PHE  43           HZ       PHE  43   3.799  12.635  -5.950
 1075    H    LEU  44           HN       LEU  44  11.132  12.803  -3.164
 1076    HA   LEU  44           HA       LEU  44  11.964  11.803  -0.617
 1077   1HB   LEU  44           HB2      LEU  44  12.973  10.373  -2.930
 1078   2HB   LEU  44           HB1      LEU  44  14.294  11.131  -2.041
 1079    HG   LEU  44           HG       LEU  44  12.448   9.992  -0.161
 1080   1HD1  LEU  44          HD13      LEU  44  13.032   8.372  -2.584
 1081   2HD1  LEU  44          HD12      LEU  44  13.218   7.557  -1.034
 1082   3HD1  LEU  44          HD11      LEU  44  11.670   8.277  -1.469
 1083   1HD2  LEU  44          HD22      LEU  44  15.304   9.423  -0.998
 1084   2HD2  LEU  44          HD21      LEU  44  14.759  10.375   0.382
 1085   3HD2  LEU  44          HD23      LEU  44  14.530   8.627   0.372
 1086    H    GLU  45           HN       GLU  45  12.041  14.078  -0.235
 1087    HA   GLU  45           HA       GLU  45  14.582  15.322  -0.654
 1088   1HB   GLU  45           HB2      GLU  45  13.812  17.174  -2.169
 1089   2HB   GLU  45           HB1      GLU  45  13.892  15.600  -2.961
 1090   1HG   GLU  45           HG2      GLU  45  11.576  15.361  -3.027
 1091   2HG   GLU  45           HG1      GLU  45  11.323  16.455  -1.667
 1092    H    GLU  46           HN       GLU  46  11.142  15.691   0.019
 1093    HA   GLU  46           HA       GLU  46  11.766  18.008   1.788
 1094   1HB   GLU  46           HB2      GLU  46   9.266  17.006   0.454
 1095   2HB   GLU  46           HB1      GLU  46   9.135  17.998   1.905
 1096   1HG   GLU  46           HG2      GLU  46  10.068  19.866   0.882
 1097   2HG   GLU  46           HG1      GLU  46  10.939  18.904  -0.314
 1098    H    ILE  47           HN       ILE  47   9.654  15.112   1.862
 1099    HA   ILE  47           HA       ILE  47   9.219  13.615   3.617
 1100    HB   ILE  47           HB       ILE  47  11.586  14.889   5.016
 1101   1HG1  ILE  47          HG12      ILE  47  11.515  12.634   2.984
 1102   2HG1  ILE  47          HG11      ILE  47  12.237  14.225   2.738
 1103   1HG2  ILE  47          HG22      ILE  47  10.039  12.316   5.262
 1104   2HG2  ILE  47          HG21      ILE  47  11.723  12.394   5.782
 1105   3HG2  ILE  47          HG23      ILE  47  10.519  13.445   6.529
 1106   1HD1  ILE  47          HD12      ILE  47  13.612  13.647   4.889
 1107   2HD1  ILE  47          HD11      ILE  47  13.171  11.983   4.508
 1108   3HD1  ILE  47          HD13      ILE  47  14.093  12.939   3.348
 1109    H    LYS  48           HN       LYS  48   7.347  14.201   4.612
 1110    HA   LYS  48           HA       LYS  48   7.377  16.613   6.365
 1111   1HB   LYS  48           HB2      LYS  48   5.312  15.270   4.699
 1112   2HB   LYS  48           HB1      LYS  48   4.759  15.938   6.235
 1113   1HG   LYS  48           HG2      LYS  48   6.386  17.948   5.257
 1114   2HG   LYS  48           HG1      LYS  48   5.609  17.331   3.797
 1115   1HD   LYS  48           HD2      LYS  48   4.102  18.969   4.587
 1116   2HD   LYS  48           HD1      LYS  48   3.411  17.448   5.157
 1117   1HE   LYS  48           HE2      LYS  48   4.958  17.943   7.264
 1118   2HE   LYS  48           HE1      LYS  48   4.783  19.607   6.705
 1119   1HZ   LYS  48           HZ2      LYS  48   2.273  18.786   6.531
 1120   2HZ   LYS  48           HZ1      LYS  48   2.792  17.799   7.812
 1121   3HZ   LYS  48           HZ3      LYS  48   2.917  19.487   7.938
 1122    H    GLU  49           HN       GLU  49   6.396  13.189   6.269
 1123    HA   GLU  49           HA       GLU  49   5.819  13.238   9.163
 1124   1HB   GLU  49           HB2      GLU  49   5.330  11.372   6.914
 1125   2HB   GLU  49           HB1      GLU  49   5.676  10.609   8.465
 1126   1HG   GLU  49           HG2      GLU  49   3.562  12.730   7.991
 1127   2HG   GLU  49           HG1      GLU  49   3.251  11.007   8.198
 1128    H    GLN  50           HN       GLN  50   8.156  13.861   9.564
 1129    HA   GLN  50           HA       GLN  50  10.351  12.170   9.000
 1130   1HB   GLN  50           HB2      GLN  50  10.392  14.493  10.056
 1131   2HB   GLN  50           HB1      GLN  50   9.999  13.707  11.585
 1132   1HG   GLN  50           HG2      GLN  50  12.012  12.262  11.321
 1133   2HG   GLN  50           HG1      GLN  50  12.423  13.144   9.851
 1134   1HE2  GLN  50          HE21      GLN  50  12.759  13.155  13.270
 1135   2HE2  GLN  50          HE22      GLN  50  13.395  14.721  13.429
 1136    H    GLU  51           HN       GLU  51   7.710  11.753  11.219
 1137    HA   GLU  51           HA       GLU  51   9.074   9.764  12.866
 1138   1HB   GLU  51           HB2      GLU  51   6.693  11.259  13.052
 1139   2HB   GLU  51           HB1      GLU  51   6.186   9.573  12.949
 1140   1HG   GLU  51           HG2      GLU  51   7.936   9.071  14.734
 1141   2HG   GLU  51           HG1      GLU  51   8.081  10.815  14.952
 1142    H    VAL  52           HN       VAL  52   6.701   9.696  10.206
 1143    HA   VAL  52           HA       VAL  52   6.306   6.874  10.167
 1144    HB   VAL  52           HB       VAL  52   6.271   8.802   7.827
 1145   1HG1  VAL  52          HG12      VAL  52   5.688   5.948   8.140
 1146   2HG1  VAL  52          HG11      VAL  52   4.341   6.853   7.448
 1147   3HG1  VAL  52          HG13      VAL  52   5.923   6.891   6.668
 1148   1HG2  VAL  52          HG21      VAL  52   4.802   9.195   9.982
 1149   2HG2  VAL  52          HG23      VAL  52   4.081   9.345   8.381
 1150   3HG2  VAL  52          HG22      VAL  52   3.843   7.872   9.319
 1151    H    VAL  53           HN       VAL  53   8.373   8.816   7.980
 1152    HA   VAL  53           HA       VAL  53   9.738   6.558   6.897
 1153    HB   VAL  53           HB       VAL  53  10.606   9.454   7.141
 1154   1HG1  VAL  53          HG11      VAL  53  11.995   7.057   6.177
 1155   2HG1  VAL  53          HG13      VAL  53  11.901   8.333   4.964
 1156   3HG1  VAL  53          HG12      VAL  53  12.639   8.659   6.532
 1157   1HG2  VAL  53          HG23      VAL  53   8.536   8.961   5.804
 1158   2HG2  VAL  53          HG22      VAL  53   9.854   9.613   4.829
 1159   3HG2  VAL  53          HG21      VAL  53   9.498   7.887   4.789
 1160    H    ASP  54           HN       ASP  54  10.238   8.397   9.838
 1161    HA   ASP  54           HA       ASP  54  12.917   7.401  10.323
 1162   1HB   ASP  54           HB2      ASP  54  12.217   9.416  11.462
 1163   2HB   ASP  54           HB1      ASP  54  10.828   8.591  12.171
 1164    H    LYS  55           HN       LYS  55   9.690   6.178  10.806
 1165    HA   LYS  55           HA       LYS  55  10.511   4.129  12.721
 1166   1HB   LYS  55           HB2      LYS  55   8.245   4.909  12.883
 1167   2HB   LYS  55           HB1      LYS  55   7.959   4.620  11.169
 1168   1HG   LYS  55           HG2      LYS  55   8.840   2.155  12.213
 1169   2HG   LYS  55           HG1      LYS  55   7.685   2.788  13.387
 1170   1HD   LYS  55           HD2      LYS  55   6.317   3.364  11.170
 1171   2HD   LYS  55           HD1      LYS  55   7.256   2.010  10.540
 1172   1HE   LYS  55           HE2      LYS  55   5.746   0.638  11.503
 1173   2HE   LYS  55           HE1      LYS  55   6.386   1.157  13.062
 1174   1HZ   LYS  55           HZ2      LYS  55   4.502   2.967  11.800
 1175   2HZ   LYS  55           HZ1      LYS  55   3.853   1.490  12.332
 1176   3HZ   LYS  55           HZ3      LYS  55   4.647   2.510  13.429
 1177    H    VAL  56           HN       VAL  56   9.300   3.990   9.326
 1178    HA   VAL  56           HA       VAL  56  10.011   1.227   9.013
 1179    HB   VAL  56           HB       VAL  56   9.726   1.681   6.590
 1180   1HG1  VAL  56          HG13      VAL  56   7.773   1.363   8.176
 1181   2HG1  VAL  56          HG12      VAL  56   7.612   3.119   8.204
 1182   3HG1  VAL  56          HG11      VAL  56   7.391   2.237   6.693
 1183   1HG2  VAL  56          HG21      VAL  56   9.590   4.545   7.559
 1184   2HG2  VAL  56          HG23      VAL  56  10.725   3.864   6.394
 1185   3HG2  VAL  56          HG22      VAL  56   9.022   4.032   5.970
 1186    H    MET  57           HN       MET  57  11.626   4.239   8.029
 1187    HA   MET  57           HA       MET  57  13.941   3.039   6.881
 1188   1HB   MET  57           HB2      MET  57  13.238   5.483   6.759
 1189   2HB   MET  57           HB1      MET  57  13.864   5.656   8.399
 1190   1HG   MET  57           HG2      MET  57  15.944   5.887   7.588
 1191   2HG   MET  57           HG1      MET  57  15.832   4.294   6.840
 1192   1HE   MET  57           HE1      MET  57  13.362   4.628   5.080
 1193   2HE   MET  57           HE3      MET  57  13.979   5.128   3.499
 1194   3HE   MET  57           HE2      MET  57  14.799   3.862   4.406
 1195    H    GLU  58           HN       GLU  58  12.928   3.464  10.183
 1196    HA   GLU  58           HA       GLU  58  15.532   3.253  11.412
 1197   1HB   GLU  58           HB2      GLU  58  12.764   3.347  12.272
 1198   2HB   GLU  58           HB1      GLU  58  13.637   2.097  13.155
 1199   1HG   GLU  58           HG2      GLU  58  15.398   3.732  13.730
 1200   2HG   GLU  58           HG1      GLU  58  14.511   4.986  12.864
 1201    H    THR  59           HN       THR  59  12.945   0.803  10.931
 1202    HA   THR  59           HA       THR  59  14.531  -1.408  11.812
 1203    HB   THR  59           HB       THR  59  12.523  -1.831   9.642
 1204    HG1  THR  59           HG1      THR  59  11.965  -0.770  12.205
 1205   1HG2  THR  59          HG23      THR  59  13.603  -3.198  12.000
 1206   2HG2  THR  59          HG22      THR  59  11.847  -3.314  11.868
 1207   3HG2  THR  59          HG21      THR  59  12.872  -3.876  10.545
 1208    H    LEU  60           HN       LEU  60  14.279   0.312   8.793
 1209    HA   LEU  60           HA       LEU  60  15.570  -1.560   7.070
 1210   1HB   LEU  60           HB2      LEU  60  15.012   1.361   7.086
 1211   2HB   LEU  60           HB1      LEU  60  16.304   0.822   6.017
 1212    HG   LEU  60           HG       LEU  60  13.547  -0.432   6.083
 1213   1HD1  LEU  60          HD11      LEU  60  13.980   2.103   5.259
 1214   2HD1  LEU  60          HD13      LEU  60  14.428   1.242   3.787
 1215   3HD1  LEU  60          HD12      LEU  60  12.818   1.033   4.475
 1216   1HD2  LEU  60          HD23      LEU  60  16.085  -0.918   4.644
 1217   2HD2  LEU  60          HD22      LEU  60  14.747  -2.021   4.970
 1218   3HD2  LEU  60          HD21      LEU  60  14.650  -0.894   3.618
 1219    H    ASP  61           HN       ASP  61  16.891   1.209   8.887
 1220    HA   ASP  61           HA       ASP  61  19.647   0.454   8.283
 1221   1HB   ASP  61           HB2      ASP  61  18.300   2.764   9.234
 1222   2HB   ASP  61           HB1      ASP  61  19.431   2.281  10.498
 1223    H    GLU  62           HN       GLU  62  17.356  -0.733  10.411
 1224    HA   GLU  62           HA       GLU  62  18.990  -1.114  12.762
 1225   1HB   GLU  62           HB2      GLU  62  16.392  -1.284  12.481
 1226   2HB   GLU  62           HB1      GLU  62  16.730  -2.952  12.018
 1227   1HG   GLU  62           HG2      GLU  62  17.144  -3.549  14.152
 1228   2HG   GLU  62           HG1      GLU  62  18.226  -2.177  14.392
 1229    H    ASP  63           HN       ASP  63  17.777  -3.601  10.508
 1230    HA   ASP  63           HA       ASP  63  20.079  -5.302  11.202
 1231   1HB   ASP  63           HB2      ASP  63  17.410  -5.716  10.182
 1232   2HB   ASP  63           HB1      ASP  63  18.586  -6.499   9.125
 1233    H    GLY  64           HN       GLY  64  18.693  -3.838   8.268
 1234   1HA   GLY  64           HA2      GLY  64  19.927  -2.916   6.447
 1235   2HA   GLY  64           HA1      GLY  64  21.407  -3.561   7.157
 1236    H    ASP  65           HN       ASP  65  20.980  -6.214   7.376
 1237    HA   ASP  65           HA       ASP  65  20.230  -7.072   4.610
 1238   1HB   ASP  65           HB2      ASP  65  22.751  -7.064   5.301
 1239   2HB   ASP  65           HB1      ASP  65  22.322  -8.492   6.243
 1240    H    GLY  66           HN       GLY  66  18.095  -7.505   5.627
 1241   1HA   GLY  66           HA2      GLY  66  18.127 -10.120   7.049
 1242   2HA   GLY  66           HA1      GLY  66  17.029  -8.835   7.548
 1243    H    GLU  67           HN       GLU  67  15.304 -10.439   7.057
 1244    HA   GLU  67           HA       GLU  67  14.735 -10.539   4.121
 1245   1HB   GLU  67           HB2      GLU  67  14.209 -12.561   6.303
 1246   2HB   GLU  67           HB1      GLU  67  13.315 -12.590   4.783
 1247   1HG   GLU  67           HG2      GLU  67  15.270 -12.990   3.506
 1248   2HG   GLU  67           HG1      GLU  67  16.333 -12.507   4.829
 1249    H    CYS  68           HN       CYS  68  12.811  -9.632   3.505
 1250    HA   CYS  68           HA       CYS  68  11.005  -8.676   5.681
 1251   1HB   CYS  68           HB2      CYS  68  11.387  -7.764   2.815
 1252   2HB   CYS  68           HB1      CYS  68  10.104  -7.163   3.864
 1253    HG   CYS  68           HG       CYS  68  11.777  -5.587   4.769
 1254    H    ASP  69           HN       ASP  69   8.597  -8.497   4.661
 1255    HA   ASP  69           HA       ASP  69   8.058 -11.038   3.180
 1256   1HB   ASP  69           HB2      ASP  69   6.252 -10.136   5.416
 1257   2HB   ASP  69           HB1      ASP  69   6.403 -11.737   4.695
 1258    H    PHE  70           HN       PHE  70   6.048 -11.004   1.995
 1259    HA   PHE  70           HA       PHE  70   5.501  -8.694   0.557
 1260   1HB   PHE  70           HB2      PHE  70   3.501  -9.756  -0.218
 1261   2HB   PHE  70           HB1      PHE  70   4.692 -11.019   0.045
 1262    HD1  PHE  70           HD1      PHE  70   4.536 -11.257   3.066
 1263    HD2  PHE  70           HD2      PHE  70   1.467 -10.893   0.082
 1264    HE1  PHE  70           HE1      PHE  70   2.953 -12.436   4.551
 1265    HE2  PHE  70           HE2      PHE  70  -0.117 -12.075   1.574
 1266    HZ   PHE  70           HZ       PHE  70   0.623 -12.846   3.808
 1267    H    GLN  71           HN       GLN  71   4.370  -9.505   3.751
 1268    HA   GLN  71           HA       GLN  71   2.273  -7.465   3.771
 1269   1HB   GLN  71           HB2      GLN  71   3.406  -9.439   5.681
 1270   2HB   GLN  71           HB1      GLN  71   2.720  -7.979   6.395
 1271   1HG   GLN  71           HG2      GLN  71   0.930  -8.817   4.364
 1272   2HG   GLN  71           HG1      GLN  71   1.344 -10.252   5.301
 1273   1HE2  GLN  71          HE22      GLN  71  -1.025  -7.417   6.957
 1274   2HE2  GLN  71          HE21      GLN  71  -0.482  -7.299   5.353
 1275    H    GLU  72           HN       GLU  72   5.457  -7.803   5.363
 1276    HA   GLU  72           HA       GLU  72   5.522  -5.223   6.521
 1277   1HB   GLU  72           HB2      GLU  72   7.414  -7.383   5.937
 1278   2HB   GLU  72           HB1      GLU  72   8.169  -5.795   5.848
 1279   1HG   GLU  72           HG2      GLU  72   6.437  -5.839   8.128
 1280   2HG   GLU  72           HG1      GLU  72   7.462  -7.275   8.181
 1281    H    PHE  73           HN       PHE  73   7.066  -6.255   3.453
 1282    HA   PHE  73           HA       PHE  73   7.866  -3.672   2.621
 1283   1HB   PHE  73           HB2      PHE  73   8.783  -5.290   1.251
 1284   2HB   PHE  73           HB1      PHE  73   7.328  -6.280   1.270
 1285    HD1  PHE  73           HD2      PHE  73   5.325  -5.550  -0.112
 1286    HD2  PHE  73           HD1      PHE  73   9.200  -3.741  -0.508
 1287    HE1  PHE  73           HE2      PHE  73   4.669  -4.630  -2.317
 1288    HE2  PHE  73           HE1      PHE  73   8.544  -2.821  -2.714
 1289    HZ   PHE  73           HZ       PHE  73   6.279  -3.266  -3.619
 1290    H    MET  74           HN       MET  74   4.710  -5.041   2.866
 1291    HA   MET  74           HA       MET  74   3.470  -3.292   0.886
 1292   1HB   MET  74           HB2      MET  74   2.710  -5.577   2.339
 1293   2HB   MET  74           HB1      MET  74   1.644  -4.296   2.899
 1294   1HG   MET  74           HG2      MET  74   0.728  -5.488   0.911
 1295   2HG   MET  74           HG1      MET  74   0.998  -3.772   0.604
 1296   1HE   MET  74           HE2      MET  74   1.835  -2.896  -0.977
 1297   2HE   MET  74           HE1      MET  74   3.595  -2.997  -0.942
 1298   3HE   MET  74           HE3      MET  74   2.701  -3.554  -2.361
 1299    H    ALA  75           HN       ALA  75   3.155  -3.506   4.425
 1300    HA   ALA  75           HA       ALA  75   1.886  -0.955   4.686
 1301   1HB   ALA  75           HB3      ALA  75   3.432  -2.623   6.695
 1302   2HB   ALA  75           HB2      ALA  75   2.451  -1.219   7.110
 1303   3HB   ALA  75           HB1      ALA  75   1.688  -2.656   6.431
 1304    H    PHE  76           HN       PHE  76   5.134  -1.875   4.174
 1305    HA   PHE  76           HA       PHE  76   6.339   0.502   5.373
 1306   1HB   PHE  76           HB2      PHE  76   7.264  -1.956   4.028
 1307   2HB   PHE  76           HB1      PHE  76   8.250  -0.532   3.695
 1308    HD1  PHE  76           HD1      PHE  76   6.477  -2.090   6.620
 1309    HD2  PHE  76           HD2      PHE  76  10.007  -0.120   5.166
 1310    HE1  PHE  76           HE1      PHE  76   7.510  -2.286   8.865
 1311    HE2  PHE  76           HE2      PHE  76  11.042  -0.315   7.412
 1312    HZ   PHE  76           HZ       PHE  76   9.794  -1.399   9.261
 1313    H    VAL  77           HN       VAL  77   5.292  -0.544   2.163
 1314    HA   VAL  77           HA       VAL  77   6.522   1.700   0.777
 1315    HB   VAL  77           HB       VAL  77   4.371  -0.285  -0.005
 1316   1HG1  VAL  77          HG11      VAL  77   5.263   2.219  -1.290
 1317   2HG1  VAL  77          HG13      VAL  77   5.280   0.807  -2.345
 1318   3HG1  VAL  77          HG12      VAL  77   3.785   1.288  -1.541
 1319   1HG2  VAL  77          HG23      VAL  77   7.115  -0.550   0.210
 1320   2HG2  VAL  77          HG22      VAL  77   6.079  -1.541  -0.818
 1321   3HG2  VAL  77          HG21      VAL  77   6.904  -0.136  -1.491
 1322    H    SER  78           HN       SER  78   3.429   1.117   2.354
 1323    HA   SER  78           HA       SER  78   2.161   3.472   1.178
 1324   1HB   SER  78           HB2      SER  78   0.518   2.997   3.168
 1325   2HB   SER  78           HB1      SER  78   0.587   1.869   1.817
 1326    HG   SER  78           HG       SER  78   0.734   0.851   3.890
 1327    H    MET  79           HN       MET  79   3.890   2.748   4.169
 1328    HA   MET  79           HA       MET  79   3.213   5.156   5.550
 1329   1HB   MET  79           HB2      MET  79   5.669   3.391   5.738
 1330   2HB   MET  79           HB1      MET  79   5.231   4.635   6.903
 1331   1HG   MET  79           HG2      MET  79   2.987   2.873   6.360
 1332   2HG   MET  79           HG1      MET  79   4.389   1.971   6.935
 1333   1HE   MET  79           HE3      MET  79   4.284   1.235   8.803
 1334   2HE   MET  79           HE2      MET  79   5.353   2.321   9.684
 1335   3HE   MET  79           HE1      MET  79   3.774   1.916  10.354
 1336    H    VAL  80           HN       VAL  80   5.942   4.343   3.396
 1337    HA   VAL  80           HA       VAL  80   7.098   7.003   3.677
 1338    HB   VAL  80           HB       VAL  80   8.585   6.148   1.791
 1339   1HG1  VAL  80          HG13      VAL  80   8.308   5.187   4.564
 1340   2HG1  VAL  80          HG12      VAL  80   9.308   4.165   3.532
 1341   3HG1  VAL  80          HG11      VAL  80   9.716   5.868   3.746
 1342   1HG2  VAL  80          HG21      VAL  80   6.542   4.194   1.658
 1343   2HG2  VAL  80          HG23      VAL  80   8.047   4.232   0.744
 1344   3HG2  VAL  80          HG22      VAL  80   7.972   3.378   2.284
 1345    H    THR  81           HN       THR  81   5.175   5.329   1.185
 1346    HA   THR  81           HA       THR  81   5.426   7.361  -0.806
 1347    HB   THR  81           HB       THR  81   3.033   5.560  -0.346
 1348    HG1  THR  81           HG1      THR  81   5.059   4.938  -2.143
 1349   1HG2  THR  81          HG23      THR  81   3.360   7.603  -2.147
 1350   2HG2  THR  81          HG22      THR  81   3.948   6.218  -3.065
 1351   3HG2  THR  81          HG21      THR  81   2.315   6.204  -2.400
 1352    H    THR  82           HN       THR  82   3.880   7.430   2.208
 1353    HA   THR  82           HA       THR  82   2.120   9.682   1.335
 1354    HB   THR  82           HB       THR  82   1.914   7.606   3.497
 1355    HG1  THR  82           HG1      THR  82  -0.109   8.808   1.953
 1356   1HG2  THR  82          HG21      THR  82   1.276  10.432   3.849
 1357   2HG2  THR  82          HG23      THR  82  -0.146   9.408   4.025
 1358   3HG2  THR  82          HG22      THR  82   1.271   9.128   5.033
 1359    H    ALA  83           HN       ALA  83   4.752   8.733   3.428
 1360    HA   ALA  83           HA       ALA  83   4.688  11.026   5.162
 1361   1HB   ALA  83           HB3      ALA  83   6.594   8.841   4.537
 1362   2HB   ALA  83           HB2      ALA  83   7.297  10.313   5.207
 1363   3HB   ALA  83           HB1      ALA  83   6.045   9.449   6.099
 1364    H    CYS  84           HN       CYS  84   6.667  10.331   2.253
 1365    HA   CYS  84           HA       CYS  84   8.271  12.541   2.110
 1366   1HB   CYS  84           HB2      CYS  84   7.827  10.678   0.333
 1367   2HB   CYS  84           HB1      CYS  84   6.697  11.846  -0.351
 1368    HG   CYS  84           HG       CYS  84   9.207  13.340   0.094
 1369    H    HIS  85           HN       HIS  85   5.176  12.699   0.313
 1370    HA   HIS  85           HA       HIS  85   5.205  15.625   0.727
 1371   1HB   HIS  85           HB2      HIS  85   3.295  15.604  -0.883
 1372   2HB   HIS  85           HB1      HIS  85   4.749  14.849  -1.531
 1373    HD1  HIS  85           HD1      HIS  85   2.612  13.772  -3.044
 1374    HD2  HIS  85           HD2      HIS  85   3.246  12.308   0.806
 1375    HE1  HIS  85           HE1      HIS  85   1.463  11.518  -2.938
 1376    H    GLU  86           HN       GLU  86   3.091  16.697   1.310
 1377    HA   GLU  86           HA       GLU  86   2.028  15.468   3.732
 1378   1HB   GLU  86           HB2      GLU  86   2.410  17.991   3.266
 1379   2HB   GLU  86           HB1      GLU  86   0.882  17.912   2.389
 1380   1HG   GLU  86           HG2      GLU  86   1.111  16.831   5.192
 1381   2HG   GLU  86           HG1      GLU  86   0.802  18.542   4.905
 1382    H    PHE  87           HN       PHE  87   0.944  15.934   0.409
 1383    HA   PHE  87           HA       PHE  87  -1.187  13.967   0.889
 1384   1HB   PHE  87           HB2      PHE  87  -1.818  16.677   1.097
 1385   2HB   PHE  87           HB1      PHE  87  -2.331  16.236  -0.531
 1386    HD1  PHE  87           HD2      PHE  87  -3.164  13.491  -0.344
 1387    HD2  PHE  87           HD1      PHE  87  -3.695  16.658   2.504
 1388    HE1  PHE  87           HE2      PHE  87  -5.156  12.334   0.567
 1389    HE2  PHE  87           HE1      PHE  87  -5.684  15.495   3.425
 1390    HZ   PHE  87           HZ       PHE  87  -6.413  13.331   2.457
 1391    H    PHE  88           HN       PHE  88  -0.959  16.394  -1.720
 1392    HA   PHE  88           HA       PHE  88   0.169  14.337  -3.525
 1393   1HB   PHE  88           HB2      PHE  88  -2.409  15.785  -4.190
 1394   2HB   PHE  88           HB1      PHE  88  -1.615  14.533  -5.144
 1395    HD1  PHE  88           HD2      PHE  88  -1.028  12.338  -3.596
 1396    HD2  PHE  88           HD1      PHE  88  -4.277  15.083  -3.006
 1397    HE1  PHE  88           HE2      PHE  88  -2.276  10.597  -2.347
 1398    HE2  PHE  88           HE1      PHE  88  -5.526  13.341  -1.760
 1399    HZ   PHE  88           HZ       PHE  88  -4.527  11.097  -1.430
 1400    H    GLU  89           HN       GLU  89   1.985  15.771  -3.643
 1401    HA   GLU  89           HA       GLU  89   1.612  18.549  -4.434
 1402   1HB   GLU  89           HB2      GLU  89   4.181  16.964  -4.623
 1403   2HB   GLU  89           HB1      GLU  89   3.985  18.702  -4.409
 1404   1HG   GLU  89           HG2      GLU  89   2.879  16.784  -2.372
 1405   2HG   GLU  89           HG1      GLU  89   4.573  17.273  -2.321
 1406    H    HIS  90           HN       HIS  90   1.100  15.802  -6.123
 1407    HA   HIS  90           HA       HIS  90   2.534  16.122  -8.554
 1408   1HB   HIS  90           HB2      HIS  90   0.691  14.330  -7.630
 1409   2HB   HIS  90           HB1      HIS  90  -0.278  15.231  -8.798
 1410    HD1  HIS  90           HD1      HIS  90   0.751  12.246  -9.220
 1411    HD2  HIS  90           HD2      HIS  90   2.501  15.669 -10.827
 1412    HE1  HIS  90           HE1      HIS  90   2.058  11.495 -11.256
 1413    H    GLU  91           HN       GLU  91  -0.186  17.865  -7.231
 1414    HA   GLU  91           HA       GLU  91  -0.637  19.234  -9.834
 1415   1HB   GLU  91           HB2      GLU  91  -2.667  18.490  -8.732
 1416   2HB   GLU  91           HB1      GLU  91  -2.184  19.267  -7.226
 1417   1HG   GLU  91           HG2      GLU  91  -2.044  21.297  -9.154
 1418   2HG   GLU  91           HG1      GLU  91  -3.528  20.419  -9.527
   
  No H/Q in entry =        1418
  Start of MODEL   16
    1   1H    MET   0           HT3      MET   0   9.449   5.535 -12.898
    2   2H    MET   0           HT2      MET   0  10.513   6.244 -14.015
    3   3H    MET   0           HT1      MET   0   8.868   6.669 -14.017
    4    HA   MET   0           HA       MET   0   8.203   4.759 -15.043
    5   1HB   MET   0           HB2      MET   0  10.859   5.714 -15.938
    6   2HB   MET   0           HB1      MET   0  10.400   4.114 -16.525
    7   1HG   MET   0           HG2      MET   0   8.071   5.424 -16.935
    8   2HG   MET   0           HG1      MET   0   9.201   6.765 -17.125
    9   1HE   MET   0           HE1      MET   0   9.709   7.478 -19.021
   10   2HE   MET   0           HE3      MET   0  11.288   6.686 -19.124
   11   3HE   MET   0           HE2      MET   0  10.193   6.662 -20.505
   12    H    SER   1           HN       SER   1   8.009   3.257 -13.226
   13    HA   SER   1           HA       SER   1   9.815   0.965 -13.526
   14   1HB   SER   1           HB2      SER   1  10.387   0.870 -11.116
   15   2HB   SER   1           HB1      SER   1  11.036   2.318 -11.879
   16    HG   SER   1           HG       SER   1   9.749   3.503 -10.701
   17    H    GLU   2           HN       GLU   2   9.056  -0.637 -11.520
   18    HA   GLU   2           HA       GLU   2   6.228  -1.110 -12.099
   19   1HB   GLU   2           HB2      GLU   2   8.331  -2.755 -11.505
   20   2HB   GLU   2           HB1      GLU   2   7.515  -2.674  -9.945
   21   1HG   GLU   2           HG2      GLU   2   6.538  -4.514 -11.154
   22   2HG   GLU   2           HG1      GLU   2   5.353  -3.206 -11.159
   23    H    LEU   3           HN       LEU   3   8.151  -0.083  -9.299
   24    HA   LEU   3           HA       LEU   3   5.826   0.007  -7.530
   25   1HB   LEU   3           HB2      LEU   3   8.341  -0.304  -6.907
   26   2HB   LEU   3           HB1      LEU   3   8.420   1.452  -7.023
   27    HG   LEU   3           HG       LEU   3   6.387   1.496  -5.462
   28   1HD1  LEU   3          HD11      LEU   3   7.112  -1.413  -5.461
   29   2HD1  LEU   3          HD13      LEU   3   6.528  -0.684  -3.965
   30   3HD1  LEU   3          HD12      LEU   3   5.519  -0.659  -5.412
   31   1HD2  LEU   3          HD23      LEU   3   9.215   0.961  -4.892
   32   2HD2  LEU   3          HD22      LEU   3   8.136   2.159  -4.179
   33   3HD2  LEU   3          HD21      LEU   3   8.150   0.508  -3.561
   34    H    GLU   4           HN       GLU   4   7.924   2.473  -9.047
   35    HA   GLU   4           HA       GLU   4   6.550   4.753  -8.129
   36   1HB   GLU   4           HB2      GLU   4   8.631   5.054  -9.278
   37   2HB   GLU   4           HB1      GLU   4   8.026   4.242 -10.722
   38   1HG   GLU   4           HG2      GLU   4   6.525   6.637  -9.761
   39   2HG   GLU   4           HG1      GLU   4   8.086   6.910 -10.537
   40    H    LYS   5           HN       LYS   5   5.679   2.537 -10.740
   41    HA   LYS   5           HA       LYS   5   3.583   4.319 -11.742
   42   1HB   LYS   5           HB2      LYS   5   4.865   1.908 -12.618
   43   2HB   LYS   5           HB1      LYS   5   3.121   1.638 -12.585
   44   1HG   LYS   5           HG2      LYS   5   2.719   3.155 -14.247
   45   2HG   LYS   5           HG1      LYS   5   3.999   4.241 -13.704
   46   1HD   LYS   5           HD2      LYS   5   5.700   2.779 -14.670
   47   2HD   LYS   5           HD1      LYS   5   4.464   1.609 -15.137
   48   1HE   LYS   5           HE2      LYS   5   3.410   3.719 -16.357
   49   2HE   LYS   5           HE1      LYS   5   5.079   4.292 -16.315
   50   1HZ   LYS   5           HZ2      LYS   5   5.628   1.975 -17.219
   51   2HZ   LYS   5           HZ1      LYS   5   3.980   1.891 -17.631
   52   3HZ   LYS   5           HZ3      LYS   5   4.956   3.113 -18.287
   53    H    ALA   6           HN       ALA   6   3.611   1.224  -9.942
   54    HA   ALA   6           HA       ALA   6   0.744   1.219  -9.560
   55   1HB   ALA   6           HB1      ALA   6   2.436  -0.756  -9.418
   56   2HB   ALA   6           HB3      ALA   6   2.680  -0.217  -7.756
   57   3HB   ALA   6           HB2      ALA   6   1.079  -0.729  -8.292
   58    H    MET   7           HN       MET   7   3.336   1.603  -7.117
   59    HA   MET   7           HA       MET   7   1.781   2.450  -4.976
   60   1HB   MET   7           HB2      MET   7   4.219   2.057  -4.836
   61   2HB   MET   7           HB1      MET   7   4.507   3.534  -5.762
   62   1HG   MET   7           HG2      MET   7   4.723   4.316  -3.574
   63   2HG   MET   7           HG1      MET   7   3.022   4.648  -3.897
   64   1HE   MET   7           HE3      MET   7   1.360   4.044  -3.076
   65   2HE   MET   7           HE2      MET   7   0.911   2.522  -2.310
   66   3HE   MET   7           HE1      MET   7   1.448   3.875  -1.317
   67    H    VAL   8           HN       VAL   8   3.329   4.587  -7.381
   68    HA   VAL   8           HA       VAL   8   2.090   6.976  -6.394
   69    HB   VAL   8           HB       VAL   8   3.005   6.466  -9.238
   70   1HG1  VAL   8          HG13      VAL   8   1.702   8.607  -8.365
   71   2HG1  VAL   8          HG12      VAL   8   3.290   9.036  -7.724
   72   3HG1  VAL   8          HG11      VAL   8   3.079   8.775  -9.456
   73   1HG2  VAL   8          HG23      VAL   8   4.726   5.806  -7.530
   74   2HG2  VAL   8          HG22      VAL   8   5.220   7.191  -8.501
   75   3HG2  VAL   8          HG21      VAL   8   4.629   7.434  -6.857
   76    H    ALA   9           HN       ALA   9   0.996   4.473  -8.597
   77    HA   ALA   9           HA       ALA   9  -1.181   5.956  -9.770
   78   1HB   ALA   9           HB2      ALA   9  -0.639   3.007  -9.382
   79   2HB   ALA   9           HB1      ALA   9  -2.138   3.582 -10.114
   80   3HB   ALA   9           HB3      ALA   9  -0.587   3.939 -10.879
   81    H    LEU  10           HN       LEU  10  -0.799   4.139  -6.773
   82    HA   LEU  10           HA       LEU  10  -3.553   3.976  -6.050
   83   1HB   LEU  10           HB2      LEU  10  -1.007   3.501  -4.793
   84   2HB   LEU  10           HB1      LEU  10  -2.032   4.426  -3.692
   85    HG   LEU  10           HG       LEU  10  -3.124   2.032  -5.164
   86   1HD1  LEU  10          HD11      LEU  10  -1.031   2.016  -3.184
   87   2HD1  LEU  10          HD13      LEU  10  -2.494   1.310  -2.495
   88   3HD1  LEU  10          HD12      LEU  10  -1.808   0.644  -3.978
   89   1HD2  LEU  10          HD22      LEU  10  -3.877   3.770  -2.847
   90   2HD2  LEU  10          HD21      LEU  10  -4.893   3.107  -4.127
   91   3HD2  LEU  10          HD23      LEU  10  -4.365   2.075  -2.800
   92    H    ILE  11           HN       ILE  11  -1.082   6.445  -5.252
   93    HA   ILE  11           HA       ILE  11  -2.696   8.218  -3.792
   94    HB   ILE  11           HB       ILE  11  -0.473   8.745  -5.780
   95   1HG1  ILE  11          HG12      ILE  11  -0.302   9.343  -2.865
   96   2HG1  ILE  11          HG11      ILE  11  -0.328   7.642  -3.329
   97   1HG2  ILE  11          HG21      ILE  11  -2.313  10.621  -4.428
   98   2HG2  ILE  11          HG23      ILE  11  -0.601  11.000  -4.239
   99   3HG2  ILE  11          HG22      ILE  11  -1.302  10.867  -5.852
  100   1HD1  ILE  11          HD12      ILE  11   1.527   9.639  -4.637
  101   2HD1  ILE  11          HD11      ILE  11   1.984   8.736  -3.192
  102   3HD1  ILE  11          HD13      ILE  11   1.616   7.878  -4.689
  103    H    ASP  12           HN       ASP  12  -2.677   7.477  -7.193
  104    HA   ASP  12           HA       ASP  12  -4.176   9.744  -8.125
  105   1HB   ASP  12           HB2      ASP  12  -2.859   7.934  -9.457
  106   2HB   ASP  12           HB1      ASP  12  -4.349   7.001  -9.362
  107    H    VAL  13           HN       VAL  13  -5.164   6.444  -7.181
  108    HA   VAL  13           HA       VAL  13  -7.909   6.583  -7.650
  109    HB   VAL  13           HB       VAL  13  -6.419   5.345  -5.319
  110   1HG1  VAL  13          HG13      VAL  13  -9.347   5.395  -6.005
  111   2HG1  VAL  13          HG12      VAL  13  -8.651   3.969  -5.234
  112   3HG1  VAL  13          HG11      VAL  13  -8.574   5.536  -4.427
  113   1HG2  VAL  13          HG23      VAL  13  -6.520   4.643  -7.982
  114   2HG2  VAL  13          HG22      VAL  13  -6.187   3.524  -6.661
  115   3HG2  VAL  13          HG21      VAL  13  -7.826   3.675  -7.295
  116    H    PHE  14           HN       PHE  14  -6.155   7.827  -4.796
  117    HA   PHE  14           HA       PHE  14  -8.390   8.750  -3.335
  118   1HB   PHE  14           HB2      PHE  14  -5.677   8.879  -2.971
  119   2HB   PHE  14           HB1      PHE  14  -6.057  10.566  -3.317
  120    HD1  PHE  14           HD1      PHE  14  -6.891   7.690  -1.109
  121    HD2  PHE  14           HD2      PHE  14  -7.245  11.924  -1.753
  122    HE1  PHE  14           HE1      PHE  14  -7.794   7.966   1.185
  123    HE2  PHE  14           HE2      PHE  14  -8.146  12.199   0.540
  124    HZ   PHE  14           HZ       PHE  14  -8.421  10.221   2.010
  125    H    HIS  15           HN       HIS  15  -6.393  10.625  -5.659
  126    HA   HIS  15           HA       HIS  15  -8.040  12.947  -5.638
  127   1HB   HIS  15           HB2      HIS  15  -5.755  12.831  -6.653
  128   2HB   HIS  15           HB1      HIS  15  -6.424  11.862  -7.967
  129    HD1  HIS  15           HD1      HIS  15  -8.394  14.700  -6.506
  130    HD2  HIS  15           HD2      HIS  15  -6.055  13.954  -9.876
  131    HE1  HIS  15           HE1      HIS  15  -8.784  16.636  -8.090
  132    H    GLN  16           HN       GLN  16  -8.493   9.830  -7.046
  133    HA   GLN  16           HA       GLN  16 -10.469  10.678  -9.028
  134   1HB   GLN  16           HB2      GLN  16  -9.095   8.229  -8.279
  135   2HB   GLN  16           HB1      GLN  16 -10.822   7.940  -8.494
  136   1HG   GLN  16           HG2      GLN  16  -8.935   9.225 -10.484
  137   2HG   GLN  16           HG1      GLN  16  -9.730   7.657 -10.642
  138   1HE2  GLN  16          HE22      GLN  16 -13.010   9.221 -11.141
  139   2HE2  GLN  16          HE21      GLN  16 -12.322   7.960 -10.236
  140    H    TYR  17           HN       TYR  17 -10.462   9.577  -5.701
  141    HA   TYR  17           HA       TYR  17 -13.447   9.582  -5.698
  142   1HB   TYR  17           HB2      TYR  17 -11.398   8.361  -3.838
  143   2HB   TYR  17           HB1      TYR  17 -13.105   8.489  -3.410
  144    HD1  TYR  17           HD2      TYR  17 -14.817   7.220  -4.631
  145    HD2  TYR  17           HD1      TYR  17 -10.646   6.859  -5.606
  146    HE1  TYR  17           HE2      TYR  17 -15.302   5.176  -5.949
  147    HE2  TYR  17           HE1      TYR  17 -11.133   4.814  -6.924
  148    HH   TYR  17           HH       TYR  17 -13.884   3.999  -8.102
  149    H    SER  18           HN       SER  18 -11.189  10.183  -3.024
  150    HA   SER  18           HA       SER  18 -12.640  12.116  -1.683
  151   1HB   SER  18           HB2      SER  18 -10.083  11.118  -1.462
  152   2HB   SER  18           HB1      SER  18  -9.782  12.808  -1.856
  153    HG   SER  18           HG       SER  18 -10.049  12.812   0.301
  154    H    GLY  19           HN       GLY  19 -10.723  12.557  -4.608
  155   1HA   GLY  19           HA2      GLY  19 -11.146  15.471  -4.553
  156   2HA   GLY  19           HA1      GLY  19 -10.231  14.583  -5.770
  157    H    ARG  20           HN       ARG  20 -13.595  14.145  -4.628
  158    HA   ARG  20           HA       ARG  20 -14.623  15.106  -7.210
  159   1HB   ARG  20           HB2      ARG  20 -15.569  13.069  -7.961
  160   2HB   ARG  20           HB1      ARG  20 -13.937  12.627  -7.461
  161   1HG   ARG  20           HG2      ARG  20 -14.962  11.026  -6.219
  162   2HG   ARG  20           HG1      ARG  20 -15.350  12.346  -5.114
  163   1HD   ARG  20           HD2      ARG  20 -17.532  11.936  -5.494
  164   2HD   ARG  20           HD1      ARG  20 -17.289  12.473  -7.155
  165    HE   ARG  20           HE       ARG  20 -17.446   9.675  -6.249
  166   1HH1  ARG  20          HH11      ARG  20 -15.657   8.727  -7.880
  167   2HH1  ARG  20          HH12      ARG  20 -16.137   8.990  -9.524
  168   1HH2  ARG  20          HH21      ARG  20 -18.495  11.406  -8.729
  169   2HH2  ARG  20          HH22      ARG  20 -17.745  10.503 -10.003
  170    H    GLU  21           HN       GLU  21 -14.861  15.466  -4.154
  171    HA   GLU  21           HA       GLU  21 -17.838  15.558  -4.155
  172   1HB   GLU  21           HB2      GLU  21 -17.029  13.558  -2.864
  173   2HB   GLU  21           HB1      GLU  21 -16.173  14.663  -1.787
  174   1HG   GLU  21           HG2      GLU  21 -18.083  15.337  -0.753
  175   2HG   GLU  21           HG1      GLU  21 -19.006  15.346  -2.256
  176    H    GLY  22           HN       GLY  22 -15.236  16.372  -1.828
  177   1HA   GLY  22           HA2      GLY  22 -15.703  19.236  -2.221
  178   2HA   GLY  22           HA1      GLY  22 -16.259  18.621  -0.666
  179    H    ASP  23           HN       ASP  23 -14.694  17.887   0.857
  180    HA   ASP  23           HA       ASP  23 -12.248  19.266   0.967
  181   1HB   ASP  23           HB2      ASP  23 -12.884  16.576   2.217
  182   2HB   ASP  23           HB1      ASP  23 -11.642  17.706   2.748
  183    H    LYS  24           HN       LYS  24 -10.023  18.146   0.984
  184    HA   LYS  24           HA       LYS  24  -9.866  16.074  -1.161
  185   1HB   LYS  24           HB2      LYS  24  -8.501  18.745  -1.018
  186   2HB   LYS  24           HB1      LYS  24  -7.663  17.393  -1.779
  187   1HG   LYS  24           HG2      LYS  24 -10.454  17.580  -2.628
  188   2HG   LYS  24           HG1      LYS  24  -9.540  19.040  -3.006
  189   1HD   LYS  24           HD2      LYS  24  -8.119  16.510  -3.572
  190   2HD   LYS  24           HD1      LYS  24  -9.545  16.799  -4.570
  191   1HE   LYS  24           HE2      LYS  24  -8.248  18.147  -5.833
  192   2HE   LYS  24           HE1      LYS  24  -8.258  19.278  -4.480
  193   1HZ   LYS  24           HZ1      LYS  24  -6.324  17.043  -4.720
  194   2HZ   LYS  24           HZ3      LYS  24  -6.006  18.609  -5.288
  195   3HZ   LYS  24           HZ2      LYS  24  -6.272  18.346  -3.630
  196    H    HIS  25           HN       HIS  25  -9.720  15.626   1.648
  197    HA   HIS  25           HA       HIS  25  -7.150  14.271   1.782
  198   1HB   HIS  25           HB2      HIS  25  -6.764  16.775   2.451
  199   2HB   HIS  25           HB1      HIS  25  -7.565  16.314   3.953
  200    HD1  HIS  25           HD1      HIS  25  -6.210  15.004   5.636
  201    HD2  HIS  25           HD2      HIS  25  -4.330  15.216   1.921
  202    HE1  HIS  25           HE1      HIS  25  -3.896  14.019   5.945
  203    H    LYS  26           HN       LYS  26 -10.168  13.907   2.149
  204    HA   LYS  26           HA       LYS  26  -9.928  12.218   4.557
  205   1HB   LYS  26           HB2      LYS  26 -11.928  13.138   5.613
  206   2HB   LYS  26           HB1      LYS  26 -10.747  14.427   5.382
  207   1HG   LYS  26           HG2      LYS  26 -11.990  15.462   3.741
  208   2HG   LYS  26           HG1      LYS  26 -12.699  13.949   3.177
  209   1HD   LYS  26           HD2      LYS  26 -14.411  15.306   4.288
  210   2HD   LYS  26           HD1      LYS  26 -14.085  13.854   5.234
  211   1HE   LYS  26           HE2      LYS  26 -12.680  15.087   6.769
  212   2HE   LYS  26           HE1      LYS  26 -12.769  16.532   5.762
  213   1HZ   LYS  26           HZ1      LYS  26 -15.082  15.232   7.099
  214   2HZ   LYS  26           HZ3      LYS  26 -14.296  16.631   7.647
  215   3HZ   LYS  26           HZ2      LYS  26 -15.133  16.653   6.168
  216    H    LEU  27           HN       LEU  27 -11.526  10.543   4.601
  217    HA   LEU  27           HA       LEU  27 -13.391  10.415   2.294
  218   1HB   LEU  27           HB2      LEU  27 -10.972   9.118   2.151
  219   2HB   LEU  27           HB1      LEU  27 -12.011   7.867   2.838
  220    HG   LEU  27           HG       LEU  27 -13.652   8.840   0.906
  221   1HD1  LEU  27          HD12      LEU  27 -10.798   9.280   0.023
  222   2HD1  LEU  27          HD11      LEU  27 -12.079   8.952  -1.144
  223   3HD1  LEU  27          HD13      LEU  27 -12.170  10.380  -0.111
  224   1HD2  LEU  27          HD23      LEU  27 -12.524   6.467   1.461
  225   2HD2  LEU  27          HD22      LEU  27 -13.366   6.764  -0.060
  226   3HD2  LEU  27          HD21      LEU  27 -11.606   6.859   0.008
  227    H    LYS  28           HN       LYS  28 -13.998   7.619   2.845
  228    HA   LYS  28           HA       LYS  28 -14.951   7.680   5.657
  229   1HB   LYS  28           HB2      LYS  28 -16.610   8.214   3.379
  230   2HB   LYS  28           HB1      LYS  28 -17.085   6.660   4.064
  231   1HG   LYS  28           HG2      LYS  28 -17.121   7.781   6.334
  232   2HG   LYS  28           HG1      LYS  28 -16.912   9.321   5.500
  233   1HD   LYS  28           HD2      LYS  28 -19.185   7.363   5.037
  234   2HD   LYS  28           HD1      LYS  28 -19.301   8.872   5.944
  235   1HE   LYS  28           HE2      LYS  28 -18.508  10.068   3.849
  236   2HE   LYS  28           HE1      LYS  28 -18.718   8.541   2.991
  237   1HZ   LYS  28           HZ3      LYS  28 -20.882   9.768   4.596
  238   2HZ   LYS  28           HZ2      LYS  28 -20.660  10.125   2.950
  239   3HZ   LYS  28           HZ1      LYS  28 -21.008   8.535   3.438
  240    H    LYS  29           HN       LYS  29 -14.742   5.670   6.561
  241    HA   LYS  29           HA       LYS  29 -13.428   3.544   5.306
  242   1HB   LYS  29           HB2      LYS  29 -14.520   2.087   7.083
  243   2HB   LYS  29           HB1      LYS  29 -13.662   3.503   7.691
  244   1HG   LYS  29           HG2      LYS  29 -16.049   4.643   7.396
  245   2HG   LYS  29           HG1      LYS  29 -16.603   2.977   7.571
  246   1HD   LYS  29           HD2      LYS  29 -16.485   4.118   9.763
  247   2HD   LYS  29           HD1      LYS  29 -15.355   2.769   9.674
  248   1HE   LYS  29           HE2      LYS  29 -14.102   5.175   8.680
  249   2HE   LYS  29           HE1      LYS  29 -14.745   5.449  10.299
  250   1HZ   LYS  29           HZ1      LYS  29 -12.979   3.198   9.499
  251   2HZ   LYS  29           HZ3      LYS  29 -12.495   4.569  10.374
  252   3HZ   LYS  29           HZ2      LYS  29 -13.597   3.470  11.058
  253    H    SER  30           HN       SER  30 -16.810   4.429   5.136
  254    HA   SER  30           HA       SER  30 -17.785   1.915   4.108
  255   1HB   SER  30           HB2      SER  30 -18.855   4.518   4.666
  256   2HB   SER  30           HB1      SER  30 -19.322   4.060   3.030
  257    HG   SER  30           HG       SER  30 -20.063   2.067   3.915
  258    H    GLU  31           HN       GLU  31 -16.592   4.882   2.513
  259    HA   GLU  31           HA       GLU  31 -17.025   3.811  -0.155
  260   1HB   GLU  31           HB2      GLU  31 -16.942   6.241   0.198
  261   2HB   GLU  31           HB1      GLU  31 -15.296   6.113   0.824
  262   1HG   GLU  31           HG2      GLU  31 -14.426   5.462  -1.293
  263   2HG   GLU  31           HG1      GLU  31 -16.037   5.139  -1.939
  264    H    LEU  32           HN       LEU  32 -14.576   3.589   2.275
  265    HA   LEU  32           HA       LEU  32 -12.429   2.752   0.500
  266   1HB   LEU  32           HB2      LEU  32 -11.727   3.614   2.610
  267   2HB   LEU  32           HB1      LEU  32 -12.880   2.612   3.489
  268    HG   LEU  32           HG       LEU  32 -11.643   0.605   2.975
  269   1HD1  LEU  32          HD12      LEU  32 -10.681   2.196   0.789
  270   2HD1  LEU  32          HD11      LEU  32  -9.297   1.598   1.704
  271   3HD1  LEU  32          HD13      LEU  32 -10.482   0.465   1.054
  272   1HD2  LEU  32          HD21      LEU  32 -10.208   2.960   4.097
  273   2HD2  LEU  32          HD23      LEU  32 -10.563   1.399   4.839
  274   3HD2  LEU  32          HD22      LEU  32  -9.217   1.553   3.708
  275    H    LYS  33           HN       LYS  33 -14.998   1.226   2.348
  276    HA   LYS  33           HA       LYS  33 -14.184  -1.496   2.111
  277   1HB   LYS  33           HB2      LYS  33 -16.136  -0.457   3.475
  278   2HB   LYS  33           HB1      LYS  33 -17.063  -0.579   1.985
  279   1HG   LYS  33           HG2      LYS  33 -16.213  -3.054   1.951
  280   2HG   LYS  33           HG1      LYS  33 -15.899  -2.787   3.667
  281   1HD   LYS  33           HD2      LYS  33 -18.216  -2.213   4.069
  282   2HD   LYS  33           HD1      LYS  33 -18.570  -2.241   2.341
  283   1HE   LYS  33           HE2      LYS  33 -17.929  -4.665   2.306
  284   2HE   LYS  33           HE1      LYS  33 -17.761  -4.603   4.060
  285   1HZ   LYS  33           HZ3      LYS  33 -20.156  -3.578   3.858
  286   2HZ   LYS  33           HZ2      LYS  33 -20.175  -4.471   2.412
  287   3HZ   LYS  33           HZ1      LYS  33 -19.917  -5.256   3.896
  288    H    GLU  34           HN       GLU  34 -16.219   0.560   0.058
  289    HA   GLU  34           HA       GLU  34 -16.588  -1.473  -1.976
  290   1HB   GLU  34           HB2      GLU  34 -17.922   0.111  -3.012
  291   2HB   GLU  34           HB1      GLU  34 -17.882   0.813  -1.397
  292   1HG   GLU  34           HG2      GLU  34 -17.278   2.672  -2.595
  293   2HG   GLU  34           HG1      GLU  34 -15.679   1.976  -2.355
  294    H    LEU  35           HN       LEU  35 -14.270   1.018  -1.284
  295    HA   LEU  35           HA       LEU  35 -12.942   1.234  -3.781
  296   1HB   LEU  35           HB2      LEU  35 -12.582   2.332  -1.312
  297   2HB   LEU  35           HB1      LEU  35 -11.241   1.182  -1.346
  298    HG   LEU  35           HG       LEU  35 -10.626   3.435  -2.250
  299   1HD1  LEU  35          HD11      LEU  35  -9.992   0.917  -3.223
  300   2HD1  LEU  35          HD13      LEU  35 -10.423   1.811  -4.680
  301   3HD1  LEU  35          HD12      LEU  35  -9.146   2.412  -3.622
  302   1HD2  LEU  35          HD21      LEU  35 -13.102   3.281  -3.492
  303   2HD2  LEU  35          HD23      LEU  35 -11.844   4.462  -3.859
  304   3HD2  LEU  35          HD22      LEU  35 -11.974   2.985  -4.815
  305    H    ILE  36           HN       ILE  36 -12.580  -1.128  -1.147
  306    HA   ILE  36           HA       ILE  36 -10.462  -2.583  -2.554
  307    HB   ILE  36           HB       ILE  36 -11.978  -3.866  -0.335
  308   1HG1  ILE  36          HG12      ILE  36 -10.476  -1.262  -0.104
  309   2HG1  ILE  36          HG11      ILE  36 -12.010  -1.724   0.627
  310   1HG2  ILE  36          HG23      ILE  36  -9.754  -4.564  -1.580
  311   2HG2  ILE  36          HG22      ILE  36  -9.015  -3.416  -0.462
  312   3HG2  ILE  36          HG21      ILE  36  -9.910  -4.803   0.160
  313   1HD1  ILE  36          HD12      ILE  36 -10.631  -3.508   1.906
  314   2HD1  ILE  36          HD11      ILE  36  -9.227  -2.547   1.438
  315   3HD1  ILE  36          HD13      ILE  36 -10.497  -1.829   2.429
  316    H    ASN  37           HN       ASN  37 -13.732  -3.548  -1.450
  317    HA   ASN  37           HA       ASN  37 -13.808  -5.909  -3.063
  318   1HB   ASN  37           HB2      ASN  37 -15.248  -5.244  -1.009
  319   2HB   ASN  37           HB1      ASN  37 -16.285  -4.443  -2.190
  320   1HD2  ASN  37          HD22      ASN  37 -17.417  -8.012  -1.785
  321   2HD2  ASN  37          HD21      ASN  37 -17.210  -6.718  -0.706
  322    H    ASN  38           HN       ASN  38 -13.926  -2.736  -4.139
  323    HA   ASN  38           HA       ASN  38 -15.566  -3.573  -6.499
  324   1HB   ASN  38           HB2      ASN  38 -16.315  -1.582  -4.934
  325   2HB   ASN  38           HB1      ASN  38 -15.108  -0.682  -5.849
  326   1HD2  ASN  38          HD22      ASN  38 -17.064  -0.536  -8.790
  327   2HD2  ASN  38          HD21      ASN  38 -15.583  -0.157  -8.051
  328    H    GLU  39           HN       GLU  39 -13.287  -0.852  -5.989
  329    HA   GLU  39           HA       GLU  39 -12.180  -0.878  -8.550
  330   1HB   GLU  39           HB2      GLU  39 -10.721  -0.322  -5.946
  331   2HB   GLU  39           HB1      GLU  39 -10.163   0.155  -7.551
  332   1HG   GLU  39           HG2      GLU  39 -12.845   0.991  -6.422
  333   2HG   GLU  39           HG1      GLU  39 -11.385   1.970  -6.267
  334    H    LEU  40           HN       LEU  40 -10.724  -2.505  -5.700
  335    HA   LEU  40           HA       LEU  40  -8.922  -4.060  -7.345
  336   1HB   LEU  40           HB2      LEU  40  -9.673  -3.955  -4.464
  337   2HB   LEU  40           HB1      LEU  40  -8.981  -5.470  -5.047
  338    HG   LEU  40           HG       LEU  40  -7.725  -2.748  -5.492
  339   1HD1  LEU  40          HD13      LEU  40  -7.903  -3.949  -3.071
  340   2HD1  LEU  40          HD12      LEU  40  -6.468  -4.760  -3.703
  341   3HD1  LEU  40          HD11      LEU  40  -6.503  -3.000  -3.571
  342   1HD2  LEU  40          HD21      LEU  40  -7.345  -4.994  -6.946
  343   2HD2  LEU  40          HD23      LEU  40  -6.045  -3.852  -6.609
  344   3HD2  LEU  40          HD22      LEU  40  -6.212  -5.311  -5.633
  345    H    SER  41           HN       SER  41 -10.785  -5.928  -5.076
  346    HA   SER  41           HA       SER  41 -12.303  -7.691  -5.398
  347   1HB   SER  41           HB2      SER  41 -13.396  -5.794  -6.844
  348   2HB   SER  41           HB1      SER  41 -12.816  -6.750  -8.204
  349    HG   SER  41           HG       SER  41 -14.370  -8.103  -7.831
  350    H    HIS  42           HN       HIS  42  -9.446  -7.351  -7.014
  351    HA   HIS  42           HA       HIS  42  -9.586  -9.364  -9.042
  352   1HB   HIS  42           HB2      HIS  42  -7.637  -7.650  -8.176
  353   2HB   HIS  42           HB1      HIS  42  -7.049  -9.184  -7.530
  354    HD1  HIS  42           HD1      HIS  42  -6.669 -11.141  -9.293
  355    HD2  HIS  42           HD2      HIS  42  -7.418  -7.395 -10.960
  356    HE1  HIS  42           HE1      HIS  42  -5.990 -11.294 -11.729
  357    H    PHE  43           HN       PHE  43  -9.656  -9.526  -5.624
  358    HA   PHE  43           HA       PHE  43  -9.391 -12.499  -5.777
  359   1HB   PHE  43           HB2      PHE  43  -8.649 -10.978  -3.288
  360   2HB   PHE  43           HB1      PHE  43  -8.106 -12.570  -3.820
  361    HD1  PHE  43           HD2      PHE  43  -7.769  -8.917  -4.405
  362    HD2  PHE  43           HD1      PHE  43  -6.230 -12.828  -5.299
  363    HE1  PHE  43           HE2      PHE  43  -5.775  -7.892  -5.463
  364    HE2  PHE  43           HE1      PHE  43  -4.237 -11.801  -6.358
  365    HZ   PHE  43           HZ       PHE  43  -4.010  -9.334  -6.442
  366    H    LEU  44           HN       LEU  44 -10.032 -12.351  -2.755
  367    HA   LEU  44           HA       LEU  44 -11.949 -12.181  -1.380
  368   1HB   LEU  44           HB2      LEU  44 -12.309 -10.115  -3.211
  369   2HB   LEU  44           HB1      LEU  44 -13.786 -11.068  -3.366
  370    HG   LEU  44           HG       LEU  44 -13.089 -10.843  -0.583
  371   1HD1  LEU  44          HD11      LEU  44 -12.202  -8.618  -1.984
  372   2HD1  LEU  44          HD13      LEU  44 -13.808  -8.138  -1.439
  373   3HD1  LEU  44          HD12      LEU  44 -12.598  -8.657  -0.265
  374   1HD2  LEU  44          HD23      LEU  44 -15.353 -10.543  -2.390
  375   2HD2  LEU  44          HD22      LEU  44 -15.341 -11.019  -0.691
  376   3HD2  LEU  44          HD21      LEU  44 -15.373  -9.310  -1.129
  377    H    GLU  45           HN       GLU  45 -11.415 -14.543  -2.627
  378    HA   GLU  45           HA       GLU  45 -14.050 -15.458  -3.707
  379   1HB   GLU  45           HB2      GLU  45 -12.377 -17.602  -4.043
  380   2HB   GLU  45           HB1      GLU  45 -12.670 -16.385  -5.281
  381   1HG   GLU  45           HG2      GLU  45 -10.489 -16.021  -3.223
  382   2HG   GLU  45           HG1      GLU  45 -10.211 -16.936  -4.701
  383    H    GLU  46           HN       GLU  46 -11.366 -16.669  -1.734
  384    HA   GLU  46           HA       GLU  46 -13.373 -17.875   0.123
  385   1HB   GLU  46           HB2      GLU  46 -10.589 -18.729  -0.698
  386   2HB   GLU  46           HB1      GLU  46 -11.285 -19.264   0.832
  387   1HG   GLU  46           HG2      GLU  46 -13.330 -19.684  -1.019
  388   2HG   GLU  46           HG1      GLU  46 -11.866 -20.177  -1.874
  389    H    ILE  47           HN       ILE  47 -12.291 -15.127  -0.075
  390    HA   ILE  47           HA       ILE  47 -11.608 -13.448   1.387
  391    HB   ILE  47           HB       ILE  47 -11.977 -15.746   3.294
  392   1HG1  ILE  47          HG12      ILE  47 -13.448 -13.335   2.363
  393   2HG1  ILE  47          HG11      ILE  47 -14.070 -14.907   2.853
  394   1HG2  ILE  47          HG21      ILE  47 -10.071 -14.373   4.121
  395   2HG2  ILE  47          HG23      ILE  47 -11.083 -12.932   4.008
  396   3HG2  ILE  47          HG22      ILE  47 -11.492 -14.211   5.153
  397   1HD1  ILE  47          HD12      ILE  47 -13.670 -14.321   5.222
  398   2HD1  ILE  47          HD11      ILE  47 -13.058 -12.742   4.723
  399   3HD1  ILE  47          HD13      ILE  47 -14.750 -13.160   4.449
  400    H    LYS  48           HN       LYS  48  -9.612 -12.586   1.992
  401    HA   LYS  48           HA       LYS  48  -7.287 -14.141   1.188
  402   1HB   LYS  48           HB2      LYS  48  -7.024 -11.514   2.601
  403   2HB   LYS  48           HB1      LYS  48  -6.150 -12.120   1.194
  404   1HG   LYS  48           HG2      LYS  48  -8.723 -12.026   0.242
  405   2HG   LYS  48           HG1      LYS  48  -8.701 -10.641   1.335
  406   1HD   LYS  48           HD2      LYS  48  -6.347 -10.223   0.123
  407   2HD   LYS  48           HD1      LYS  48  -7.156 -11.103  -1.175
  408   1HE   LYS  48           HE2      LYS  48  -9.022  -9.529  -1.133
  409   2HE   LYS  48           HE1      LYS  48  -8.311  -8.683   0.241
  410   1HZ   LYS  48           HZ1      LYS  48  -6.534  -8.983  -2.006
  411   2HZ   LYS  48           HZ3      LYS  48  -7.905  -8.043  -2.344
  412   3HZ   LYS  48           HZ2      LYS  48  -6.873  -7.611  -1.064
  413    H    GLU  49           HN       GLU  49  -7.661 -12.227   4.189
  414    HA   GLU  49           HA       GLU  49  -6.546 -14.595   5.646
  415   1HB   GLU  49           HB2      GLU  49  -5.254 -12.178   5.348
  416   2HB   GLU  49           HB1      GLU  49  -6.076 -11.969   6.891
  417   1HG   GLU  49           HG2      GLU  49  -4.154 -14.175   6.113
  418   2HG   GLU  49           HG1      GLU  49  -3.928 -12.949   7.360
  419    H    GLN  50           HN       GLN  50  -8.313 -15.389   6.725
  420    HA   GLN  50           HA       GLN  50 -10.640 -14.047   7.430
  421   1HB   GLN  50           HB2      GLN  50 -10.177 -16.519   7.747
  422   2HB   GLN  50           HB1      GLN  50  -9.307 -16.095   9.222
  423   1HG   GLN  50           HG2      GLN  50 -11.945 -14.827   9.056
  424   2HG   GLN  50           HG1      GLN  50 -12.031 -16.589   9.051
  425   1HE2  GLN  50          HE22      GLN  50 -11.971 -15.848  12.621
  426   2HE2  GLN  50          HE21      GLN  50 -13.061 -15.880  11.320
  427    H    GLU  51           HN       GLU  51  -7.514 -13.967   9.054
  428    HA   GLU  51           HA       GLU  51  -8.577 -12.464  11.331
  429   1HB   GLU  51           HB2      GLU  51  -6.308 -13.998  10.921
  430   2HB   GLU  51           HB1      GLU  51  -5.677 -12.350  10.958
  431   1HG   GLU  51           HG2      GLU  51  -7.429 -12.241  13.033
  432   2HG   GLU  51           HG1      GLU  51  -6.947 -13.935  13.119
  433    H    VAL  52           HN       VAL  52  -6.052 -11.591   8.905
  434    HA   VAL  52           HA       VAL  52  -6.038  -8.828   9.478
  435    HB   VAL  52           HB       VAL  52  -5.737  -9.928   6.668
  436   1HG1  VAL  52          HG11      VAL  52  -4.729  -7.541   8.201
  437   2HG1  VAL  52          HG13      VAL  52  -3.830  -8.150   6.811
  438   3HG1  VAL  52          HG12      VAL  52  -5.494  -7.597   6.613
  439   1HG2  VAL  52          HG23      VAL  52  -4.357 -10.837   8.957
  440   2HG2  VAL  52          HG22      VAL  52  -3.932 -11.122   7.269
  441   3HG2  VAL  52          HG21      VAL  52  -3.252  -9.741   8.127
  442    H    VAL  53           HN       VAL  53  -7.757 -10.401   6.787
  443    HA   VAL  53           HA       VAL  53  -9.308  -8.189   5.998
  444    HB   VAL  53           HB       VAL  53  -9.901 -11.158   5.926
  445   1HG1  VAL  53          HG11      VAL  53 -11.467  -8.806   4.852
  446   2HG1  VAL  53          HG13      VAL  53 -11.588 -10.408   4.122
  447   3HG1  VAL  53          HG12      VAL  53 -12.055 -10.169   5.805
  448   1HG2  VAL  53          HG21      VAL  53  -9.019  -9.149   3.821
  449   2HG2  VAL  53          HG23      VAL  53  -8.002 -10.391   4.553
  450   3HG2  VAL  53          HG22      VAL  53  -9.353 -10.855   3.518
  451    H    ASP  54           HN       ASP  54  -9.689 -10.289   8.768
  452    HA   ASP  54           HA       ASP  54 -12.461  -9.665   9.280
  453   1HB   ASP  54           HB2      ASP  54 -10.286 -11.039  10.680
  454   2HB   ASP  54           HB1      ASP  54 -11.341 -10.143  11.768
  455    H    LYS  55           HN       LYS  55  -9.397  -8.176  10.313
  456    HA   LYS  55           HA       LYS  55 -10.626  -6.340  12.153
  457   1HB   LYS  55           HB2      LYS  55  -8.030  -7.030  11.514
  458   2HB   LYS  55           HB1      LYS  55  -8.155  -5.383  10.895
  459   1HG   LYS  55           HG2      LYS  55  -8.418  -4.471  12.979
  460   2HG   LYS  55           HG1      LYS  55  -9.330  -5.855  13.581
  461   1HD   LYS  55           HD2      LYS  55  -7.428  -6.400  14.688
  462   2HD   LYS  55           HD1      LYS  55  -6.840  -6.948  13.117
  463   1HE   LYS  55           HE2      LYS  55  -5.590  -5.011  12.759
  464   2HE   LYS  55           HE1      LYS  55  -6.584  -4.047  13.851
  465   1HZ   LYS  55           HZ3      LYS  55  -5.143  -6.304  15.006
  466   2HZ   LYS  55           HZ2      LYS  55  -4.214  -4.962  14.534
  467   3HZ   LYS  55           HZ1      LYS  55  -5.470  -4.773  15.662
  468    H    VAL  56           HN       VAL  56  -9.521  -5.844   8.755
  469    HA   VAL  56           HA       VAL  56 -10.500  -3.119   8.746
  470    HB   VAL  56           HB       VAL  56 -10.132  -3.267   6.303
  471   1HG1  VAL  56          HG11      VAL  56  -8.132  -4.046   8.324
  472   2HG1  VAL  56          HG13      VAL  56  -7.688  -4.448   6.665
  473   3HG1  VAL  56          HG12      VAL  56  -8.057  -2.779   7.100
  474   1HG2  VAL  56          HG23      VAL  56  -9.959  -6.192   6.969
  475   2HG2  VAL  56          HG22      VAL  56 -10.835  -5.406   5.655
  476   3HG2  VAL  56          HG21      VAL  56  -9.078  -5.554   5.581
  477    H    MET  57           HN       MET  57 -11.742  -6.182   7.483
  478    HA   MET  57           HA       MET  57 -14.164  -5.099   6.406
  479   1HB   MET  57           HB2      MET  57 -13.071  -7.430   6.038
  480   2HB   MET  57           HB1      MET  57 -13.906  -7.889   7.524
  481   1HG   MET  57           HG2      MET  57 -15.254  -8.429   5.512
  482   2HG   MET  57           HG1      MET  57 -16.059  -7.243   6.538
  483   1HE   MET  57           HE3      MET  57 -13.951  -8.008   3.530
  484   2HE   MET  57           HE2      MET  57 -13.911  -6.549   2.546
  485   3HE   MET  57           HE1      MET  57 -12.953  -6.632   4.023
  486    H    GLU  58           HN       GLU  58 -13.172  -5.945   9.656
  487    HA   GLU  58           HA       GLU  58 -15.898  -6.092  10.697
  488   1HB   GLU  58           HB2      GLU  58 -13.159  -6.091  11.883
  489   2HB   GLU  58           HB1      GLU  58 -14.481  -5.560  12.917
  490   1HG   GLU  58           HG2      GLU  58 -15.720  -7.679  12.164
  491   2HG   GLU  58           HG1      GLU  58 -14.168  -8.231  11.536
  492    H    THR  59           HN       THR  59 -13.284  -3.627  11.047
  493    HA   THR  59           HA       THR  59 -14.969  -1.673  12.280
  494    HB   THR  59           HB       THR  59 -12.826  -0.743  10.421
  495    HG1  THR  59           HG1      THR  59 -12.279  -2.175  12.803
  496   1HG2  THR  59          HG23      THR  59 -13.645  -0.206  13.283
  497   2HG2  THR  59          HG22      THR  59 -12.219   0.516  12.536
  498   3HG2  THR  59          HG21      THR  59 -13.825   0.868  11.896
  499    H    LEU  60           HN       LEU  60 -14.528  -2.681   8.998
  500    HA   LEU  60           HA       LEU  60 -15.731  -0.440   7.670
  501   1HB   LEU  60           HB2      LEU  60 -15.070  -3.278   7.010
  502   2HB   LEU  60           HB1      LEU  60 -16.217  -2.451   5.961
  503    HG   LEU  60           HG       LEU  60 -13.448  -1.443   6.688
  504   1HD1  LEU  60          HD13      LEU  60 -14.385  -3.277   4.668
  505   2HD1  LEU  60          HD12      LEU  60 -13.776  -1.811   3.901
  506   3HD1  LEU  60          HD11      LEU  60 -12.737  -2.732   4.988
  507   1HD2  LEU  60          HD23      LEU  60 -15.790  -0.111   5.687
  508   2HD2  LEU  60          HD22      LEU  60 -14.185   0.562   5.980
  509   3HD2  LEU  60          HD21      LEU  60 -14.568  -0.151   4.414
  510    H    ASP  61           HN       ASP  61 -17.057  -3.657   8.487
  511    HA   ASP  61           HA       ASP  61 -19.789  -2.775   7.942
  512   1HB   ASP  61           HB2      ASP  61 -18.498  -5.237   8.048
  513   2HB   ASP  61           HB1      ASP  61 -19.509  -5.240   9.494
  514    H    GLU  62           HN       GLU  62 -17.728  -2.183  10.468
  515    HA   GLU  62           HA       GLU  62 -19.574  -2.627  12.680
  516   1HB   GLU  62           HB2      GLU  62 -16.930  -2.379  12.675
  517   2HB   GLU  62           HB1      GLU  62 -17.317  -0.670  12.878
  518   1HG   GLU  62           HG2      GLU  62 -18.930  -1.492  14.748
  519   2HG   GLU  62           HG1      GLU  62 -17.983  -2.980  14.693
  520    H    ASP  63           HN       ASP  63 -18.604   0.151  10.701
  521    HA   ASP  63           HA       ASP  63 -21.040   1.550  11.689
  522   1HB   ASP  63           HB2      ASP  63 -18.438   2.254  12.458
  523   2HB   ASP  63           HB1      ASP  63 -18.865   3.414  11.200
  524    H    GLY  64           HN       GLY  64 -18.380   1.627   9.322
  525   1HA   GLY  64           HA2      GLY  64 -18.394   2.189   7.042
  526   2HA   GLY  64           HA1      GLY  64 -20.083   1.676   7.047
  527    H    ASP  65           HN       ASP  65 -19.401   4.144   9.313
  528    HA   ASP  65           HA       ASP  65 -20.248   6.253   7.385
  529   1HB   ASP  65           HB2      ASP  65 -22.103   5.228   8.928
  530   2HB   ASP  65           HB1      ASP  65 -21.327   6.188  10.187
  531    H    GLY  66           HN       GLY  66 -17.822   5.303   9.237
  532   1HA   GLY  66           HA2      GLY  66 -17.377   7.801  10.736
  533   2HA   GLY  66           HA1      GLY  66 -16.330   6.382  10.760
  534    H    GLU  67           HN       GLU  67 -15.415   9.084  10.382
  535    HA   GLU  67           HA       GLU  67 -14.788   9.302   7.504
  536   1HB   GLU  67           HB2      GLU  67 -13.868  11.037   9.818
  537   2HB   GLU  67           HB1      GLU  67 -13.745  11.425   8.101
  538   1HG   GLU  67           HG2      GLU  67 -15.945  12.001   7.942
  539   2HG   GLU  67           HG1      GLU  67 -16.461  10.713   9.031
  540    H    CYS  68           HN       CYS  68 -12.833   8.703   6.630
  541    HA   CYS  68           HA       CYS  68 -10.791   7.634   8.536
  542   1HB   CYS  68           HB2      CYS  68 -11.991   6.443   6.296
  543   2HB   CYS  68           HB1      CYS  68 -10.378   6.903   5.752
  544    HG   CYS  68           HG       CYS  68 -10.686   5.275   8.398
  545    H    ASP  69           HN       ASP  69  -8.501   7.697   7.312
  546    HA   ASP  69           HA       ASP  69  -8.189  10.490   6.280
  547   1HB   ASP  69           HB2      ASP  69  -6.312   8.832   7.990
  548   2HB   ASP  69           HB1      ASP  69  -5.879  10.380   7.265
  549    H    PHE  70           HN       PHE  70  -5.921  10.600   5.063
  550    HA   PHE  70           HA       PHE  70  -6.144   8.800   2.812
  551   1HB   PHE  70           HB2      PHE  70  -5.300  11.122   2.590
  552   2HB   PHE  70           HB1      PHE  70  -3.889  10.693   3.557
  553    HD1  PHE  70           HD2      PHE  70  -5.462   8.366   1.152
  554    HD2  PHE  70           HD1      PHE  70  -2.251  11.142   1.821
  555    HE1  PHE  70           HE2      PHE  70  -4.318   7.531  -0.881
  556    HE2  PHE  70           HE1      PHE  70  -1.106  10.306  -0.214
  557    HZ   PHE  70           HZ       PHE  70  -2.140   8.501  -1.566
  558    H    GLN  71           HN       GLN  71  -3.909   9.062   5.563
  559    HA   GLN  71           HA       GLN  71  -2.210   6.888   4.689
  560   1HB   GLN  71           HB2      GLN  71  -2.488   8.601   7.085
  561   2HB   GLN  71           HB1      GLN  71  -1.842   6.990   7.394
  562   1HG   GLN  71           HG2      GLN  71  -0.603   8.016   5.026
  563   2HG   GLN  71           HG1      GLN  71  -0.481   9.237   6.294
  564   1HE2  GLN  71          HE22      GLN  71   2.344   6.720   6.589
  565   2HE2  GLN  71          HE21      GLN  71   1.773   7.648   5.288
  566    H    GLU  72           HN       GLU  72  -5.198   7.088   6.505
  567    HA   GLU  72           HA       GLU  72  -5.002   4.397   7.594
  568   1HB   GLU  72           HB2      GLU  72  -7.045   6.555   7.489
  569   2HB   GLU  72           HB1      GLU  72  -7.668   4.912   7.630
  570   1HG   GLU  72           HG2      GLU  72  -5.427   5.214   9.404
  571   2HG   GLU  72           HG1      GLU  72  -6.563   6.534   9.686
  572    H    PHE  73           HN       PHE  73  -7.158   5.781   5.096
  573    HA   PHE  73           HA       PHE  73  -8.104   3.339   4.063
  574   1HB   PHE  73           HB2      PHE  73  -9.281   4.975   3.009
  575   2HB   PHE  73           HB1      PHE  73  -7.974   6.142   3.183
  576    HD1  PHE  73           HD2      PHE  73  -6.148   6.245   1.498
  577    HD2  PHE  73           HD1      PHE  73  -9.544   3.663   1.002
  578    HE1  PHE  73           HE2      PHE  73  -5.588   5.972  -0.902
  579    HE2  PHE  73           HE1      PHE  73  -8.984   3.387  -1.397
  580    HZ   PHE  73           HZ       PHE  73  -7.007   4.542  -2.350
  581    H    MET  74           HN       MET  74  -4.968   4.852   3.688
  582    HA   MET  74           HA       MET  74  -4.204   3.283   1.351
  583   1HB   MET  74           HB2      MET  74  -3.098   5.427   2.873
  584   2HB   MET  74           HB1      MET  74  -1.920   4.118   2.878
  585   1HG   MET  74           HG2      MET  74  -3.209   4.623   0.264
  586   2HG   MET  74           HG1      MET  74  -2.167   5.923   0.848
  587   1HE   MET  74           HE3      MET  74  -2.483   3.781  -1.367
  588   2HE   MET  74           HE2      MET  74  -0.854   3.341  -1.874
  589   3HE   MET  74           HE1      MET  74  -1.824   2.191  -0.959
  590    H    ALA  75           HN       ALA  75  -3.168   3.181   4.776
  591    HA   ALA  75           HA       ALA  75  -1.799   0.680   4.508
  592   1HB   ALA  75           HB1      ALA  75  -2.034   2.567   6.497
  593   2HB   ALA  75           HB3      ALA  75  -2.983   1.232   7.153
  594   3HB   ALA  75           HB2      ALA  75  -1.295   0.980   6.708
  595    H    PHE  76           HN       PHE  76  -5.106   1.445   4.508
  596    HA   PHE  76           HA       PHE  76  -6.045  -1.088   5.640
  597   1HB   PHE  76           HB2      PHE  76  -7.222   1.425   4.717
  598   2HB   PHE  76           HB1      PHE  76  -8.147   0.019   4.188
  599    HD1  PHE  76           HD1      PHE  76  -6.589   1.596   7.194
  600    HD2  PHE  76           HD2      PHE  76  -9.525  -1.164   5.701
  601    HE1  PHE  76           HE1      PHE  76  -7.522   1.354   9.478
  602    HE2  PHE  76           HE2      PHE  76 -10.459  -1.406   7.987
  603    HZ   PHE  76           HZ       PHE  76  -9.459  -0.147   9.874
  604    H    VAL  77           HN       VAL  77  -5.935   0.386   2.386
  605    HA   VAL  77           HA       VAL  77  -6.964  -1.905   0.994
  606    HB   VAL  77           HB       VAL  77  -5.157   0.348   0.062
  607   1HG1  VAL  77          HG12      VAL  77  -5.774  -2.098  -1.224
  608   2HG1  VAL  77          HG11      VAL  77  -6.789  -0.877  -1.989
  609   3HG1  VAL  77          HG13      VAL  77  -5.037  -0.670  -1.948
  610   1HG2  VAL  77          HG23      VAL  77  -8.063   0.001   0.490
  611   2HG2  VAL  77          HG22      VAL  77  -7.106   1.480   0.413
  612   3HG2  VAL  77          HG21      VAL  77  -7.629   0.691  -1.075
  613    H    SER  78           HN       SER  78  -3.766  -1.098   2.184
  614    HA   SER  78           HA       SER  78  -2.361  -3.014   0.523
  615   1HB   SER  78           HB2      SER  78  -1.368  -2.097   3.208
  616   2HB   SER  78           HB1      SER  78  -0.448  -2.439   1.746
  617    HG   SER  78           HG       SER  78  -1.683  -0.142   2.559
  618    H    MET  79           HN       MET  79  -3.246  -3.083   3.995
  619    HA   MET  79           HA       MET  79  -2.358  -5.671   4.560
  620   1HB   MET  79           HB2      MET  79  -4.327  -5.693   6.253
  621   2HB   MET  79           HB1      MET  79  -3.071  -4.469   6.433
  622   1HG   MET  79           HG2      MET  79  -4.526  -2.886   5.127
  623   2HG   MET  79           HG1      MET  79  -5.794  -4.102   5.155
  624   1HE   MET  79           HE3      MET  79  -3.069  -2.724   7.100
  625   2HE   MET  79           HE2      MET  79  -3.775  -1.795   8.419
  626   3HE   MET  79           HE1      MET  79  -3.441  -3.511   8.639
  627    H    VAL  80           HN       VAL  80  -5.490  -4.741   3.093
  628    HA   VAL  80           HA       VAL  80  -6.449  -7.478   3.086
  629    HB   VAL  80           HB       VAL  80  -8.090  -6.526   1.353
  630   1HG1  VAL  80          HG13      VAL  80  -7.793  -5.529   4.182
  631   2HG1  VAL  80          HG12      VAL  80  -9.190  -5.094   3.196
  632   3HG1  VAL  80          HG11      VAL  80  -8.866  -6.787   3.566
  633   1HG2  VAL  80          HG22      VAL  80  -6.215  -4.404   1.419
  634   2HG2  VAL  80          HG21      VAL  80  -7.749  -4.455   0.552
  635   3HG2  VAL  80          HG23      VAL  80  -7.683  -3.801   2.188
  636    H    THR  81           HN       THR  81  -4.847  -5.405   0.673
  637    HA   THR  81           HA       THR  81  -5.028  -7.321  -1.468
  638    HB   THR  81           HB       THR  81  -2.843  -5.254  -1.125
  639    HG1  THR  81           HG1      THR  81  -5.541  -4.984  -1.924
  640   1HG2  THR  81          HG23      THR  81  -3.261  -7.124  -3.086
  641   2HG2  THR  81          HG22      THR  81  -4.128  -5.732  -3.733
  642   3HG2  THR  81          HG21      THR  81  -2.416  -5.594  -3.328
  643    H    THR  82           HN       THR  82  -3.127  -7.185   1.373
  644    HA   THR  82           HA       THR  82  -1.483  -9.443   0.325
  645    HB   THR  82           HB       THR  82   0.020  -7.558   0.374
  646    HG1  THR  82           HG1      THR  82   1.447  -8.681   1.399
  647   1HG2  THR  82          HG21      THR  82  -1.571  -6.857   2.726
  648   2HG2  THR  82          HG23      THR  82   0.163  -6.683   3.001
  649   3HG2  THR  82          HG22      THR  82  -0.609  -5.823   1.670
  650    H    ALA  83           HN       ALA  83  -3.967  -9.230   2.005
  651    HA   ALA  83           HA       ALA  83  -3.501  -9.666   4.737
  652   1HB   ALA  83           HB1      ALA  83  -5.687  -9.859   3.019
  653   2HB   ALA  83           HB3      ALA  83  -5.509 -11.493   3.656
  654   3HB   ALA  83           HB2      ALA  83  -5.714 -10.134   4.761
  655    H    CYS  84           HN       CYS  84  -2.671 -11.654   2.032
  656    HA   CYS  84           HA       CYS  84  -1.228 -13.530   2.024
  657   1HB   CYS  84           HB2      CYS  84  -1.629 -13.773   5.006
  658   2HB   CYS  84           HB1      CYS  84  -0.298 -14.392   4.032
  659    HG   CYS  84           HG       CYS  84  -0.487 -11.579   5.149
  660    H    HIS  85           HN       HIS  85  -1.426 -15.920   3.324
  661    HA   HIS  85           HA       HIS  85  -2.795 -17.810   3.689
  662   1HB   HIS  85           HB2      HIS  85  -4.516 -15.847   4.407
  663   2HB   HIS  85           HB1      HIS  85  -5.314 -16.435   2.945
  664    HD1  HIS  85           HD1      HIS  85  -7.036 -18.118   3.578
  665    HD2  HIS  85           HD2      HIS  85  -3.606 -18.486   5.919
  666    HE1  HIS  85           HE1      HIS  85  -7.420 -20.103   5.101
  667    H    GLU  86           HN       GLU  86  -1.700 -18.405   1.648
  668    HA   GLU  86           HA       GLU  86  -1.770 -19.249  -0.540
  669   1HB   GLU  86           HB2      GLU  86  -4.110 -19.997   0.611
  670   2HB   GLU  86           HB1      GLU  86  -4.727 -19.012  -0.716
  671   1HG   GLU  86           HG2      GLU  86  -4.518 -21.289  -1.513
  672   2HG   GLU  86           HG1      GLU  86  -3.254 -20.327  -2.279
  673    H    PHE  87           HN       PHE  87  -0.928 -17.633  -1.824
  674    HA   PHE  87           HA       PHE  87  -2.801 -16.025  -3.380
  675   1HB   PHE  87           HB2      PHE  87  -2.113 -13.855  -2.687
  676   2HB   PHE  87           HB1      PHE  87  -2.399 -14.735  -1.186
  677    HD1  PHE  87           HD1      PHE  87  -0.075 -16.358  -0.765
  678    HD2  PHE  87           HD2      PHE  87  -0.301 -12.402  -2.423
  679    HE1  PHE  87           HE1      PHE  87   2.267 -15.934  -0.073
  680    HE2  PHE  87           HE2      PHE  87   2.043 -11.983  -1.728
  681    HZ   PHE  87           HZ       PHE  87   3.326 -13.745  -0.554
  682    H    PHE  88           HN       PHE  88  -0.865 -14.139  -4.310
  683    HA   PHE  88           HA       PHE  88   0.738 -14.068  -6.033
  684   1HB   PHE  88           HB2      PHE  88   1.912 -15.727  -3.834
  685   2HB   PHE  88           HB1      PHE  88   2.792 -15.607  -5.356
  686    HD1  PHE  88           HD1      PHE  88   0.695 -12.764  -4.664
  687    HD2  PHE  88           HD2      PHE  88   4.563 -14.462  -3.880
  688    HE1  PHE  88           HE1      PHE  88   1.542 -10.531  -3.995
  689    HE2  PHE  88           HE2      PHE  88   5.409 -12.229  -3.216
  690    HZ   PHE  88           HZ       PHE  88   3.900 -10.264  -3.274
  691    H    GLU  89           HN       GLU  89  -1.413 -16.072  -6.355
  692    HA   GLU  89           HA       GLU  89   0.093 -17.989  -8.086
  693   1HB   GLU  89           HB2      GLU  89  -1.077 -18.922  -5.936
  694   2HB   GLU  89           HB1      GLU  89  -2.562 -18.708  -6.866
  695   1HG   GLU  89           HG2      GLU  89  -2.118 -20.736  -7.767
  696   2HG   GLU  89           HG1      GLU  89  -0.846 -19.924  -8.678
  697    H    HIS  90           HN       HIS  90  -2.872 -16.134  -7.582
  698    HA   HIS  90           HA       HIS  90  -4.454 -15.337  -9.105
  699   1HB   HIS  90           HB2      HIS  90  -3.409 -14.128 -10.697
  700   2HB   HIS  90           HB1      HIS  90  -1.909 -14.887 -10.179
  701    HD1  HIS  90           HD1      HIS  90  -4.533 -15.022 -12.860
  702    HD2  HIS  90           HD2      HIS  90  -0.954 -16.943 -11.917
  703    HE1  HIS  90           HE1      HIS  90  -3.886 -16.373 -14.903
  704    H    GLU  91           HN       GLU  91  -3.794 -18.397  -8.833
  705    HA   GLU  91           HA       GLU  91  -4.405 -19.705 -11.256
  706   1HB   GLU  91           HB2      GLU  91  -4.983 -21.596  -9.912
  707   2HB   GLU  91           HB1      GLU  91  -3.712 -20.746  -9.038
  708   1HG   GLU  91           HG2      GLU  91  -5.427 -19.613  -7.661
  709   2HG   GLU  91           HG1      GLU  91  -6.689 -20.497  -8.519
  710   1H    MET   0           HT3      MET   0  -9.933  -3.819 -13.046
  711   2H    MET   0           HT2      MET   0 -11.050  -4.386 -14.195
  712   3H    MET   0           HT1      MET   0  -9.408  -4.808 -14.320
  713    HA   MET   0           HA       MET   0  -8.777  -2.789 -15.133
  714   1HB   MET   0           HB2      MET   0 -11.477  -3.625 -16.020
  715   2HB   MET   0           HB1      MET   0 -11.035  -1.967 -16.426
  716   1HG   MET   0           HG2      MET   0  -8.735  -3.218 -17.097
  717   2HG   MET   0           HG1      MET   0  -9.880  -4.526 -17.399
  718   1HE   MET   0           HE1      MET   0 -10.478  -5.004 -19.342
  719   2HE   MET   0           HE3      MET   0 -12.054  -4.201 -19.277
  720   3HE   MET   0           HE2      MET   0 -11.022  -4.011 -20.692
  721    H    SER   1           HN       SER   1  -8.495  -1.518 -13.159
  722    HA   SER   1           HA       SER   1 -10.298   0.794 -13.095
  723   1HB   SER   1           HB2      SER   1 -10.761   0.595 -10.667
  724   2HB   SER   1           HB1      SER   1 -11.454  -0.749 -11.572
  725    HG   SER   1           HG       SER   1 -10.120  -2.068 -10.607
  726    H    GLU   2           HN       GLU   2  -9.440   2.139 -10.943
  727    HA   GLU   2           HA       GLU   2  -6.638   2.678 -11.586
  728   1HB   GLU   2           HB2      GLU   2  -8.703   4.240 -10.702
  729   2HB   GLU   2           HB1      GLU   2  -7.818   3.970  -9.202
  730   1HG   GLU   2           HG2      GLU   2  -6.884   5.941 -10.219
  731   2HG   GLU   2           HG1      GLU   2  -5.709   4.643 -10.438
  732    H    LEU   3           HN       LEU   3  -8.440   1.319  -8.849
  733    HA   LEU   3           HA       LEU   3  -6.040   1.013  -7.210
  734   1HB   LEU   3           HB2      LEU   3  -8.523   1.246  -6.442
  735   2HB   LEU   3           HB1      LEU   3  -8.614  -0.484  -6.768
  736    HG   LEU   3           HG       LEU   3  -6.516  -0.716  -5.317
  737   1HD1  LEU   3          HD11      LEU   3  -7.224   2.172  -4.928
  738   2HD1  LEU   3          HD13      LEU   3  -6.577   1.267  -3.560
  739   3HD1  LEU   3          HD12      LEU   3  -5.634   1.417  -5.043
  740   1HD2  LEU   3          HD23      LEU   3  -9.314  -0.249  -4.558
  741   2HD2  LEU   3          HD22      LEU   3  -8.213  -1.531  -4.051
  742   3HD2  LEU   3          HD21      LEU   3  -8.186   0.031  -3.231
  743    H    GLU   4           HN       GLU   4  -8.217  -1.251  -8.921
  744    HA   GLU   4           HA       GLU   4  -6.817  -3.625  -8.353
  745   1HB   GLU   4           HB2      GLU   4  -8.950  -3.781  -9.435
  746   2HB   GLU   4           HB1      GLU   4  -8.406  -2.800 -10.794
  747   1HG   GLU   4           HG2      GLU   4  -6.877  -5.294 -10.203
  748   2HG   GLU   4           HG1      GLU   4  -8.474  -5.472 -10.933
  749    H    LYS   5           HN       LYS   5  -6.052  -1.107 -10.709
  750    HA   LYS   5           HA       LYS   5  -4.013  -2.756 -12.014
  751   1HB   LYS   5           HB2      LYS   5  -5.317  -0.255 -12.532
  752   2HB   LYS   5           HB1      LYS   5  -3.572   0.007 -12.546
  753   1HG   LYS   5           HG2      LYS   5  -3.254  -1.299 -14.396
  754   2HG   LYS   5           HG1      LYS   5  -4.517  -2.439 -13.932
  755   1HD   LYS   5           HD2      LYS   5  -6.249  -0.868 -14.635
  756   2HD   LYS   5           HD1      LYS   5  -5.026   0.347 -15.011
  757   1HE   LYS   5           HE2      LYS   5  -4.044  -1.601 -16.525
  758   2HE   LYS   5           HE1      LYS   5  -5.713  -2.171 -16.478
  759   1HZ   LYS   5           HZ2      LYS   5  -6.286   0.238 -17.068
  760   2HZ   LYS   5           HZ1      LYS   5  -4.659   0.370 -17.539
  761   3HZ   LYS   5           HZ3      LYS   5  -5.670  -0.762 -18.296
  762    H    ALA   6           HN       ALA   6  -3.942   0.098  -9.851
  763    HA   ALA   6           HA       ALA   6  -1.061   0.055  -9.600
  764   1HB   ALA   6           HB1      ALA   6  -2.732   1.998  -9.142
  765   2HB   ALA   6           HB3      ALA   6  -2.906   1.263  -7.549
  766   3HB   ALA   6           HB2      ALA   6  -1.328   1.834  -8.089
  767    H    MET   7           HN       MET   7  -3.545  -0.622  -7.108
  768    HA   MET   7           HA       MET   7  -1.899  -1.726  -5.159
  769   1HB   MET   7           HB2      MET   7  -4.325  -1.350  -4.861
  770   2HB   MET   7           HB1      MET   7  -4.665  -2.702  -5.947
  771   1HG   MET   7           HG2      MET   7  -4.783  -3.747  -3.865
  772   2HG   MET   7           HG1      MET   7  -3.101  -4.035  -4.301
  773   1HE   MET   7           HE3      MET   7  -1.402  -3.538  -3.487
  774   2HE   MET   7           HE2      MET   7  -0.911  -2.119  -2.563
  775   3HE   MET   7           HE1      MET   7  -1.410  -3.583  -1.719
  776    H    VAL   8           HN       VAL   8  -3.567  -3.552  -7.734
  777    HA   VAL   8           HA       VAL   8  -2.299  -6.045  -7.104
  778    HB   VAL   8           HB       VAL   8  -3.338  -5.192  -9.819
  779   1HG1  VAL   8          HG13      VAL   8  -2.010  -7.425  -9.275
  780   2HG1  VAL   8          HG12      VAL   8  -3.570  -7.926  -8.621
  781   3HG1  VAL   8          HG11      VAL   8  -3.435  -7.457 -10.315
  782   1HG2  VAL   8          HG23      VAL   8  -4.977  -4.744  -7.967
  783   2HG2  VAL   8          HG22      VAL   8  -5.522  -6.001  -9.078
  784   3HG2  VAL   8          HG21      VAL   8  -4.858  -6.441  -7.504
  785    H    ALA   9           HN       ALA   9  -1.289  -3.293  -9.031
  786    HA   ALA   9           HA       ALA   9   0.824  -4.623 -10.473
  787   1HB   ALA   9           HB2      ALA   9   0.319  -1.743  -9.704
  788   2HB   ALA   9           HB1      ALA   9   1.780  -2.226 -10.566
  789   3HB   ALA   9           HB3      ALA   9   0.195  -2.485 -11.299
  790    H    LEU  10           HN       LEU  10   0.587  -3.183  -7.263
  791    HA   LEU  10           HA       LEU  10   3.371  -3.112  -6.649
  792   1HB   LEU  10           HB2      LEU  10   0.887  -2.790  -5.231
  793   2HB   LEU  10           HB1      LEU  10   1.953  -3.843  -4.298
  794    HG   LEU  10           HG       LEU  10   2.994  -1.290  -5.514
  795   1HD1  LEU  10          HD11      LEU  10   0.992  -1.512  -3.455
  796   2HD1  LEU  10          HD13      LEU  10   2.488  -0.896  -2.751
  797   3HD1  LEU  10          HD12      LEU  10   1.740  -0.056  -4.110
  798   1HD2  LEU  10          HD22      LEU  10   3.840  -3.296  -3.463
  799   2HD2  LEU  10          HD21      LEU  10   4.802  -2.485  -4.698
  800   3HD2  LEU  10          HD23      LEU  10   4.340  -1.620  -3.232
  801    H    ILE  11           HN       ILE  11   0.924  -5.657  -6.050
  802    HA   ILE  11           HA       ILE  11   2.591  -7.596  -4.890
  803    HB   ILE  11           HB       ILE  11   0.278  -7.877  -6.827
  804   1HG1  ILE  11          HG12      ILE  11   0.232  -8.824  -4.000
  805   2HG1  ILE  11          HG11      ILE  11   0.247  -7.079  -4.255
  806   1HG2  ILE  11          HG21      ILE  11   2.164  -9.904  -5.795
  807   2HG2  ILE  11          HG23      ILE  11   0.459 -10.302  -5.579
  808   3HG2  ILE  11          HG22      ILE  11   1.091  -9.973  -7.193
  809   1HD1  ILE  11          HD12      ILE  11  -1.676  -8.900  -5.713
  810   2HD1  ILE  11          HD11      ILE  11  -2.062  -8.181  -4.149
  811   3HD1  ILE  11          HD13      ILE  11  -1.756  -7.146  -5.544
  812    H    ASP  12           HN       ASP  12   2.424  -6.447  -8.171
  813    HA   ASP  12           HA       ASP  12   3.866  -8.586  -9.438
  814   1HB   ASP  12           HB2      ASP  12   2.502  -6.625 -10.479
  815   2HB   ASP  12           HB1      ASP  12   4.000  -5.712 -10.338
  816    H    VAL  13           HN       VAL  13   4.916  -5.425  -8.145
  817    HA   VAL  13           HA       VAL  13   7.636  -5.508  -8.750
  818    HB   VAL  13           HB       VAL  13   6.258  -4.562  -6.221
  819   1HG1  VAL  13          HG13      VAL  13   9.152  -4.527  -7.038
  820   2HG1  VAL  13          HG12      VAL  13   8.500  -3.208  -6.066
  821   3HG1  VAL  13          HG11      VAL  13   8.450  -4.862  -5.455
  822   1HG2  VAL  13          HG23      VAL  13   6.246  -3.542  -8.781
  823   2HG2  VAL  13          HG22      VAL  13   5.979  -2.591  -7.318
  824   3HG2  VAL  13          HG21      VAL  13   7.587  -2.666  -8.040
  825    H    PHE  14           HN       PHE  14   6.004  -7.088  -5.993
  826    HA   PHE  14           HA       PHE  14   8.296  -8.183  -4.758
  827   1HB   PHE  14           HB2      PHE  14   5.604  -8.349  -4.292
  828   2HB   PHE  14           HB1      PHE  14   5.952  -9.984  -4.858
  829    HD1  PHE  14           HD1      PHE  14   6.904  -7.401  -2.354
  830    HD2  PHE  14           HD2      PHE  14   7.201 -11.524  -3.526
  831    HE1  PHE  14           HE1      PHE  14   7.907  -7.954  -0.153
  832    HE2  PHE  14           HE2      PHE  14   8.203 -12.078  -1.325
  833    HZ   PHE  14           HZ       PHE  14   8.555 -10.292   0.362
  834    H    HIS  15           HN       HIS  15   6.185  -9.760  -7.202
  835    HA   HIS  15           HA       HIS  15   7.816 -12.070  -7.539
  836   1HB   HIS  15           HB2      HIS  15   5.490 -11.829  -8.429
  837   2HB   HIS  15           HB1      HIS  15   6.105 -10.708  -9.644
  838    HD1  HIS  15           HD1      HIS  15   8.121 -13.704  -8.628
  839    HD2  HIS  15           HD2      HIS  15   5.639 -12.553 -11.775
  840    HE1  HIS  15           HE1      HIS  15   8.429 -15.433 -10.454
  841    H    GLN  16           HN       GLN  16   8.227  -8.805  -8.574
  842    HA   GLN  16           HA       GLN  16  10.108  -9.406 -10.731
  843   1HB   GLN  16           HB2      GLN  16   8.783  -7.067  -9.629
  844   2HB   GLN  16           HB1      GLN  16  10.500  -6.755  -9.883
  845   1HG   GLN  16           HG2      GLN  16   8.518  -7.785 -11.929
  846   2HG   GLN  16           HG1      GLN  16   9.316  -6.212 -11.930
  847   1HE2  GLN  16          HE22      GLN  16  12.559  -7.706 -12.761
  848   2HE2  GLN  16          HE21      GLN  16  11.918  -6.564 -11.681
  849    H    TYR  17           HN       TYR  17  10.255  -8.719  -7.298
  850    HA   TYR  17           HA       TYR  17  13.237  -8.725  -7.430
  851   1HB   TYR  17           HB2      TYR  17  11.280  -7.738  -5.345
  852   2HB   TYR  17           HB1      TYR  17  13.004  -7.918  -5.012
  853    HD1  TYR  17           HD2      TYR  17  14.668  -6.512  -6.146
  854    HD2  TYR  17           HD1      TYR  17  10.460  -6.031  -6.878
  855    HE1  TYR  17           HE2      TYR  17  15.105  -4.322  -7.225
  856    HE2  TYR  17           HE1      TYR  17  10.898  -3.842  -7.958
  857    HH   TYR  17           HH       TYR  17  13.603  -2.891  -9.150
  858    H    SER  18           HN       SER  18  11.097  -9.645  -4.750
  859    HA   SER  18           HA       SER  18  12.593 -11.728  -3.721
  860   1HB   SER  18           HB2      SER  18  10.054 -10.763  -3.267
  861   2HB   SER  18           HB1      SER  18   9.727 -12.393  -3.849
  862    HG   SER  18           HG       SER  18  10.088 -12.658  -1.723
  863    H    GLY  19           HN       GLY  19  10.546 -11.808  -6.592
  864   1HA   GLY  19           HA2      GLY  19  10.953 -14.707  -6.910
  865   2HA   GLY  19           HA1      GLY  19   9.991 -13.679  -7.968
  866    H    ARG  20           HN       ARG  20  13.405 -13.385  -6.933
  867    HA   ARG  20           HA       ARG  20  14.311 -14.025  -9.656
  868   1HB   ARG  20           HB2      ARG  20  15.234 -11.912 -10.195
  869   2HB   ARG  20           HB1      ARG  20  13.629 -11.534  -9.571
  870   1HG   ARG  20           HG2      ARG  20  14.718 -10.098  -8.190
  871   2HG   ARG  20           HG1      ARG  20  15.147 -11.543  -7.274
  872   1HD   ARG  20           HD2      ARG  20  17.312 -11.089  -7.697
  873   2HD   ARG  20           HD1      ARG  20  16.994 -11.421  -9.399
  874    HE   ARG  20           HE       ARG  20  17.208  -8.754  -8.167
  875   1HH1  ARG  20          HH11      ARG  20  15.351  -7.616  -9.589
  876   2HH1  ARG  20          HH12      ARG  20  15.757  -7.675 -11.271
  877   1HH2  ARG  20          HH21      ARG  20  18.134 -10.171 -10.885
  878   2HH2  ARG  20          HH22      ARG  20  17.332  -9.120 -12.005
  879    H    GLU  21           HN       GLU  21  14.682 -14.755  -6.681
  880    HA   GLU  21           HA       GLU  21  17.655 -14.846  -6.828
  881   1HB   GLU  21           HB2      GLU  21  16.917 -13.018  -5.266
  882   2HB   GLU  21           HB1      GLU  21  16.104 -14.246  -4.294
  883   1HG   GLU  21           HG2      GLU  21  18.055 -15.041  -3.440
  884   2HG   GLU  21           HG1      GLU  21  18.910 -14.866  -4.972
  885    H    GLY  22           HN       GLY  22  15.156 -15.935  -4.502
  886   1HA   GLY  22           HA2      GLY  22  15.588 -18.732  -5.263
  887   2HA   GLY  22           HA1      GLY  22  16.216 -18.310  -3.669
  888    H    ASP  23           HN       ASP  23  14.723 -17.766  -2.001
  889    HA   ASP  23           HA       ASP  23  12.277 -19.147  -1.951
  890   1HB   ASP  23           HB2      ASP  23  12.983 -16.630  -0.411
  891   2HB   ASP  23           HB1      ASP  23  11.760 -17.817   0.033
  892    H    LYS  24           HN       LYS  24  10.061 -18.035  -1.697
  893    HA   LYS  24           HA       LYS  24   9.821 -15.719  -3.563
  894   1HB   LYS  24           HB2      LYS  24   8.450 -18.386  -3.687
  895   2HB   LYS  24           HB1      LYS  24   7.586 -16.951  -4.238
  896   1HG   LYS  24           HG2      LYS  24  10.334 -17.033  -5.229
  897   2HG   LYS  24           HG1      LYS  24   9.396 -18.437  -5.741
  898   1HD   LYS  24           HD2      LYS  24   7.965 -15.858  -5.928
  899   2HD   LYS  24           HD1      LYS  24   9.343 -16.022  -7.017
  900   1HE   LYS  24           HE2      LYS  24   7.984 -17.206  -8.377
  901   2HE   LYS  24           HE1      LYS  24   8.048 -18.493  -7.174
  902   1HZ   LYS  24           HZ1      LYS  24   6.119 -16.245  -7.053
  903   2HZ   LYS  24           HZ3      LYS  24   5.768 -17.730  -7.793
  904   3HZ   LYS  24           HZ2      LYS  24   6.108 -17.671  -6.129
  905    H    HIS  25           HN       HIS  25   9.803 -15.615  -0.716
  906    HA   HIS  25           HA       HIS  25   7.250 -14.285  -0.302
  907   1HB   HIS  25           HB2      HIS  25   6.880 -16.850   0.071
  908   2HB   HIS  25           HB1      HIS  25   7.748 -16.578   1.582
  909    HD1  HIS  25           HD1      HIS  25   6.478 -15.478   3.470
  910    HD2  HIS  25           HD2      HIS  25   4.435 -15.238  -0.156
  911    HE1  HIS  25           HE1      HIS  25   4.187 -14.538   3.999
  912    H    LYS  26           HN       LYS  26  10.283 -13.970  -0.028
  913    HA   LYS  26           HA       LYS  26  10.162 -12.585   2.576
  914   1HB   LYS  26           HB2      LYS  26  12.201 -13.630   3.421
  915   2HB   LYS  26           HB1      LYS  26  11.003 -14.882   3.085
  916   1HG   LYS  26           HG2      LYS  26  12.167 -15.709   1.276
  917   2HG   LYS  26           HG1      LYS  26  12.859 -14.138   0.870
  918   1HD   LYS  26           HD2      LYS  26  14.610 -15.621   1.731
  919   2HD   LYS  26           HD1      LYS  26  14.336 -14.294   2.861
  920   1HE   LYS  26           HE2      LYS  26  12.993 -15.706   4.295
  921   2HE   LYS  26           HE1      LYS  26  13.027 -17.016   3.114
  922   1HZ   LYS  26           HZ1      LYS  26  15.406 -15.892   4.495
  923   2HZ   LYS  26           HZ3      LYS  26  14.637 -17.346   4.903
  924   3HZ   LYS  26           HZ2      LYS  26  15.406 -17.189   3.397
  925    H    LEU  27           HN       LEU  27  11.770 -10.928   2.751
  926    HA   LEU  27           HA       LEU  27  13.532 -10.525   0.396
  927   1HB   LEU  27           HB2      LEU  27  11.118  -9.218   0.520
  928   2HB   LEU  27           HB1      LEU  27  12.193  -8.060   1.308
  929    HG   LEU  27           HG       LEU  27  13.740  -8.792  -0.801
  930   1HD1  LEU  27          HD12      LEU  27  10.847  -9.120  -1.600
  931   2HD1  LEU  27          HD11      LEU  27  12.077  -8.654  -2.776
  932   3HD1  LEU  27          HD13      LEU  27  12.204 -10.196  -1.930
  933   1HD2  LEU  27          HD23      LEU  27  12.655  -6.504   0.092
  934   2HD2  LEU  27          HD22      LEU  27  13.425  -6.613  -1.490
  935   3HD2  LEU  27          HD21      LEU  27  11.670  -6.715  -1.356
  936    H    LYS  28           HN       LYS  28  14.179  -7.815   1.257
  937    HA   LYS  28           HA       LYS  28  15.258  -8.217   3.995
  938   1HB   LYS  28           HB2      LYS  28  16.811  -8.474   1.596
  939   2HB   LYS  28           HB1      LYS  28  17.326  -7.014   2.444
  940   1HG   LYS  28           HG2      LYS  28  17.455  -8.404   4.557
  941   2HG   LYS  28           HG1      LYS  28  17.201  -9.831   3.549
  942   1HD   LYS  28           HD2      LYS  28  19.461  -7.832   3.227
  943   2HD   LYS  28           HD1      LYS  28  19.610  -9.438   3.938
  944   1HE   LYS  28           HE2      LYS  28  18.716 -10.372   1.752
  945   2HE   LYS  28           HE1      LYS  28  18.896  -8.753   1.078
  946   1HZ   LYS  28           HZ3      LYS  28  21.122 -10.167   2.421
  947   2HZ   LYS  28           HZ2      LYS  28  20.823 -10.323   0.756
  948   3HZ   LYS  28           HZ1      LYS  28  21.205  -8.803   1.417
  949    H    LYS  29           HN       LYS  29  15.100  -6.332   5.145
  950    HA   LYS  29           HA       LYS  29  13.746  -4.068   4.219
  951   1HB   LYS  29           HB2      LYS  29  14.924  -2.841   6.111
  952   2HB   LYS  29           HB1      LYS  29  14.084  -4.321   6.578
  953   1HG   LYS  29           HG2      LYS  29  16.451  -5.417   6.040
  954   2HG   LYS  29           HG1      LYS  29  17.022  -3.784   6.392
  955   1HD   LYS  29           HD2      LYS  29  16.994  -5.185   8.429
  956   2HD   LYS  29           HD1      LYS  29  15.871  -3.832   8.558
  957   1HE   LYS  29           HE2      LYS  29  14.559  -6.102   7.336
  958   2HE   LYS  29           HE1      LYS  29  15.274  -6.568   8.879
  959   1HZ   LYS  29           HZ1      LYS  29  13.487  -4.237   8.440
  960   2HZ   LYS  29           HZ3      LYS  29  13.034  -5.703   9.163
  961   3HZ   LYS  29           HZ2      LYS  29  14.172  -4.697   9.925
  962    H    SER  30           HN       SER  30  17.110  -4.931   3.789
  963    HA   SER  30           HA       SER  30  18.054  -2.310   3.036
  964   1HB   SER  30           HB2      SER  30  19.133  -4.962   3.222
  965   2HB   SER  30           HB1      SER  30  19.529  -4.308   1.635
  966    HG   SER  30           HG       SER  30  20.322  -2.439   2.722
  967    H    GLU  31           HN       GLU  31  16.774  -5.061   1.146
  968    HA   GLU  31           HA       GLU  31  17.095  -3.675  -1.389
  969   1HB   GLU  31           HB2      GLU  31  17.012  -6.128  -1.332
  970   2HB   GLU  31           HB1      GLU  31  15.397  -6.077  -0.621
  971   1HG   GLU  31           HG2      GLU  31  14.439  -5.172  -2.602
  972   2HG   GLU  31           HG1      GLU  31  16.021  -4.775  -3.275
  973    H    LEU  32           HN       LEU  32  14.759  -3.747   1.158
  974    HA   LEU  32           HA       LEU  32  12.539  -2.698  -0.403
  975   1HB   LEU  32           HB2      LEU  32  11.926  -3.811   1.614
  976   2HB   LEU  32           HB1      LEU  32  13.123  -2.923   2.557
  977    HG   LEU  32           HG       LEU  32  11.877  -0.868   2.348
  978   1HD1  LEU  32          HD12      LEU  32  10.809  -2.182   0.029
  979   2HD1  LEU  32          HD11      LEU  32   9.471  -1.697   1.071
  980   3HD1  LEU  32          HD13      LEU  32  10.633  -0.495   0.513
  981   1HD2  LEU  32          HD21      LEU  32  10.480  -3.341   3.237
  982   2HD2  LEU  32          HD23      LEU  32  10.876  -1.882   4.148
  983   3HD2  LEU  32          HD22      LEU  32   9.480  -1.897   3.068
  984    H    LYS  33           HN       LYS  33  15.197  -1.412   1.499
  985    HA   LYS  33           HA       LYS  33  14.388   1.319   1.635
  986   1HB   LYS  33           HB2      LYS  33  16.391   0.123   2.773
  987   2HB   LYS  33           HB1      LYS  33  17.253   0.424   1.270
  988   1HG   LYS  33           HG2      LYS  33  16.417   2.884   1.576
  989   2HG   LYS  33           HG1      LYS  33  16.181   2.411   3.259
  990   1HD   LYS  33           HD2      LYS  33  18.509   1.790   3.481
  991   2HD   LYS  33           HD1      LYS  33  18.785   2.030   1.755
  992   1HE   LYS  33           HE2      LYS  33  18.156   4.440   2.047
  993   2HE   LYS  33           HE1      LYS  33  18.069   4.163   3.787
  994   1HZ   LYS  33           HZ3      LYS  33  20.448   3.171   3.351
  995   2HZ   LYS  33           HZ2      LYS  33  20.406   4.234   2.027
  996   3HZ   LYS  33           HZ1      LYS  33  20.219   4.833   3.607
  997    H    GLU  34           HN       GLU  34  16.319  -0.471  -0.744
  998    HA   GLU  34           HA       GLU  34  16.608   1.794  -2.530
  999   1HB   GLU  34           HB2      GLU  34  17.886   0.345  -3.809
 1000   2HB   GLU  34           HB1      GLU  34  17.912  -0.547  -2.291
 1001   1HG   GLU  34           HG2      GLU  34  17.244  -2.246  -3.680
 1002   2HG   GLU  34           HG1      GLU  34  15.662  -1.584  -3.285
 1003    H    LEU  35           HN       LEU  35  14.308  -0.762  -2.043
 1004    HA   LEU  35           HA       LEU  35  12.870  -0.672  -4.486
 1005   1HB   LEU  35           HB2      LEU  35  12.615  -2.062  -2.158
 1006   2HB   LEU  35           HB1      LEU  35  11.281  -0.916  -1.989
 1007    HG   LEU  35           HG       LEU  35  10.610  -3.040  -3.133
 1008   1HD1  LEU  35          HD11      LEU  35   9.950  -0.423  -3.762
 1009   2HD1  LEU  35          HD13      LEU  35  10.310  -1.135  -5.336
 1010   3HD1  LEU  35          HD12      LEU  35   9.077  -1.859  -4.303
 1011   1HD2  LEU  35          HD21      LEU  35  13.029  -2.740  -4.457
 1012   2HD2  LEU  35          HD23      LEU  35  11.749  -3.867  -4.908
 1013   3HD2  LEU  35          HD22      LEU  35  11.845  -2.285  -5.681
 1014    H    ILE  36           HN       ILE  36  12.640   1.353  -1.570
 1015    HA   ILE  36           HA       ILE  36  10.470   2.969  -2.692
 1016    HB   ILE  36           HB       ILE  36  12.092   3.972  -0.403
 1017   1HG1  ILE  36          HG12      ILE  36  10.585   1.359  -0.424
 1018   2HG1  ILE  36          HG11      ILE  36  12.153   1.729   0.288
 1019   1HG2  ILE  36          HG23      ILE  36   9.818   4.817  -1.451
 1020   2HG2  ILE  36          HG22      ILE  36   9.123   3.542  -0.450
 1021   3HG2  ILE  36          HG21      ILE  36  10.053   4.842   0.297
 1022   1HD1  ILE  36          HD12      ILE  36  10.843   3.346   1.834
 1023   2HD1  ILE  36          HD11      ILE  36   9.413   2.450   1.317
 1024   3HD1  ILE  36          HD13      ILE  36  10.721   1.615   2.156
 1025    H    ASN  37           HN       ASN  37  13.791   3.790  -1.625
 1026    HA   ASN  37           HA       ASN  37  13.813   6.331  -2.938
 1027   1HB   ASN  37           HB2      ASN  37  15.337   5.419  -1.049
 1028   2HB   ASN  37           HB1      ASN  37  16.316   4.766  -2.364
 1029   1HD2  ASN  37          HD22      ASN  37  17.485   8.259  -1.579
 1030   2HD2  ASN  37          HD21      ASN  37  17.318   6.844  -0.656
 1031    H    ASN  38           HN       ASN  38  13.860   3.310  -4.401
 1032    HA   ASN  38           HA       ASN  38  15.397   4.427  -6.712
 1033   1HB   ASN  38           HB2      ASN  38  16.205   2.260  -5.437
 1034   2HB   ASN  38           HB1      ASN  38  14.952   1.478  -6.399
 1035   1HD2  ASN  38          HD22      ASN  38  16.776   1.690  -9.422
 1036   2HD2  ASN  38          HD21      ASN  38  15.326   1.226  -8.670
 1037    H    GLU  39           HN       GLU  39  13.128   1.666  -6.437
 1038    HA   GLU  39           HA       GLU  39  11.907   2.003  -8.923
 1039   1HB   GLU  39           HB2      GLU  39  10.566   1.137  -6.341
 1040   2HB   GLU  39           HB1      GLU  39   9.928   0.860  -7.962
 1041   1HG   GLU  39           HG2      GLU  39  12.654  -0.112  -7.072
 1042   2HG   GLU  39           HG1      GLU  39  11.197  -1.099  -6.972
 1043    H    LEU  40           HN       LEU  40  10.590   3.274  -5.832
 1044    HA   LEU  40           HA       LEU  40   8.726   5.019  -7.193
 1045   1HB   LEU  40           HB2      LEU  40   9.604   4.563  -4.382
 1046   2HB   LEU  40           HB1      LEU  40   8.896   6.138  -4.745
 1047    HG   LEU  40           HG       LEU  40   7.603   3.493  -5.463
 1048   1HD1  LEU  40          HD13      LEU  40   7.895   4.391  -2.923
 1049   2HD1  LEU  40          HD12      LEU  40   6.439   5.272  -3.387
 1050   3HD1  LEU  40          HD11      LEU  40   6.468   3.510  -3.474
 1051   1HD2  LEU  40          HD21      LEU  40   7.176   5.897  -6.612
 1052   2HD2  LEU  40          HD23      LEU  40   5.882   4.725  -6.358
 1053   3HD2  LEU  40          HD22      LEU  40   6.106   6.055  -5.220
 1054    H    SER  41           HN       SER  41  10.701   6.597  -4.797
 1055    HA   SER  41           HA       SER  41  12.214   8.384  -4.971
 1056   1HB   SER  41           HB2      SER  41  13.228   6.674  -6.686
 1057   2HB   SER  41           HB1      SER  41  12.594   7.791  -7.890
 1058    HG   SER  41           HG       SER  41  14.174   9.086  -7.425
 1059    H    HIS  42           HN       HIS  42   9.286   8.243  -6.486
 1060    HA   HIS  42           HA       HIS  42   9.347  10.487  -8.257
 1061   1HB   HIS  42           HB2      HIS  42   7.427   8.683  -7.520
 1062   2HB   HIS  42           HB1      HIS  42   6.878  10.127  -6.667
 1063    HD1  HIS  42           HD1      HIS  42   6.430  12.283  -8.156
 1064    HD2  HIS  42           HD2      HIS  42   7.083   8.769 -10.303
 1065    HE1  HIS  42           HE1      HIS  42   5.649  12.734 -10.524
 1066    H    PHE  43           HN       PHE  43   9.571  10.234  -4.851
 1067    HA   PHE  43           HA       PHE  43   9.318  13.204  -4.626
 1068   1HB   PHE  43           HB2      PHE  43   8.679  11.391  -2.312
 1069   2HB   PHE  43           HB1      PHE  43   8.122  13.036  -2.622
 1070    HD1  PHE  43           HD2      PHE  43   7.736   9.481  -3.631
 1071    HD2  PHE  43           HD1      PHE  43   6.184  13.473  -3.971
 1072    HE1  PHE  43           HE2      PHE  43   5.690   8.595  -4.717
 1073    HE2  PHE  43           HE1      PHE  43   4.140  12.585  -5.057
 1074    HZ   PHE  43           HZ       PHE  43   3.892  10.147  -5.431
 1075    H    LEU  44           HN       LEU  44  10.090  12.685  -1.675
 1076    HA   LEU  44           HA       LEU  44  12.067  12.351  -0.421
 1077   1HB   LEU  44           HB2      LEU  44  12.332  10.523  -2.505
 1078   2HB   LEU  44           HB1      LEU  44  13.806  11.487  -2.609
 1079    HG   LEU  44           HG       LEU  44  13.234  10.926   0.154
 1080   1HD1  LEU  44          HD11      LEU  44  12.269   8.889  -1.468
 1081   2HD1  LEU  44          HD13      LEU  44  13.895   8.342  -1.057
 1082   3HD1  LEU  44          HD12      LEU  44  12.740   8.718   0.223
 1083   1HD2  LEU  44          HD23      LEU  44  15.413  10.846  -1.775
 1084   2HD2  LEU  44          HD22      LEU  44  15.479  11.109  -0.033
 1085   3HD2  LEU  44          HD21      LEU  44  15.481   9.467  -0.678
 1086    H    GLU  45           HN       GLU  45  11.491  14.848  -1.344
 1087    HA   GLU  45           HA       GLU  45  14.082  15.884  -2.420
 1088   1HB   GLU  45           HB2      GLU  45  12.408  18.055  -2.418
 1089   2HB   GLU  45           HB1      GLU  45  12.638  16.998  -3.808
 1090   1HG   GLU  45           HG2      GLU  45  10.551  16.387  -1.714
 1091   2HG   GLU  45           HG1      GLU  45  10.211  17.476  -3.055
 1092    H    GLU  46           HN       GLU  46  11.495  16.850  -0.198
 1093    HA   GLU  46           HA       GLU  46  13.591  17.822   1.701
 1094   1HB   GLU  46           HB2      GLU  46  10.778  18.766   1.117
 1095   2HB   GLU  46           HB1      GLU  46  11.543  19.112   2.668
 1096   1HG   GLU  46           HG2      GLU  46  13.505  19.753   0.791
 1097   2HG   GLU  46           HG1      GLU  46  12.009  20.348   0.069
 1098    H    ILE  47           HN       ILE  47  12.485  15.118   1.216
 1099    HA   ILE  47           HA       ILE  47  11.859  13.274   2.491
 1100    HB   ILE  47           HB       ILE  47  12.328  15.322   4.647
 1101   1HG1  ILE  47          HG12      ILE  47  13.742  13.042   3.365
 1102   2HG1  ILE  47          HG11      ILE  47  14.395  14.542   4.016
 1103   1HG2  ILE  47          HG21      ILE  47  10.451  13.862   5.382
 1104   2HG2  ILE  47          HG23      ILE  47  11.444  12.443   5.050
 1105   3HG2  ILE  47          HG22      ILE  47  11.915  13.570   6.323
 1106   1HD1  ILE  47          HD12      ILE  47  14.095  13.672   6.310
 1107   2HD1  ILE  47          HD11      ILE  47  13.454  12.167   5.649
 1108   3HD1  ILE  47          HD13      ILE  47  15.135  12.614   5.353
 1109    H    LYS  48           HN       LYS  48   9.887  12.345   3.075
 1110    HA   LYS  48           HA       LYS  48   7.536  13.986   2.572
 1111   1HB   LYS  48           HB2      LYS  48   7.323  11.208   3.665
 1112   2HB   LYS  48           HB1      LYS  48   6.390  11.980   2.383
 1113   1HG   LYS  48           HG2      LYS  48   8.918  12.002   1.313
 1114   2HG   LYS  48           HG1      LYS  48   8.935  10.494   2.225
 1115   1HD   LYS  48           HD2      LYS  48   6.527  10.227   1.082
 1116   2HD   LYS  48           HD1      LYS  48   7.281  11.259  -0.135
 1117   1HE   LYS  48           HE2      LYS  48   9.137   9.691  -0.371
 1118   2HE   LYS  48           HE1      LYS  48   8.483   8.683   0.920
 1119   1HZ   LYS  48           HZ1      LYS  48   6.607   9.256  -1.191
 1120   2HZ   LYS  48           HZ3      LYS  48   7.956   8.363  -1.702
 1121   3HZ   LYS  48           HZ2      LYS  48   6.982   7.778  -0.440
 1122    H    GLU  49           HN       GLU  49   8.031  11.723   5.296
 1123    HA   GLU  49           HA       GLU  49   6.997  13.895   7.082
 1124   1HB   GLU  49           HB2      GLU  49   5.678  11.531   6.550
 1125   2HB   GLU  49           HB1      GLU  49   6.566  11.139   8.018
 1126   1HG   GLU  49           HG2      GLU  49   4.627  13.424   7.601
 1127   2HG   GLU  49           HG1      GLU  49   4.448  12.059   8.700
 1128    H    GLN  50           HN       GLN  50   8.813  14.551   8.168
 1129    HA   GLN  50           HA       GLN  50  11.164  13.133   8.599
 1130   1HB   GLN  50           HB2      GLN  50  10.731  15.549   9.236
 1131   2HB   GLN  50           HB1      GLN  50   9.923  14.949  10.685
 1132   1HG   GLN  50           HG2      GLN  50  12.542  13.708  10.251
 1133   2HG   GLN  50           HG1      GLN  50  12.641  15.456  10.456
 1134   1HE2  GLN  50          HE22      GLN  50  12.736  14.288  13.907
 1135   2HE2  GLN  50          HE21      GLN  50  13.766  14.477  12.571
 1136    H    GLU  51           HN       GLU  51   8.113  12.858  10.339
 1137    HA   GLU  51           HA       GLU  51   9.267  11.088  12.366
 1138   1HB   GLU  51           HB2      GLU  51   6.991  12.663  12.250
 1139   2HB   GLU  51           HB1      GLU  51   6.353  11.022  12.114
 1140   1HG   GLU  51           HG2      GLU  51   8.195  10.662  14.080
 1141   2HG   GLU  51           HG1      GLU  51   7.726  12.334  14.393
 1142    H    VAL  52           HN       VAL  52   6.631  10.519   9.969
 1143    HA   VAL  52           HA       VAL  52   6.624   7.706  10.201
 1144    HB   VAL  52           HB       VAL  52   6.207   9.141   7.562
 1145   1HG1  VAL  52          HG11      VAL  52   5.251   6.585   8.835
 1146   2HG1  VAL  52          HG13      VAL  52   4.296   7.360   7.572
 1147   3HG1  VAL  52          HG12      VAL  52   5.945   6.833   7.232
 1148   1HG2  VAL  52          HG23      VAL  52   4.936   9.765  10.006
 1149   2HG2  VAL  52          HG22      VAL  52   4.438  10.253   8.386
 1150   3HG2  VAL  52          HG21      VAL  52   3.788   8.779   9.099
 1151    H    VAL  53           HN       VAL  53   8.232   9.595   7.647
 1152    HA   VAL  53           HA       VAL  53   9.732   7.493   6.525
 1153    HB   VAL  53           HB       VAL  53  10.340  10.448   6.787
 1154   1HG1  VAL  53          HG11      VAL  53  11.845   8.243   5.367
 1155   2HG1  VAL  53          HG13      VAL  53  11.941   9.921   4.830
 1156   3HG1  VAL  53          HG12      VAL  53  12.483   9.481   6.450
 1157   1HG2  VAL  53          HG21      VAL  53   9.354   8.712   4.496
 1158   2HG2  VAL  53          HG23      VAL  53   8.378   9.854   5.420
 1159   3HG2  VAL  53          HG22      VAL  53   9.683  10.442   4.388
 1160    H    ASP  54           HN       ASP  54  10.249   9.241   9.512
 1161    HA   ASP  54           HA       ASP  54  13.037   8.557   9.817
 1162   1HB   ASP  54           HB2      ASP  54  10.937   9.752  11.473
 1163   2HB   ASP  54           HB1      ASP  54  12.036   8.731  12.393
 1164    H    LYS  55           HN       LYS  55  10.014   6.955  10.799
 1165    HA   LYS  55           HA       LYS  55  11.313   4.909  12.341
 1166   1HB   LYS  55           HB2      LYS  55   8.696   5.673  11.911
 1167   2HB   LYS  55           HB1      LYS  55   8.782   4.115  11.088
 1168   1HG   LYS  55           HG2      LYS  55   9.132   2.954  13.031
 1169   2HG   LYS  55           HG1      LYS  55  10.079   4.254  13.757
 1170   1HD   LYS  55           HD2      LYS  55   8.231   4.662  15.006
 1171   2HD   LYS  55           HD1      LYS  55   7.576   5.397  13.543
 1172   1HE   LYS  55           HE2      LYS  55   6.300   3.519  13.007
 1173   2HE   LYS  55           HE1      LYS  55   7.335   2.429  13.928
 1174   1HZ   LYS  55           HZ3      LYS  55   5.962   4.531  15.412
 1175   2HZ   LYS  55           HZ2      LYS  55   5.004   3.257  14.823
 1176   3HZ   LYS  55           HZ1      LYS  55   6.308   2.934  15.863
 1177    H    VAL  56           HN       VAL  56  10.053   4.829   8.962
 1178    HA   VAL  56           HA       VAL  56  11.016   2.127   8.574
 1179    HB   VAL  56           HB       VAL  56  10.540   2.572   6.188
 1180   1HG1  VAL  56          HG11      VAL  56   8.636   3.100   8.377
 1181   2HG1  VAL  56          HG13      VAL  56   8.121   3.700   6.801
 1182   3HG1  VAL  56          HG12      VAL  56   8.499   1.990   7.013
 1183   1HG2  VAL  56          HG23      VAL  56  10.416   5.392   7.214
 1184   2HG2  VAL  56          HG22      VAL  56  11.226   4.772   5.776
 1185   3HG2  VAL  56          HG21      VAL  56   9.469   4.930   5.800
 1186    H    MET  57           HN       MET  57  12.219   5.320   7.644
 1187    HA   MET  57           HA       MET  57  14.583   4.374   6.334
 1188   1HB   MET  57           HB2      MET  57  13.489   6.733   6.302
 1189   2HB   MET  57           HB1      MET  57  14.391   7.008   7.794
 1190   1HG   MET  57           HG2      MET  57  15.652   7.788   5.804
 1191   2HG   MET  57           HG1      MET  57  16.495   6.486   6.642
 1192   1HE   MET  57           HE3      MET  57  14.260   7.611   3.848
 1193   2HE   MET  57           HE2      MET  57  14.166   6.281   2.696
 1194   3HE   MET  57           HE1      MET  57  13.276   6.186   4.214
 1195    H    GLU  58           HN       GLU  58  13.743   4.819   9.704
 1196    HA   GLU  58           HA       GLU  58  16.513   4.837  10.632
 1197   1HB   GLU  58           HB2      GLU  58  13.829   4.693  11.930
 1198   2HB   GLU  58           HB1      GLU  58  15.192   4.039  12.831
 1199   1HG   GLU  58           HG2      GLU  58  16.411   6.233  12.288
 1200   2HG   GLU  58           HG1      GLU  58  14.836   6.858  11.803
 1201    H    THR  59           HN       THR  59  13.901   2.349  10.795
 1202    HA   THR  59           HA       THR  59  15.628   0.259  11.703
 1203    HB   THR  59           HB       THR  59  13.401  -0.436   9.842
 1204    HG1  THR  59           HG1      THR  59  12.967   0.695  12.403
 1205   1HG2  THR  59          HG23      THR  59  14.339  -1.317  12.580
 1206   2HG2  THR  59          HG22      THR  59  12.878  -1.942  11.813
 1207   3HG2  THR  59          HG21      THR  59  14.452  -2.214  11.065
 1208    H    LEU  60           HN       LEU  60  15.047   1.659   8.592
 1209    HA   LEU  60           HA       LEU  60  16.176  -0.404   6.949
 1210   1HB   LEU  60           HB2      LEU  60  15.504   2.493   6.669
 1211   2HB   LEU  60           HB1      LEU  60  16.599   1.798   5.477
 1212    HG   LEU  60           HG       LEU  60  13.858   0.712   6.198
 1213   1HD1  LEU  60          HD13      LEU  60  14.713   2.779   4.379
 1214   2HD1  LEU  60          HD12      LEU  60  14.066   1.416   3.465
 1215   3HD1  LEU  60          HD11      LEU  60  13.079   2.198   4.700
 1216   1HD2  LEU  60          HD23      LEU  60  16.144  -0.489   4.937
 1217   2HD2  LEU  60          HD22      LEU  60  14.549  -1.193   5.217
 1218   3HD2  LEU  60          HD21      LEU  60  14.868  -0.294   3.735
 1219    H    ASP  61           HN       ASP  61  17.557   2.689   8.090
 1220    HA   ASP  61           HA       ASP  61  20.256   1.878   7.320
 1221   1HB   ASP  61           HB2      ASP  61  18.987   4.309   7.783
 1222   2HB   ASP  61           HB1      ASP  61  20.061   4.135   9.173
 1223    H    GLU  62           HN       GLU  62  18.306   0.984   9.845
 1224    HA   GLU  62           HA       GLU  62  20.252   1.155  12.009
 1225   1HB   GLU  62           HB2      GLU  62  17.609   0.910  12.093
 1226   2HB   GLU  62           HB1      GLU  62  17.995  -0.810  12.068
 1227   1HG   GLU  62           HG2      GLU  62  19.695  -0.224  13.951
 1228   2HG   GLU  62           HG1      GLU  62  18.756   1.260  14.121
 1229    H    ASP  63           HN       ASP  63  19.178  -1.364   9.751
 1230    HA   ASP  63           HA       ASP  63  21.647  -2.872  10.451
 1231   1HB   ASP  63           HB2      ASP  63  19.078  -3.663  11.244
 1232   2HB   ASP  63           HB1      ASP  63  19.442  -4.661   9.836
 1233    H    GLY  64           HN       GLY  64  18.885  -2.659   8.213
 1234   1HA   GLY  64           HA2      GLY  64  18.794  -2.939   5.884
 1235   2HA   GLY  64           HA1      GLY  64  20.485  -2.432   5.875
 1236    H    ASP  65           HN       ASP  65  19.888  -5.157   7.850
 1237    HA   ASP  65           HA       ASP  65  20.636  -7.018   5.643
 1238   1HB   ASP  65           HB2      ASP  65  22.564  -6.188   7.218
 1239   2HB   ASP  65           HB1      ASP  65  21.838  -7.294   8.383
 1240    H    GLY  66           HN       GLY  66  18.300  -6.298   7.705
 1241   1HA   GLY  66           HA2      GLY  66  17.905  -8.958   8.905
 1242   2HA   GLY  66           HA1      GLY  66  16.872  -7.552   9.152
 1243    H    GLU  67           HN       GLU  67  15.922 -10.188   8.486
 1244    HA   GLU  67           HA       GLU  67  15.167 -10.053   5.635
 1245   1HB   GLU  67           HB2      GLU  67  14.340 -12.057   7.758
 1246   2HB   GLU  67           HB1      GLU  67  14.139 -12.232   6.014
 1247   1HG   GLU  67           HG2      GLU  67  16.326 -12.787   5.687
 1248   2HG   GLU  67           HG1      GLU  67  16.899 -11.642   6.901
 1249    H    CYS  68           HN       CYS  68  13.179  -9.352   4.930
 1250    HA   CYS  68           HA       CYS  68  11.230  -8.520   7.040
 1251   1HB   CYS  68           HB2      CYS  68  12.337  -7.067   4.912
 1252   2HB   CYS  68           HB1      CYS  68  10.698  -7.455   4.388
 1253    HG   CYS  68           HG       CYS  68  11.134  -6.163   7.197
 1254    H    ASP  69           HN       ASP  69   8.888  -8.433   5.923
 1255    HA   ASP  69           HA       ASP  69   8.513 -11.080   4.572
 1256   1HB   ASP  69           HB2      ASP  69   6.724  -9.641   6.556
 1257   2HB   ASP  69           HB1      ASP  69   6.249 -11.089   5.665
 1258    H    PHE  70           HN       PHE  70   6.191 -11.040   3.453
 1259    HA   PHE  70           HA       PHE  70   6.324  -8.980   1.432
 1260   1HB   PHE  70           HB2      PHE  70   5.458 -11.255   0.964
 1261   2HB   PHE  70           HB1      PHE  70   4.094 -10.947   2.040
 1262    HD1  PHE  70           HD2      PHE  70   5.572  -8.346  -0.130
 1263    HD2  PHE  70           HD1      PHE  70   2.376 -11.177   0.339
 1264    HE1  PHE  70           HE2      PHE  70   4.346  -7.268  -1.994
 1265    HE2  PHE  70           HE1      PHE  70   1.147 -10.099  -1.527
 1266    HZ   PHE  70           HZ       PHE  70   2.131  -8.144  -2.693
 1267    H    GLN  71           HN       GLN  71   4.214  -9.572   4.229
 1268    HA   GLN  71           HA       GLN  71   2.490  -7.306   3.703
 1269   1HB   GLN  71           HB2      GLN  71   2.865  -9.297   5.858
 1270   2HB   GLN  71           HB1      GLN  71   2.244  -7.734   6.390
 1271   1HG   GLN  71           HG2      GLN  71   0.895  -8.466   3.973
 1272   2HG   GLN  71           HG1      GLN  71   0.823  -9.828   5.088
 1273   1HE2  GLN  71          HE22      GLN  71  -1.971  -7.368   5.814
 1274   2HE2  GLN  71          HE21      GLN  71  -1.466  -8.132   4.384
 1275    H    GLU  72           HN       GLU  72   5.556  -7.728   5.346
 1276    HA   GLU  72           HA       GLU  72   5.425  -5.188   6.761
 1277   1HB   GLU  72           HB2      GLU  72   7.450  -7.318   6.303
 1278   2HB   GLU  72           HB1      GLU  72   8.088  -5.706   6.617
 1279   1HG   GLU  72           HG2      GLU  72   5.925  -6.220   8.437
 1280   2HG   GLU  72           HG1      GLU  72   7.065  -7.566   8.505
 1281    H    PHE  73           HN       PHE  73   7.459  -6.262   4.018
 1282    HA   PHE  73           HA       PHE  73   8.372  -3.712   3.251
 1283   1HB   PHE  73           HB2      PHE  73   9.491  -5.208   1.954
 1284   2HB   PHE  73           HB1      PHE  73   8.188  -6.387   2.042
 1285    HD1  PHE  73           HD2      PHE  73   6.287  -6.284   0.442
 1286    HD2  PHE  73           HD1      PHE  73   9.674  -3.662   0.113
 1287    HE1  PHE  73           HE2      PHE  73   5.623  -5.720  -1.880
 1288    HE2  PHE  73           HE1      PHE  73   9.007  -3.096  -2.207
 1289    HZ   PHE  73           HZ       PHE  73   6.984  -4.126  -3.205
 1290    H    MET  74           HN       MET  74   5.214  -5.167   2.835
 1291    HA   MET  74           HA       MET  74   4.355  -3.325   0.743
 1292   1HB   MET  74           HB2      MET  74   3.306  -5.637   2.042
 1293   2HB   MET  74           HB1      MET  74   2.138  -4.336   2.259
 1294   1HG   MET  74           HG2      MET  74   3.306  -4.522  -0.452
 1295   2HG   MET  74           HG1      MET  74   2.282  -5.881   0.015
 1296   1HE   MET  74           HE3      MET  74   2.513  -3.485  -1.933
 1297   2HE   MET  74           HE2      MET  74   0.864  -2.987  -2.310
 1298   3HE   MET  74           HE1      MET  74   1.880  -1.955  -1.305
 1299    H    ALA  75           HN       ALA  75   3.475  -3.637   4.199
 1300    HA   ALA  75           HA       ALA  75   2.110  -1.122   4.300
 1301   1HB   ALA  75           HB1      ALA  75   2.424  -3.237   6.032
 1302   2HB   ALA  75           HB3      ALA  75   3.408  -1.993   6.803
 1303   3HB   ALA  75           HB2      ALA  75   1.703  -1.688   6.468
 1304    H    PHE  76           HN       PHE  76   5.410  -1.884   4.059
 1305    HA   PHE  76           HA       PHE  76   6.414   0.492   5.449
 1306   1HB   PHE  76           HB2      PHE  76   7.534  -1.892   4.174
 1307   2HB   PHE  76           HB1      PHE  76   8.442  -0.433   3.780
 1308    HD1  PHE  76           HD1      PHE  76   7.010  -2.362   6.637
 1309    HD2  PHE  76           HD2      PHE  76   9.893   0.556   5.362
 1310    HE1  PHE  76           HE1      PHE  76   8.047  -2.399   8.889
 1311    HE2  PHE  76           HE2      PHE  76  10.929   0.519   7.614
 1312    HZ   PHE  76           HZ       PHE  76  10.007  -0.960   9.378
 1313    H    VAL  77           HN       VAL  77   6.151  -0.576   2.045
 1314    HA   VAL  77           HA       VAL  77   7.130   1.866   0.899
 1315    HB   VAL  77           HB       VAL  77   5.269  -0.255  -0.217
 1316   1HG1  VAL  77          HG12      VAL  77   5.843   2.329  -1.222
 1317   2HG1  VAL  77          HG11      VAL  77   6.815   1.207  -2.175
 1318   3HG1  VAL  77          HG13      VAL  77   5.065   0.999  -2.080
 1319   1HG2  VAL  77          HG23      VAL  77   8.194   0.035   0.116
 1320   2HG2  VAL  77          HG22      VAL  77   7.224  -1.423  -0.096
 1321   3HG2  VAL  77          HG21      VAL  77   7.685  -0.459  -1.499
 1322    H    SER  78           HN       SER  78   3.982   0.923   2.125
 1323    HA   SER  78           HA       SER  78   2.517   3.029   0.775
 1324   1HB   SER  78           HB2      SER  78   1.638   1.792   3.371
 1325   2HB   SER  78           HB1      SER  78   0.655   2.309   2.004
 1326    HG   SER  78           HG       SER  78   1.911  -0.070   2.474
 1327    H    MET  79           HN       MET  79   3.556   2.674   4.186
 1328    HA   MET  79           HA       MET  79   2.711   5.175   5.102
 1329   1HB   MET  79           HB2      MET  79   4.753   4.989   6.695
 1330   2HB   MET  79           HB1      MET  79   3.498   3.754   6.780
 1331   1HG   MET  79           HG2      MET  79   4.884   2.339   5.228
 1332   2HG   MET  79           HG1      MET  79   6.159   3.542   5.346
 1333   1HE   MET  79           HE3      MET  79   3.516   1.940   7.230
 1334   2HE   MET  79           HE2      MET  79   4.275   0.860   8.395
 1335   3HE   MET  79           HE1      MET  79   3.961   2.536   8.836
 1336    H    VAL  80           HN       VAL  80   5.768   4.427   3.393
 1337    HA   VAL  80           HA       VAL  80   6.742   7.144   3.678
 1338    HB   VAL  80           HB       VAL  80   8.299   6.409   1.770
 1339   1HG1  VAL  80          HG13      VAL  80   8.125   5.072   4.465
 1340   2HG1  VAL  80          HG12      VAL  80   9.474   4.763   3.371
 1341   3HG1  VAL  80          HG11      VAL  80   9.176   6.398   3.963
 1342   1HG2  VAL  80          HG22      VAL  80   6.416   4.296   1.661
 1343   2HG2  VAL  80          HG21      VAL  80   7.912   4.449   0.739
 1344   3HG2  VAL  80          HG23      VAL  80   7.914   3.603   2.285
 1345    H    THR  81           HN       THR  81   5.020   5.379   1.104
 1346    HA   THR  81           HA       THR  81   5.118   7.542  -0.791
 1347    HB   THR  81           HB       THR  81   2.938   5.449  -0.606
 1348    HG1  THR  81           HG1      THR  81   5.597   5.278  -1.553
 1349   1HG2  THR  81          HG23      THR  81   3.280   7.545  -2.340
 1350   2HG2  THR  81          HG22      THR  81   4.108   6.240  -3.190
 1351   3HG2  THR  81          HG21      THR  81   2.416   6.056  -2.729
 1352    H    THR  82           HN       THR  82   3.346   7.064   2.094
 1353    HA   THR  82           HA       THR  82   1.669   9.435   1.405
 1354    HB   THR  82           HB       THR  82   0.158   7.557   1.292
 1355    HG1  THR  82           HG1      THR  82  -1.214   8.551   2.509
 1356   1HG2  THR  82          HG21      THR  82   1.850   6.576   3.465
 1357   2HG2  THR  82          HG23      THR  82   0.130   6.369   3.797
 1358   3HG2  THR  82          HG22      THR  82   0.836   5.676   2.336
 1359    H    ALA  83           HN       ALA  83   4.225   9.017   2.933
 1360    HA   ALA  83           HA       ALA  83   3.884   9.118   5.715
 1361   1HB   ALA  83           HB1      ALA  83   5.994   9.516   3.939
 1362   2HB   ALA  83           HB3      ALA  83   5.854  11.062   4.775
 1363   3HB   ALA  83           HB2      ALA  83   6.099   9.579   5.698
 1364    H    CYS  84           HN       CYS  84   2.947  11.420   3.314
 1365    HA   CYS  84           HA       CYS  84   1.517  13.282   3.599
 1366   1HB   CYS  84           HB2      CYS  84   2.049  13.161   6.569
 1367   2HB   CYS  84           HB1      CYS  84   0.680  13.892   5.735
 1368    HG   CYS  84           HG       CYS  84   0.903  10.963   6.494
 1369    H    HIS  85           HN       HIS  85   1.787  15.497   5.173
 1370    HA   HIS  85           HA       HIS  85   3.183  17.329   5.704
 1371   1HB   HIS  85           HB2      HIS  85   4.920  15.293   6.098
 1372   2HB   HIS  85           HB1      HIS  85   5.656  16.051   4.686
 1373    HD1  HIS  85           HD1      HIS  85   7.415  17.646   5.439
 1374    HD2  HIS  85           HD2      HIS  85   4.097  17.727   7.963
 1375    HE1  HIS  85           HE1      HIS  85   7.881  19.429   7.176
 1376    H    GLU  86           HN       GLU  86   2.000  18.167   3.801
 1377    HA   GLU  86           HA       GLU  86   1.979  19.271   1.732
 1378   1HB   GLU  86           HB2      GLU  86   4.372  19.872   2.860
 1379   2HB   GLU  86           HB1      GLU  86   4.922  19.053   1.398
 1380   1HG   GLU  86           HG2      GLU  86   4.694  21.412   0.895
 1381   2HG   GLU  86           HG1      GLU  86   3.392  20.549   0.072
 1382    H    PHE  87           HN       PHE  87   1.071  17.823   0.301
 1383    HA   PHE  87           HA       PHE  87   2.863  16.415  -1.522
 1384   1HB   PHE  87           HB2      PHE  87   2.193  14.178  -1.069
 1385   2HB   PHE  87           HB1      PHE  87   2.550  14.867   0.513
 1386    HD1  PHE  87           HD1      PHE  87   0.257  16.429   1.233
 1387    HD2  PHE  87           HD2      PHE  87   0.387  12.702  -0.904
 1388    HE1  PHE  87           HE1      PHE  87  -2.057  15.924   1.969
 1389    HE2  PHE  87           HE2      PHE  87  -1.929  12.201  -0.162
 1390    HZ   PHE  87           HZ       PHE  87  -3.148  13.813   1.271
 1391    H    PHE  88           HN       PHE  88   0.875  14.658  -2.589
 1392    HA   PHE  88           HA       PHE  88  -0.803  14.798  -4.234
 1393   1HB   PHE  88           HB2      PHE  88  -1.869  16.179  -1.800
 1394   2HB   PHE  88           HB1      PHE  88  -2.815  16.246  -3.286
 1395    HD1  PHE  88           HD1      PHE  88  -0.707  13.338  -3.038
 1396    HD2  PHE  88           HD2      PHE  88  -4.528  14.931  -1.883
 1397    HE1  PHE  88           HE1      PHE  88  -1.537  11.040  -2.607
 1398    HE2  PHE  88           HE2      PHE  88  -5.356  12.633  -1.458
 1399    HZ   PHE  88           HZ       PHE  88  -3.862  10.689  -1.821
 1400    H    GLU  89           HN       GLU  89   1.342  16.826  -4.404
 1401    HA   GLU  89           HA       GLU  89  -0.227  18.941  -5.819
 1402   1HB   GLU  89           HB2      GLU  89   1.048  19.603  -3.627
 1403   2HB   GLU  89           HB1      GLU  89   2.486  19.503  -4.644
 1404   1HG   GLU  89           HG2      GLU  89   2.014  21.626  -5.268
 1405   2HG   GLU  89           HG1      GLU  89   0.697  20.931  -6.213
 1406    H    HIS  90           HN       HIS  90   2.745  17.036  -5.680
 1407    HA   HIS  90           HA       HIS  90   4.255  16.428  -7.358
 1408   1HB   HIS  90           HB2      HIS  90   3.132  15.422  -9.039
 1409   2HB   HIS  90           HB1      HIS  90   1.661  16.111  -8.364
 1410    HD1  HIS  90           HD1      HIS  90   4.164  16.575 -11.124
 1411    HD2  HIS  90           HD2      HIS  90   0.640  18.365  -9.795
 1412    HE1  HIS  90           HE1      HIS  90   3.432  18.161 -12.957
 1413    H    GLU  91           HN       GLU  91   3.627  19.431  -6.685
 1414    HA   GLU  91           HA       GLU  91   4.136  21.023  -8.955
 1415   1HB   GLU  91           HB2      GLU  91   4.786  22.737  -7.418
 1416   2HB   GLU  91           HB1      GLU  91   3.549  21.791  -6.598
 1417   1HG   GLU  91           HG2      GLU  91   5.315  20.493  -5.449
 1418   2HG   GLU  91           HG1      GLU  91   6.544  21.476  -6.248
   
  No H/Q in entry =        1418
  Start of MODEL   17
    1   1H    MET   0           HT3      MET   0   7.104   3.709 -14.706
    2   2H    MET   0           HT2      MET   0   7.669   5.310 -14.762
    3   3H    MET   0           HT1      MET   0   6.929   4.618 -16.126
    4    HA   MET   0           HA       MET   0   8.827   3.761 -16.844
    5   1HB   MET   0           HB2      MET   0   9.667   5.931 -15.995
    6   2HB   MET   0           HB1      MET   0   9.987   5.187 -14.428
    7   1HG   MET   0           HG2      MET   0  11.654   3.739 -15.356
    8   2HG   MET   0           HG1      MET   0  11.188   4.155 -17.005
    9   1HE   MET   0           HE2      MET   0  12.251   5.243 -18.273
   10   2HE   MET   0           HE1      MET   0  11.898   6.955 -18.058
   11   3HE   MET   0           HE3      MET   0  13.572   6.388 -18.048
   12    H    SER   1           HN       SER   1   8.463   3.313 -13.343
   13    HA   SER   1           HA       SER   1   9.812   0.660 -13.651
   14   1HB   SER   1           HB2      SER   1  10.790   0.924 -11.598
   15   2HB   SER   1           HB1      SER   1  10.577   2.633 -11.965
   16    HG   SER   1           HG       SER   1   8.409   2.273 -10.956
   17    H    GLU   2           HN       GLU   2   8.932  -0.927 -11.870
   18    HA   GLU   2           HA       GLU   2   6.056  -1.150 -12.326
   19   1HB   GLU   2           HB2      GLU   2   7.885  -3.039 -12.144
   20   2HB   GLU   2           HB1      GLU   2   7.556  -2.913 -10.418
   21   1HG   GLU   2           HG2      GLU   2   5.774  -4.254 -10.750
   22   2HG   GLU   2           HG1      GLU   2   5.026  -2.920 -11.629
   23    H    LEU   3           HN       LEU   3   8.147  -0.221  -9.648
   24    HA   LEU   3           HA       LEU   3   5.986  -0.319  -7.684
   25   1HB   LEU   3           HB2      LEU   3   8.481  -0.583  -7.202
   26   2HB   LEU   3           HB1      LEU   3   8.605   1.160  -7.413
   27    HG   LEU   3           HG       LEU   3   6.727   1.368  -5.698
   28   1HD1  LEU   3          HD11      LEU   3   7.431  -1.560  -5.414
   29   2HD1  LEU   3          HD13      LEU   3   6.653  -0.643  -4.126
   30   3HD1  LEU   3          HD12      LEU   3   5.838  -0.852  -5.676
   31   1HD2  LEU   3          HD21      LEU   3   9.556   0.734  -5.333
   32   2HD2  LEU   3          HD23      LEU   3   8.583   1.984  -4.558
   33   3HD2  LEU   3          HD22      LEU   3   8.595   0.344  -3.907
   34    H    GLU   4           HN       GLU   4   7.852   2.334  -9.173
   35    HA   GLU   4           HA       GLU   4   6.424   4.475  -8.044
   36   1HB   GLU   4           HB2      GLU   4   8.434   4.892  -9.318
   37   2HB   GLU   4           HB1      GLU   4   7.706   4.223 -10.777
   38   1HG   GLU   4           HG2      GLU   4   5.910   6.203  -9.950
   39   2HG   GLU   4           HG1      GLU   4   7.499   6.916  -9.682
   40    H    LYS   5           HN       LYS   5   5.756   2.856 -11.175
   41    HA   LYS   5           HA       LYS   5   3.398   4.370 -11.731
   42   1HB   LYS   5           HB2      LYS   5   3.925   1.526 -12.620
   43   2HB   LYS   5           HB1      LYS   5   2.955   2.749 -13.441
   44   1HG   LYS   5           HG2      LYS   5   5.738   3.564 -12.886
   45   2HG   LYS   5           HG1      LYS   5   5.574   2.228 -14.026
   46   1HD   LYS   5           HD2      LYS   5   5.276   3.905 -15.537
   47   2HD   LYS   5           HD1      LYS   5   3.621   3.874 -14.931
   48   1HE   LYS   5           HE2      LYS   5   4.118   5.657 -13.350
   49   2HE   LYS   5           HE1      LYS   5   5.819   5.634 -13.810
   50   1HZ   LYS   5           HZ2      LYS   5   3.800   6.027 -15.898
   51   2HZ   LYS   5           HZ1      LYS   5   4.170   7.333 -14.875
   52   3HZ   LYS   5           HZ3      LYS   5   5.391   6.616 -15.807
   53    H    ALA   6           HN       ALA   6   3.900   1.392  -9.884
   54    HA   ALA   6           HA       ALA   6   1.036   0.888  -9.609
   55   1HB   ALA   6           HB3      ALA   6   2.903  -0.864  -9.535
   56   2HB   ALA   6           HB2      ALA   6   3.238  -0.287  -7.905
   57   3HB   ALA   6           HB1      ALA   6   1.667  -0.990  -8.285
   58    H    MET   7           HN       MET   7   3.430   1.319  -7.011
   59    HA   MET   7           HA       MET   7   1.760   2.018  -4.942
   60   1HB   MET   7           HB2      MET   7   4.086   1.819  -4.469
   61   2HB   MET   7           HB1      MET   7   4.512   3.054  -5.657
   62   1HG   MET   7           HG2      MET   7   4.571   3.803  -3.219
   63   2HG   MET   7           HG1      MET   7   3.603   4.804  -4.300
   64   1HE   MET   7           HE2      MET   7   3.787   1.896  -2.017
   65   2HE   MET   7           HE1      MET   7   3.540   3.177  -0.834
   66   3HE   MET   7           HE3      MET   7   2.320   1.913  -1.043
   67    H    VAL   8           HN       VAL   8   3.165   4.294  -7.295
   68    HA   VAL   8           HA       VAL   8   1.795   6.584  -6.233
   69    HB   VAL   8           HB       VAL   8   2.756   6.236  -9.080
   70   1HG1  VAL   8          HG12      VAL   8   2.011   8.511  -7.286
   71   2HG1  VAL   8          HG11      VAL   8   3.309   8.761  -8.451
   72   3HG1  VAL   8          HG13      VAL   8   1.703   8.297  -9.010
   73   1HG2  VAL   8          HG22      VAL   8   4.366   5.682  -7.031
   74   2HG2  VAL   8          HG21      VAL   8   4.941   6.625  -8.403
   75   3HG2  VAL   8          HG23      VAL   8   4.445   7.440  -6.920
   76    H    ALA   9           HN       ALA   9   0.921   4.192  -8.696
   77    HA   ALA   9           HA       ALA   9  -1.315   5.549  -9.807
   78   1HB   ALA   9           HB2      ALA   9  -0.782   2.599  -9.363
   79   2HB   ALA   9           HB1      ALA   9  -2.197   3.194 -10.229
   80   3HB   ALA   9           HB3      ALA   9  -0.582   3.517 -10.855
   81    H    LEU  10           HN       LEU  10  -1.034   3.527  -6.893
   82    HA   LEU  10           HA       LEU  10  -3.780   3.450  -6.185
   83   1HB   LEU  10           HB2      LEU  10  -1.263   2.855  -4.929
   84   2HB   LEU  10           HB1      LEU  10  -2.259   3.771  -3.799
   85    HG   LEU  10           HG       LEU  10  -3.688   1.657  -5.296
   86   1HD1  LEU  10          HD11      LEU  10  -1.616   0.980  -3.185
   87   2HD1  LEU  10          HD13      LEU  10  -2.790  -0.148  -3.865
   88   3HD1  LEU  10          HD12      LEU  10  -1.530   0.538  -4.890
   89   1HD2  LEU  10          HD22      LEU  10  -3.654   2.955  -2.620
   90   2HD2  LEU  10          HD21      LEU  10  -5.025   2.480  -3.623
   91   3HD2  LEU  10          HD23      LEU  10  -4.179   1.270  -2.659
   92    H    ILE  11           HN       ILE  11  -1.268   5.800  -5.153
   93    HA   ILE  11           HA       ILE  11  -2.908   7.538  -3.686
   94    HB   ILE  11           HB       ILE  11  -0.539   8.092  -5.483
   95   1HG1  ILE  11          HG12      ILE  11   0.413   8.627  -3.130
   96   2HG1  ILE  11          HG11      ILE  11  -1.017   7.795  -2.518
   97   1HG2  ILE  11          HG23      ILE  11  -2.126  10.007  -3.756
   98   2HG2  ILE  11          HG22      ILE  11  -0.485  10.340  -4.308
   99   3HG2  ILE  11          HG21      ILE  11  -1.789  10.148  -5.480
  100   1HD1  ILE  11          HD11      ILE  11   0.723   6.510  -4.614
  101   2HD1  ILE  11          HD13      ILE  11   1.141   6.398  -2.905
  102   3HD1  ILE  11          HD12      ILE  11  -0.389   5.742  -3.483
  103    H    ASP  12           HN       ASP  12  -2.691   7.033  -7.135
  104    HA   ASP  12           HA       ASP  12  -4.056   9.395  -8.003
  105   1HB   ASP  12           HB2      ASP  12  -2.804   7.521  -9.362
  106   2HB   ASP  12           HB1      ASP  12  -4.391   6.754  -9.405
  107    H    VAL  13           HN       VAL  13  -5.270   6.101  -7.295
  108    HA   VAL  13           HA       VAL  13  -7.994   6.500  -7.803
  109    HB   VAL  13           HB       VAL  13  -6.700   4.927  -5.551
  110   1HG1  VAL  13          HG12      VAL  13  -9.399   5.637  -5.847
  111   2HG1  VAL  13          HG11      VAL  13  -9.293   3.992  -6.474
  112   3HG1  VAL  13          HG13      VAL  13  -8.758   4.347  -4.832
  113   1HG2  VAL  13          HG23      VAL  13  -6.577   4.512  -8.269
  114   2HG2  VAL  13          HG22      VAL  13  -6.421   3.246  -7.053
  115   3HG2  VAL  13          HG21      VAL  13  -7.982   3.547  -7.816
  116    H    PHE  14           HN       PHE  14  -6.098   7.471  -4.976
  117    HA   PHE  14           HA       PHE  14  -8.247   8.319  -3.319
  118   1HB   PHE  14           HB2      PHE  14  -5.622   8.161  -2.919
  119   2HB   PHE  14           HB1      PHE  14  -5.691   9.870  -3.348
  120    HD1  PHE  14           HD1      PHE  14  -7.542  11.285  -2.150
  121    HD2  PHE  14           HD2      PHE  14  -6.083   7.510  -0.722
  122    HE1  PHE  14           HE1      PHE  14  -8.370  11.827   0.123
  123    HE2  PHE  14           HE2      PHE  14  -6.910   8.049   1.553
  124    HZ   PHE  14           HZ       PHE  14  -8.055  10.209   1.977
  125    H    HIS  15           HN       HIS  15  -6.424  10.059  -5.834
  126    HA   HIS  15           HA       HIS  15  -7.784  12.572  -5.414
  127   1HB   HIS  15           HB2      HIS  15  -5.569  12.234  -6.622
  128   2HB   HIS  15           HB1      HIS  15  -6.506  11.629  -7.989
  129    HD1  HIS  15           HD1      HIS  15  -8.058  14.336  -5.989
  130    HD2  HIS  15           HD2      HIS  15  -5.733  14.035  -9.433
  131    HE1  HIS  15           HE1      HIS  15  -8.196  16.586  -7.145
  132    H    GLN  16           HN       GLN  16  -8.652   9.627  -6.983
  133    HA   GLN  16           HA       GLN  16 -10.600  10.823  -8.799
  134   1HB   GLN  16           HB2      GLN  16  -9.346   8.387  -8.688
  135   2HB   GLN  16           HB1      GLN  16 -10.947   7.986  -8.066
  136   1HG   GLN  16           HG2      GLN  16 -11.097   7.732 -10.435
  137   2HG   GLN  16           HG1      GLN  16 -11.889   9.265 -10.070
  138   1HE2  GLN  16          HE22      GLN  16  -9.797  10.672 -12.561
  139   2HE2  GLN  16          HE21      GLN  16 -11.385  10.275 -12.117
  140    H    TYR  17           HN       TYR  17 -10.876   8.811  -5.842
  141    HA   TYR  17           HA       TYR  17 -13.725   9.422  -5.612
  142   1HB   TYR  17           HB2      TYR  17 -11.790   8.059  -3.718
  143   2HB   TYR  17           HB1      TYR  17 -13.529   8.178  -3.453
  144    HD1  TYR  17           HD1      TYR  17 -10.969   6.929  -5.862
  145    HD2  TYR  17           HD2      TYR  17 -15.019   6.650  -4.467
  146    HE1  TYR  17           HE1      TYR  17 -11.326   4.935  -7.296
  147    HE2  TYR  17           HE2      TYR  17 -15.377   4.655  -5.900
  148    HH   TYR  17           HH       TYR  17 -14.028   3.841  -8.283
  149    H    SER  18           HN       SER  18 -10.859  10.140  -3.592
  150    HA   SER  18           HA       SER  18 -12.356  12.206  -2.132
  151   1HB   SER  18           HB2      SER  18 -10.382  10.577  -1.338
  152   2HB   SER  18           HB1      SER  18  -9.396  11.935  -1.875
  153    HG   SER  18           HG       SER  18 -11.653  12.468  -0.317
  154    H    GLY  19           HN       GLY  19 -12.614  13.204  -4.484
  155   1HA   GLY  19           HA2      GLY  19 -10.959  15.580  -4.539
  156   2HA   GLY  19           HA1      GLY  19 -10.578  14.492  -5.874
  157    H    ARG  20           HN       ARG  20 -13.166  13.465  -6.367
  158    HA   ARG  20           HA       ARG  20 -14.392  15.850  -7.632
  159   1HB   ARG  20           HB2      ARG  20 -15.600  14.280  -9.024
  160   2HB   ARG  20           HB1      ARG  20 -13.915  13.760  -8.966
  161   1HG   ARG  20           HG2      ARG  20 -14.493  12.153  -7.164
  162   2HG   ARG  20           HG1      ARG  20 -16.182  12.641  -7.293
  163   1HD   ARG  20           HD2      ARG  20 -15.990  12.027  -9.786
  164   2HD   ARG  20           HD1      ARG  20 -14.494  11.207  -9.345
  165    HE   ARG  20           HE       ARG  20 -16.841  10.458  -7.741
  166   1HH1  ARG  20          HH11      ARG  20 -14.151   9.083  -8.818
  167   2HH1  ARG  20          HH12      ARG  20 -14.869   7.760  -9.675
  168   1HH2  ARG  20          HH21      ARG  20 -18.072   9.079  -9.557
  169   2HH2  ARG  20          HH22      ARG  20 -17.090   7.756 -10.090
  170    H    GLU  21           HN       GLU  21 -14.813  13.821  -4.923
  171    HA   GLU  21           HA       GLU  21 -17.719  14.351  -4.744
  172   1HB   GLU  21           HB2      GLU  21 -16.010  12.296  -3.803
  173   2HB   GLU  21           HB1      GLU  21 -16.616  13.136  -2.376
  174   1HG   GLU  21           HG2      GLU  21 -18.930  12.912  -3.253
  175   2HG   GLU  21           HG1      GLU  21 -18.301  12.005  -4.629
  176    H    GLY  22           HN       GLY  22 -17.852  14.568  -1.896
  177   1HA   GLY  22           HA2      GLY  22 -17.406  17.405  -1.598
  178   2HA   GLY  22           HA1      GLY  22 -17.928  16.314  -0.318
  179    H    ASP  23           HN       ASP  23 -16.015  14.686   0.253
  180    HA   ASP  23           HA       ASP  23 -13.984  16.191   1.524
  181   1HB   ASP  23           HB2      ASP  23 -13.596  13.321   0.679
  182   2HB   ASP  23           HB1      ASP  23 -13.053  14.120   2.152
  183    H    LYS  24           HN       LYS  24 -11.534  15.100   0.928
  184    HA   LYS  24           HA       LYS  24 -10.990  15.192  -1.935
  185   1HB   LYS  24           HB2      LYS  24 -11.277  17.610  -1.400
  186   2HB   LYS  24           HB1      LYS  24  -9.995  17.473  -0.198
  187   1HG   LYS  24           HG2      LYS  24  -8.371  16.897  -1.891
  188   2HG   LYS  24           HG1      LYS  24  -9.630  16.779  -3.123
  189   1HD   LYS  24           HD2      LYS  24 -10.124  19.280  -2.356
  190   2HD   LYS  24           HD1      LYS  24  -8.432  19.215  -1.864
  191   1HE   LYS  24           HE2      LYS  24  -8.628  20.036  -4.176
  192   2HE   LYS  24           HE1      LYS  24  -7.804  18.479  -4.138
  193   1HZ   LYS  24           HZ3      LYS  24 -10.716  18.506  -4.441
  194   2HZ   LYS  24           HZ2      LYS  24  -9.765  18.923  -5.785
  195   3HZ   LYS  24           HZ1      LYS  24  -9.579  17.405  -5.047
  196    H    HIS  25           HN       HIS  25  -9.015  16.235   0.856
  197    HA   HIS  25           HA       HIS  25  -7.027  14.191   0.136
  198   1HB   HIS  25           HB2      HIS  25  -5.635  15.791   0.879
  199   2HB   HIS  25           HB1      HIS  25  -6.998  16.773   1.379
  200    HD1  HIS  25           HD1      HIS  25  -4.057  15.426   2.763
  201    HD2  HIS  25           HD2      HIS  25  -8.003  15.571   4.090
  202    HE1  HIS  25           HE1      HIS  25  -3.982  15.076   5.270
  203    H    LYS  26           HN       LYS  26  -9.815  13.991   1.740
  204    HA   LYS  26           HA       LYS  26  -8.725  11.973   3.655
  205   1HB   LYS  26           HB2      LYS  26 -10.507  12.629   5.255
  206   2HB   LYS  26           HB1      LYS  26  -9.396  13.961   4.937
  207   1HG   LYS  26           HG2      LYS  26 -11.158  14.479   3.000
  208   2HG   LYS  26           HG1      LYS  26 -12.242  13.628   4.099
  209   1HD   LYS  26           HD2      LYS  26 -10.434  15.765   5.186
  210   2HD   LYS  26           HD1      LYS  26 -11.912  16.231   4.343
  211   1HE   LYS  26           HE2      LYS  26 -13.257  14.886   5.867
  212   2HE   LYS  26           HE1      LYS  26 -11.804  14.289   6.666
  213   1HZ   LYS  26           HZ2      LYS  26 -11.719  17.094   6.605
  214   2HZ   LYS  26           HZ1      LYS  26 -13.230  16.619   7.221
  215   3HZ   LYS  26           HZ3      LYS  26 -11.805  16.069   7.957
  216    H    LEU  27           HN       LEU  27  -9.729  10.008   3.460
  217    HA   LEU  27           HA       LEU  27 -11.999   9.825   1.562
  218   1HB   LEU  27           HB2      LEU  27  -9.735   8.206   2.121
  219   2HB   LEU  27           HB1      LEU  27 -11.156   7.271   2.584
  220    HG   LEU  27           HG       LEU  27 -10.957   8.721  -0.061
  221   1HD1  LEU  27          HD12      LEU  27  -9.261   6.715   0.593
  222   2HD1  LEU  27          HD11      LEU  27 -10.647   5.768   0.052
  223   3HD1  LEU  27          HD13      LEU  27  -9.900   6.939  -1.035
  224   1HD2  LEU  27          HD21      LEU  27 -12.694   6.443   0.947
  225   2HD2  LEU  27          HD23      LEU  27 -13.215   8.114   0.725
  226   3HD2  LEU  27          HD22      LEU  27 -12.759   7.139  -0.672
  227    H    LYS  28           HN       LYS  28 -12.998   7.329   2.662
  228    HA   LYS  28           HA       LYS  28 -13.940   8.024   5.373
  229   1HB   LYS  28           HB2      LYS  28 -15.674   7.950   2.912
  230   2HB   LYS  28           HB1      LYS  28 -16.347   7.534   4.489
  231   1HG   LYS  28           HG2      LYS  28 -15.595   9.710   5.385
  232   2HG   LYS  28           HG1      LYS  28 -14.927  10.128   3.807
  233   1HD   LYS  28           HD2      LYS  28 -17.013  11.145   3.677
  234   2HD   LYS  28           HD1      LYS  28 -17.367   9.568   2.966
  235   1HE   LYS  28           HE2      LYS  28 -18.757   9.015   4.655
  236   2HE   LYS  28           HE1      LYS  28 -17.591   9.531   5.875
  237   1HZ   LYS  28           HZ1      LYS  28 -18.612  11.785   4.530
  238   2HZ   LYS  28           HZ3      LYS  28 -19.906  10.840   5.082
  239   3HZ   LYS  28           HZ2      LYS  28 -18.727  11.387   6.177
  240    H    LYS  29           HN       LYS  29 -15.230   6.164   6.293
  241    HA   LYS  29           HA       LYS  29 -13.948   3.647   5.587
  242   1HB   LYS  29           HB2      LYS  29 -16.282   4.112   7.464
  243   2HB   LYS  29           HB1      LYS  29 -15.213   2.710   7.436
  244   1HG   LYS  29           HG2      LYS  29 -13.328   4.036   8.128
  245   2HG   LYS  29           HG1      LYS  29 -14.235   5.535   7.920
  246   1HD   LYS  29           HD2      LYS  29 -14.642   5.333  10.148
  247   2HD   LYS  29           HD1      LYS  29 -15.861   4.166   9.635
  248   1HE   LYS  29           HE2      LYS  29 -14.712   2.813  11.091
  249   2HE   LYS  29           HE1      LYS  29 -13.722   2.540   9.659
  250   1HZ   LYS  29           HZ2      LYS  29 -12.833   4.881  10.901
  251   2HZ   LYS  29           HZ1      LYS  29 -12.966   3.685  12.099
  252   3HZ   LYS  29           HZ3      LYS  29 -12.008   3.406  10.729
  253    H    SER  30           HN       SER  30 -16.973   5.216   4.848
  254    HA   SER  30           HA       SER  30 -18.262   2.772   3.867
  255   1HB   SER  30           HB2      SER  30 -19.628   4.629   4.733
  256   2HB   SER  30           HB1      SER  30 -18.982   5.699   3.492
  257    HG   SER  30           HG       SER  30 -21.035   4.745   2.963
  258    H    GLU  31           HN       GLU  31 -16.453   5.486   2.483
  259    HA   GLU  31           HA       GLU  31 -16.887   4.486  -0.254
  260   1HB   GLU  31           HB2      GLU  31 -16.466   6.992   0.647
  261   2HB   GLU  31           HB1      GLU  31 -14.791   6.532   0.348
  262   1HG   GLU  31           HG2      GLU  31 -15.253   6.026  -1.954
  263   2HG   GLU  31           HG1      GLU  31 -16.992   6.167  -1.698
  264    H    LEU  32           HN       LEU  32 -14.713   4.070   2.368
  265    HA   LEU  32           HA       LEU  32 -12.475   3.122   0.728
  266   1HB   LEU  32           HB2      LEU  32 -11.885   4.053   2.874
  267   2HB   LEU  32           HB1      LEU  32 -13.064   3.033   3.702
  268    HG   LEU  32           HG       LEU  32 -11.800   1.040   3.204
  269   1HD1  LEU  32          HD12      LEU  32 -10.630   2.796   1.175
  270   2HD1  LEU  32          HD11      LEU  32  -9.418   1.855   2.043
  271   3HD1  LEU  32          HD13      LEU  32 -10.737   1.035   1.207
  272   1HD2  LEU  32          HD23      LEU  32 -11.022   2.470   5.113
  273   2HD2  LEU  32          HD22      LEU  32  -9.729   1.502   4.406
  274   3HD2  LEU  32          HD21      LEU  32  -9.853   3.220   4.028
  275    H    LYS  33           HN       LYS  33 -15.141   1.803   2.621
  276    HA   LYS  33           HA       LYS  33 -14.505  -0.965   2.436
  277   1HB   LYS  33           HB2      LYS  33 -16.425   0.352   3.700
  278   2HB   LYS  33           HB1      LYS  33 -17.346  -0.018   2.246
  279   1HG   LYS  33           HG2      LYS  33 -16.261  -2.448   2.696
  280   2HG   LYS  33           HG1      LYS  33 -16.325  -1.852   4.354
  281   1HD   LYS  33           HD2      LYS  33 -18.756  -1.194   3.853
  282   2HD   LYS  33           HD1      LYS  33 -18.611  -2.198   2.411
  283   1HE   LYS  33           HE2      LYS  33 -18.744  -4.116   3.603
  284   2HE   LYS  33           HE1      LYS  33 -17.612  -3.528   4.821
  285   1HZ   LYS  33           HZ3      LYS  33 -20.450  -2.684   4.647
  286   2HZ   LYS  33           HZ2      LYS  33 -19.890  -3.923   5.666
  287   3HZ   LYS  33           HZ1      LYS  33 -19.351  -2.325   5.889
  288    H    GLU  34           HN       GLU  34 -16.181   1.230   0.241
  289    HA   GLU  34           HA       GLU  34 -16.826  -0.874  -1.678
  290   1HB   GLU  34           HB2      GLU  34 -17.902   0.818  -2.898
  291   2HB   GLU  34           HB1      GLU  34 -17.991   1.452  -1.257
  292   1HG   GLU  34           HG2      GLU  34 -16.176   2.951  -1.622
  293   2HG   GLU  34           HG1      GLU  34 -15.742   2.174  -3.142
  294    H    LEU  35           HN       LEU  35 -14.411   1.654  -1.333
  295    HA   LEU  35           HA       LEU  35 -13.066   1.503  -3.786
  296   1HB   LEU  35           HB2      LEU  35 -12.625   2.784  -1.406
  297   2HB   LEU  35           HB1      LEU  35 -11.312   1.602  -1.408
  298    HG   LEU  35           HG       LEU  35 -10.465   3.548  -2.521
  299   1HD1  LEU  35          HD13      LEU  35 -10.432   1.106  -3.660
  300   2HD1  LEU  35          HD12      LEU  35 -11.261   1.996  -4.936
  301   3HD1  LEU  35          HD11      LEU  35  -9.658   2.506  -4.404
  302   1HD2  LEU  35          HD22      LEU  35 -13.095   4.066  -3.132
  303   2HD2  LEU  35          HD21      LEU  35 -11.723   4.935  -3.817
  304   3HD2  LEU  35          HD23      LEU  35 -12.450   3.593  -4.702
  305    H    ILE  36           HN       ILE  36 -12.598  -0.554  -0.901
  306    HA   ILE  36           HA       ILE  36 -10.637  -2.232  -2.275
  307    HB   ILE  36           HB       ILE  36 -12.053  -3.098   0.218
  308   1HG1  ILE  36          HG12      ILE  36 -10.452  -0.606  -0.146
  309   2HG1  ILE  36          HG11      ILE  36 -11.720  -0.968   1.017
  310   1HG2  ILE  36          HG23      ILE  36 -10.205  -4.388  -0.971
  311   2HG2  ILE  36          HG22      ILE  36  -9.112  -3.089  -0.488
  312   3HG2  ILE  36          HG21      ILE  36  -9.929  -4.057   0.739
  313   1HD1  ILE  36          HD13      ILE  36  -8.895  -2.053   1.146
  314   2HD1  ILE  36          HD12      ILE  36  -9.521  -0.725   2.124
  315   3HD1  ILE  36          HD11      ILE  36 -10.173  -2.353   2.321
  316    H    ASN  37           HN       ASN  37 -13.928  -2.775  -1.008
  317    HA   ASN  37           HA       ASN  37 -14.210  -5.391  -2.131
  318   1HB   ASN  37           HB2      ASN  37 -15.602  -4.343  -0.283
  319   2HB   ASN  37           HB1      ASN  37 -16.471  -3.475  -1.548
  320   1HD2  ASN  37          HD22      ASN  37 -17.047  -7.506  -1.101
  321   2HD2  ASN  37          HD21      ASN  37 -15.761  -6.739  -0.300
  322    H    ASN  38           HN       ASN  38 -13.968  -2.506  -3.805
  323    HA   ASN  38           HA       ASN  38 -15.783  -3.486  -5.962
  324   1HB   ASN  38           HB2      ASN  38 -16.055  -1.125  -4.995
  325   2HB   ASN  38           HB1      ASN  38 -14.534  -0.739  -5.799
  326   1HD2  ASN  38          HD22      ASN  38 -16.124  -0.257  -8.886
  327   2HD2  ASN  38          HD21      ASN  38 -14.822   0.099  -7.860
  328    H    GLU  39           HN       GLU  39 -12.622  -1.818  -5.628
  329    HA   GLU  39           HA       GLU  39 -11.784  -3.167  -8.152
  330   1HB   GLU  39           HB2      GLU  39 -10.565  -0.802  -6.692
  331   2HB   GLU  39           HB1      GLU  39 -10.002  -1.456  -8.230
  332   1HG   GLU  39           HG2      GLU  39 -11.596  -0.345  -9.371
  333   2HG   GLU  39           HG1      GLU  39 -12.860  -0.941  -8.297
  334    H    LEU  40           HN       LEU  40 -11.822  -4.406  -5.407
  335    HA   LEU  40           HA       LEU  40  -9.032  -5.390  -5.487
  336   1HB   LEU  40           HB2      LEU  40  -9.348  -3.430  -3.788
  337   2HB   LEU  40           HB1      LEU  40 -10.175  -4.645  -2.812
  338    HG   LEU  40           HG       LEU  40  -7.828  -5.883  -3.768
  339   1HD1  LEU  40          HD12      LEU  40  -7.401  -3.155  -3.860
  340   2HD1  LEU  40          HD11      LEU  40  -6.809  -3.580  -2.255
  341   3HD1  LEU  40          HD13      LEU  40  -6.140  -4.374  -3.680
  342   1HD2  LEU  40          HD22      LEU  40  -9.176  -5.980  -1.531
  343   2HD2  LEU  40          HD21      LEU  40  -7.433  -6.238  -1.480
  344   3HD2  LEU  40          HD23      LEU  40  -8.105  -4.673  -1.027
  345    H    SER  41           HN       SER  41 -12.338  -5.740  -4.325
  346    HA   SER  41           HA       SER  41 -12.092  -8.210  -2.963
  347   1HB   SER  41           HB2      SER  41 -14.201  -7.367  -2.659
  348   2HB   SER  41           HB1      SER  41 -14.287  -6.712  -4.291
  349    HG   SER  41           HG       SER  41 -14.634  -9.389  -3.429
  350    H    HIS  42           HN       HIS  42 -11.554  -7.573  -6.263
  351    HA   HIS  42           HA       HIS  42 -12.561  -9.934  -7.489
  352   1HB   HIS  42           HB2      HIS  42 -11.544  -7.909  -8.652
  353   2HB   HIS  42           HB1      HIS  42  -9.964  -8.561  -8.221
  354    HD1  HIS  42           HD1      HIS  42  -9.079  -9.532 -10.359
  355    HD2  HIS  42           HD2      HIS  42 -13.056 -10.592  -9.702
  356    HE1  HIS  42           HE1      HIS  42  -9.692 -11.184 -12.181
  357    H    PHE  43           HN       PHE  43  -9.883  -9.431  -5.337
  358    HA   PHE  43           HA       PHE  43  -8.732 -12.083  -5.996
  359   1HB   PHE  43           HB2      PHE  43  -7.820  -9.892  -4.105
  360   2HB   PHE  43           HB1      PHE  43  -6.973 -11.421  -4.341
  361    HD1  PHE  43           HD1      PHE  43  -6.153 -12.029  -6.661
  362    HD2  PHE  43           HD2      PHE  43  -7.559  -8.099  -5.642
  363    HE1  PHE  43           HE1      PHE  43  -5.032 -11.106  -8.669
  364    HE2  PHE  43           HE2      PHE  43  -6.439  -7.176  -7.652
  365    HZ   PHE  43           HZ       PHE  43  -5.175  -8.680  -9.166
  366    H    LEU  44           HN       LEU  44 -10.950 -10.671  -3.827
  367    HA   LEU  44           HA       LEU  44 -10.513 -12.287  -1.507
  368   1HB   LEU  44           HB2      LEU  44 -12.658 -10.547  -2.544
  369   2HB   LEU  44           HB1      LEU  44 -13.215 -11.846  -1.489
  370    HG   LEU  44           HG       LEU  44 -12.582  -9.676  -0.313
  371   1HD1  LEU  44          HD13      LEU  44 -11.729 -12.428   0.300
  372   2HD1  LEU  44          HD12      LEU  44 -10.842 -11.188   1.188
  373   3HD1  LEU  44          HD11      LEU  44 -12.598 -11.269   1.304
  374   1HD2  LEU  44          HD23      LEU  44 -10.394  -9.729  -1.918
  375   2HD2  LEU  44          HD22      LEU  44 -10.437  -8.874  -0.376
  376   3HD2  LEU  44          HD21      LEU  44  -9.732 -10.488  -0.471
  377    H    GLU  45           HN       GLU  45 -11.008 -14.412  -1.135
  378    HA   GLU  45           HA       GLU  45 -13.186 -15.828  -2.298
  379   1HB   GLU  45           HB2      GLU  45 -11.587 -17.368  -3.729
  380   2HB   GLU  45           HB1      GLU  45 -12.238 -15.882  -4.422
  381   1HG   GLU  45           HG2      GLU  45 -10.221 -14.734  -4.208
  382   2HG   GLU  45           HG1      GLU  45  -9.643 -15.787  -2.918
  383    H    GLU  46           HN       GLU  46  -9.890 -16.014  -1.024
  384    HA   GLU  46           HA       GLU  46 -10.754 -18.436   0.505
  385   1HB   GLU  46           HB2      GLU  46  -8.102 -18.723   0.599
  386   2HB   GLU  46           HB1      GLU  46  -9.049 -19.351  -0.747
  387   1HG   GLU  46           HG2      GLU  46  -8.436 -17.585  -2.169
  388   2HG   GLU  46           HG1      GLU  46  -7.964 -16.543  -0.827
  389    H    ILE  47           HN       ILE  47  -8.626 -15.561   0.600
  390    HA   ILE  47           HA       ILE  47  -8.085 -14.170   2.416
  391    HB   ILE  47           HB       ILE  47 -10.106 -15.742   4.023
  392   1HG1  ILE  47          HG12      ILE  47 -10.811 -13.248   2.507
  393   2HG1  ILE  47          HG11      ILE  47 -10.832 -14.797   1.661
  394   1HG2  ILE  47          HG22      ILE  47  -8.402 -13.700   4.722
  395   2HG2  ILE  47          HG21      ILE  47  -9.863 -12.817   4.279
  396   3HG2  ILE  47          HG23      ILE  47  -9.926 -14.055   5.534
  397   1HD1  ILE  47          HD12      ILE  47 -12.159 -14.726   4.320
  398   2HD1  ILE  47          HD11      ILE  47 -12.966 -13.860   3.013
  399   3HD1  ILE  47          HD13      ILE  47 -12.627 -15.583   2.850
  400    H    LYS  48           HN       LYS  48  -6.217 -14.430   3.515
  401    HA   LYS  48           HA       LYS  48  -5.672 -17.102   4.737
  402   1HB   LYS  48           HB2      LYS  48  -4.011 -15.112   3.305
  403   2HB   LYS  48           HB1      LYS  48  -3.255 -15.849   4.717
  404   1HG   LYS  48           HG2      LYS  48  -3.729 -18.088   3.832
  405   2HG   LYS  48           HG1      LYS  48  -4.547 -17.381   2.439
  406   1HD   LYS  48           HD2      LYS  48  -2.549 -16.521   1.544
  407   2HD   LYS  48           HD1      LYS  48  -1.699 -16.641   3.084
  408   1HE   LYS  48           HE2      LYS  48  -2.309 -19.239   2.742
  409   2HE   LYS  48           HE1      LYS  48  -2.246 -18.748   1.050
  410   1HZ   LYS  48           HZ2      LYS  48  -0.062 -17.572   1.906
  411   2HZ   LYS  48           HZ1      LYS  48  -0.115 -18.835   3.042
  412   3HZ   LYS  48           HZ3      LYS  48  -0.066 -19.190   1.384
  413    H    GLU  49           HN       GLU  49  -5.435 -13.594   5.280
  414    HA   GLU  49           HA       GLU  49  -4.873 -14.111   8.155
  415   1HB   GLU  49           HB2      GLU  49  -4.180 -12.009   6.278
  416   2HB   GLU  49           HB1      GLU  49  -4.970 -11.338   7.705
  417   1HG   GLU  49           HG2      GLU  49  -2.573 -13.193   7.698
  418   2HG   GLU  49           HG1      GLU  49  -2.558 -11.473   8.095
  419    H    GLN  50           HN       GLN  50  -7.022 -14.806   8.710
  420    HA   GLN  50           HA       GLN  50  -9.403 -13.389   8.081
  421   1HB   GLN  50           HB2      GLN  50  -9.340 -15.683   9.053
  422   2HB   GLN  50           HB1      GLN  50  -8.814 -14.991  10.588
  423   1HG   GLN  50           HG2      GLN  50 -11.065 -14.983  11.011
  424   2HG   GLN  50           HG1      GLN  50 -10.988 -13.455  10.132
  425   1HE2  GLN  50          HE22      GLN  50 -13.604 -15.731   8.598
  426   2HE2  GLN  50          HE21      GLN  50 -13.335 -15.205  10.190
  427    H    GLU  51           HN       GLU  51  -6.887 -12.708  10.396
  428    HA   GLU  51           HA       GLU  51  -8.529 -10.884  11.986
  429   1HB   GLU  51           HB2      GLU  51  -5.558 -11.440  11.883
  430   2HB   GLU  51           HB1      GLU  51  -6.262 -10.222  12.946
  431   1HG   GLU  51           HG2      GLU  51  -7.413 -11.812  14.221
  432   2HG   GLU  51           HG1      GLU  51  -7.360 -13.023  12.938
  433    H    VAL  52           HN       VAL  52  -6.229 -10.602   9.312
  434    HA   VAL  52           HA       VAL  52  -6.041  -7.727   9.401
  435    HB   VAL  52           HB       VAL  52  -5.623  -9.693   7.136
  436   1HG1  VAL  52          HG13      VAL  52  -5.374  -6.713   7.308
  437   2HG1  VAL  52          HG12      VAL  52  -4.187  -7.601   6.354
  438   3HG1  VAL  52          HG11      VAL  52  -5.900  -7.716   5.956
  439   1HG2  VAL  52          HG23      VAL  52  -4.129  -9.759   9.216
  440   2HG2  VAL  52          HG22      VAL  52  -3.303  -9.536   7.675
  441   3HG2  VAL  52          HG21      VAL  52  -3.571  -8.155   8.739
  442    H    VAL  53           HN       VAL  53  -7.939  -9.902   7.270
  443    HA   VAL  53           HA       VAL  53  -9.417  -7.721   6.101
  444    HB   VAL  53           HB       VAL  53  -9.911 -10.708   6.207
  445   1HG1  VAL  53          HG11      VAL  53 -11.584  -8.466   5.134
  446   2HG1  VAL  53          HG13      VAL  53 -11.514  -9.976   4.223
  447   3HG1  VAL  53          HG12      VAL  53 -12.090  -9.978   5.889
  448   1HG2  VAL  53          HG21      VAL  53  -8.920  -8.768   4.101
  449   2HG2  VAL  53          HG23      VAL  53  -8.038 -10.116   4.818
  450   3HG2  VAL  53          HG22      VAL  53  -9.395 -10.427   3.735
  451    H    ASP  54           HN       ASP  54  -9.885  -9.751   8.930
  452    HA   ASP  54           HA       ASP  54 -12.641  -8.904   9.348
  453   1HB   ASP  54           HB2      ASP  54 -11.865 -11.041  10.264
  454   2HB   ASP  54           HB1      ASP  54 -10.647 -10.204  11.228
  455    H    LYS  55           HN       LYS  55  -9.495  -7.644  10.063
  456    HA   LYS  55           HA       LYS  55 -10.412  -5.881  12.211
  457   1HB   LYS  55           HB2      LYS  55  -7.860  -6.525  10.893
  458   2HB   LYS  55           HB1      LYS  55  -8.022  -4.828  11.350
  459   1HG   LYS  55           HG2      LYS  55  -8.252  -5.325  13.624
  460   2HG   LYS  55           HG1      LYS  55  -8.761  -6.985  13.310
  461   1HD   LYS  55           HD2      LYS  55  -6.633  -7.665  13.556
  462   2HD   LYS  55           HD1      LYS  55  -6.176  -6.675  12.170
  463   1HE   LYS  55           HE2      LYS  55  -5.939  -4.712  13.676
  464   2HE   LYS  55           HE1      LYS  55  -6.328  -5.742  15.052
  465   1HZ   LYS  55           HZ2      LYS  55  -4.172  -6.564  13.246
  466   2HZ   LYS  55           HZ1      LYS  55  -3.863  -5.316  14.357
  467   3HZ   LYS  55           HZ3      LYS  55  -4.352  -6.843  14.911
  468    H    VAL  56           HN       VAL  56  -9.374  -5.413   8.810
  469    HA   VAL  56           HA       VAL  56 -10.074  -2.614   8.801
  470    HB   VAL  56           HB       VAL  56  -9.857  -2.842   6.337
  471   1HG1  VAL  56          HG12      VAL  56  -7.861  -2.660   7.895
  472   2HG1  VAL  56          HG11      VAL  56  -7.689  -4.408   7.744
  473   3HG1  VAL  56          HG13      VAL  56  -7.518  -3.379   6.323
  474   1HG2  VAL  56          HG22      VAL  56  -9.934  -5.749   7.076
  475   2HG2  VAL  56          HG21      VAL  56 -10.734  -4.921   5.743
  476   3HG2  VAL  56          HG23      VAL  56  -9.004  -5.245   5.668
  477    H    MET  57           HN       MET  57 -11.699  -5.552   7.627
  478    HA   MET  57           HA       MET  57 -14.057  -4.246   6.665
  479   1HB   MET  57           HB2      MET  57 -13.333  -6.652   6.225
  480   2HB   MET  57           HB1      MET  57 -13.903  -7.029   7.850
  481   1HG   MET  57           HG2      MET  57 -15.641  -7.494   6.150
  482   2HG   MET  57           HG1      MET  57 -16.148  -6.228   7.268
  483   1HE   MET  57           HE3      MET  57 -13.979  -6.778   4.202
  484   2HE   MET  57           HE2      MET  57 -14.162  -5.316   3.236
  485   3HE   MET  57           HE1      MET  57 -13.308  -5.245   4.775
  486    H    GLU  58           HN       GLU  58 -12.929  -5.091   9.844
  487    HA   GLU  58           HA       GLU  58 -15.535  -4.970  11.133
  488   1HB   GLU  58           HB2      GLU  58 -12.706  -5.203  11.996
  489   2HB   GLU  58           HB1      GLU  58 -13.791  -4.434  13.150
  490   1HG   GLU  58           HG2      GLU  58 -15.306  -6.352  13.057
  491   2HG   GLU  58           HG1      GLU  58 -14.299  -7.118  11.829
  492    H    THR  59           HN       THR  59 -12.731  -2.717  11.178
  493    HA   THR  59           HA       THR  59 -14.151  -0.577  12.429
  494    HB   THR  59           HB       THR  59 -12.114   0.229  10.460
  495    HG1  THR  59           HG1      THR  59 -11.357  -1.448  12.605
  496   1HG2  THR  59          HG21      THR  59 -12.372   0.464  13.468
  497   2HG2  THR  59          HG23      THR  59 -11.153   1.281  12.491
  498   3HG2  THR  59          HG22      THR  59 -12.858   1.678  12.286
  499    H    LEU  60           HN       LEU  60 -14.110  -1.807   9.207
  500    HA   LEU  60           HA       LEU  60 -15.129   0.524   7.849
  501   1HB   LEU  60           HB2      LEU  60 -14.783  -2.378   7.260
  502   2HB   LEU  60           HB1      LEU  60 -15.952  -1.502   6.277
  503    HG   LEU  60           HG       LEU  60 -13.077  -0.655   6.725
  504   1HD1  LEU  60          HD13      LEU  60 -13.522  -2.760   5.314
  505   2HD1  LEU  60          HD12      LEU  60 -14.313  -1.683   4.165
  506   3HD1  LEU  60          HD11      LEU  60 -12.604  -1.469   4.541
  507   1HD2  LEU  60          HD21      LEU  60 -15.353   0.802   5.894
  508   2HD2  LEU  60          HD23      LEU  60 -13.668   1.312   5.793
  509   3HD2  LEU  60          HD22      LEU  60 -14.423   0.481   4.432
  510    H    ASP  61           HN       ASP  61 -16.707  -2.493   8.934
  511    HA   ASP  61           HA       ASP  61 -19.372  -1.462   8.414
  512   1HB   ASP  61           HB2      ASP  61 -18.316  -3.969   8.752
  513   2HB   ASP  61           HB1      ASP  61 -19.105  -3.710  10.307
  514    H    GLU  62           HN       GLU  62 -17.138  -0.970  10.918
  515    HA   GLU  62           HA       GLU  62 -18.999  -0.783  13.128
  516   1HB   GLU  62           HB2      GLU  62 -16.226  -0.724  12.845
  517   2HB   GLU  62           HB1      GLU  62 -16.638   0.904  13.386
  518   1HG   GLU  62           HG2      GLU  62 -18.040  -1.306  14.781
  519   2HG   GLU  62           HG1      GLU  62 -16.307  -1.186  15.084
  520    H    ASP  63           HN       ASP  63 -17.355   1.696  11.155
  521    HA   ASP  63           HA       ASP  63 -19.706   3.467  11.605
  522   1HB   ASP  63           HB2      ASP  63 -17.535   3.866  13.117
  523   2HB   ASP  63           HB1      ASP  63 -16.999   4.723  11.672
  524    H    GLY  64           HN       GLY  64 -19.491   2.176   9.269
  525   1HA   GLY  64           HA2      GLY  64 -17.873   2.954   7.196
  526   2HA   GLY  64           HA1      GLY  64 -19.608   2.736   6.974
  527    H    ASP  65           HN       ASP  65 -20.188   4.986   8.867
  528    HA   ASP  65           HA       ASP  65 -19.893   7.152   6.880
  529   1HB   ASP  65           HB2      ASP  65 -22.073   6.660   8.082
  530   2HB   ASP  65           HB1      ASP  65 -21.307   7.253   9.557
  531    H    GLY  66           HN       GLY  66 -17.468   6.348   8.154
  532   1HA   GLY  66           HA2      GLY  66 -16.943   8.627  10.000
  533   2HA   GLY  66           HA1      GLY  66 -15.995   7.143   9.964
  534    H    GLU  67           HN       GLU  67 -14.252   8.934   9.759
  535    HA   GLU  67           HA       GLU  67 -13.844   9.496   6.850
  536   1HB   GLU  67           HB2      GLU  67 -12.623  11.544   7.528
  537   2HB   GLU  67           HB1      GLU  67 -14.298  11.582   8.076
  538   1HG   GLU  67           HG2      GLU  67 -13.680  11.023  10.314
  539   2HG   GLU  67           HG1      GLU  67 -12.044  10.583   9.825
  540    H    CYS  68           HN       CYS  68 -11.860   8.885   6.031
  541    HA   CYS  68           HA       CYS  68  -9.971   7.624   7.971
  542   1HB   CYS  68           HB2      CYS  68 -10.379   7.164   5.001
  543   2HB   CYS  68           HB1      CYS  68  -9.107   6.405   5.955
  544    HG   CYS  68           HG       CYS  68 -11.150   5.406   7.463
  545    H    ASP  69           HN       ASP  69  -7.602   7.747   7.095
  546    HA   ASP  69           HA       ASP  69  -7.140  10.571   6.220
  547   1HB   ASP  69           HB2      ASP  69  -5.184   8.775   7.677
  548   2HB   ASP  69           HB1      ASP  69  -5.073  10.520   7.445
  549    H    PHE  70           HN       PHE  70  -4.635  10.560   5.313
  550    HA   PHE  70           HA       PHE  70  -4.844   9.064   2.822
  551   1HB   PHE  70           HB2      PHE  70  -2.498  10.095   2.470
  552   2HB   PHE  70           HB1      PHE  70  -3.865  11.204   2.583
  553    HD1  PHE  70           HD2      PHE  70  -1.043   9.707   4.488
  554    HD2  PHE  70           HD1      PHE  70  -4.054  12.767   4.378
  555    HE1  PHE  70           HE2      PHE  70   0.021  10.826   6.430
  556    HE2  PHE  70           HE1      PHE  70  -2.989  13.886   6.320
  557    HZ   PHE  70           HZ       PHE  70  -0.952  12.915   7.345
  558    H    GLN  71           HN       GLN  71  -2.810   8.888   5.735
  559    HA   GLN  71           HA       GLN  71  -1.274   6.649   4.652
  560   1HB   GLN  71           HB2      GLN  71   0.019   6.791   6.586
  561   2HB   GLN  71           HB1      GLN  71  -0.564   8.446   6.443
  562   1HG   GLN  71           HG2      GLN  71  -1.269   8.186   8.581
  563   2HG   GLN  71           HG1      GLN  71  -2.584   7.242   7.881
  564   1HE2  GLN  71          HE22      GLN  71  -0.241   4.240   8.445
  565   2HE2  GLN  71          HE21      GLN  71  -0.593   5.091   7.021
  566    H    GLU  72           HN       GLU  72  -4.161   7.069   6.560
  567    HA   GLU  72           HA       GLU  72  -4.211   4.327   7.550
  568   1HB   GLU  72           HB2      GLU  72  -6.083   6.665   7.553
  569   2HB   GLU  72           HB1      GLU  72  -6.759   5.060   7.824
  570   1HG   GLU  72           HG2      GLU  72  -4.508   5.057   9.431
  571   2HG   GLU  72           HG1      GLU  72  -5.106   6.709   9.597
  572    H    PHE  73           HN       PHE  73  -6.132   6.091   5.086
  573    HA   PHE  73           HA       PHE  73  -7.467   3.794   4.063
  574   1HB   PHE  73           HB2      PHE  73  -8.324   5.873   3.335
  575   2HB   PHE  73           HB1      PHE  73  -6.731   6.475   2.883
  576    HD1  PHE  73           HD2      PHE  73  -9.472   4.163   1.926
  577    HD2  PHE  73           HD1      PHE  73  -5.755   5.963   0.749
  578    HE1  PHE  73           HE2      PHE  73  -9.821   3.366  -0.399
  579    HE2  PHE  73           HE1      PHE  73  -6.105   5.167  -1.572
  580    HZ   PHE  73           HZ       PHE  73  -8.138   3.870  -2.146
  581    H    MET  74           HN       MET  74  -4.194   4.802   3.858
  582    HA   MET  74           HA       MET  74  -3.559   3.328   1.415
  583   1HB   MET  74           HB2      MET  74  -2.292   5.299   2.912
  584   2HB   MET  74           HB1      MET  74  -1.350   3.859   3.273
  585   1HG   MET  74           HG2      MET  74  -0.319   4.774   1.345
  586   2HG   MET  74           HG1      MET  74  -1.307   3.445   0.738
  587   1HE   MET  74           HE1      MET  74  -2.934   3.367  -0.453
  588   2HE   MET  74           HE3      MET  74  -4.310   4.414  -0.084
  589   3HE   MET  74           HE2      MET  74  -3.477   4.562  -1.628
  590    H    ALA  75           HN       ALA  75  -2.461   2.944   4.772
  591    HA   ALA  75           HA       ALA  75  -1.552   0.280   4.360
  592   1HB   ALA  75           HB3      ALA  75  -1.507   2.115   6.462
  593   2HB   ALA  75           HB2      ALA  75  -2.477   0.780   7.086
  594   3HB   ALA  75           HB1      ALA  75  -0.840   0.483   6.502
  595    H    PHE  76           HN       PHE  76  -4.692   1.527   4.558
  596    HA   PHE  76           HA       PHE  76  -5.970  -0.847   5.688
  597   1HB   PHE  76           HB2      PHE  76  -6.787   1.804   4.690
  598   2HB   PHE  76           HB1      PHE  76  -7.935   0.518   4.321
  599    HD1  PHE  76           HD2      PHE  76  -7.594  -1.292   6.628
  600    HD2  PHE  76           HD1      PHE  76  -7.746   2.998   6.471
  601    HE1  PHE  76           HE2      PHE  76  -8.406  -1.235   8.971
  602    HE2  PHE  76           HE1      PHE  76  -8.558   3.057   8.813
  603    HZ   PHE  76           HZ       PHE  76  -8.887   0.940  10.064
  604    H    VAL  77           HN       VAL  77  -5.564   0.587   2.457
  605    HA   VAL  77           HA       VAL  77  -6.953  -1.538   1.066
  606    HB   VAL  77           HB       VAL  77  -4.935   0.532   0.130
  607   1HG1  VAL  77          HG13      VAL  77  -5.466  -1.753  -1.221
  608   2HG1  VAL  77          HG12      VAL  77  -6.833  -0.777  -1.757
  609   3HG1  VAL  77          HG11      VAL  77  -5.187  -0.211  -2.031
  610   1HG2  VAL  77          HG22      VAL  77  -7.621   0.748   0.940
  611   2HG2  VAL  77          HG21      VAL  77  -6.688   1.952   0.049
  612   3HG2  VAL  77          HG23      VAL  77  -7.669   0.772  -0.823
  613    H    SER  78           HN       SER  78  -3.673  -1.074   2.200
  614    HA   SER  78           HA       SER  78  -2.557  -3.223   0.569
  615   1HB   SER  78           HB2      SER  78  -1.439  -1.870   3.040
  616   2HB   SER  78           HB1      SER  78  -0.539  -2.897   1.929
  617    HG   SER  78           HG       SER  78  -1.970  -0.715   0.912
  618    H    MET  79           HN       MET  79  -3.300  -2.876   4.057
  619    HA   MET  79           HA       MET  79  -2.612  -5.392   4.971
  620   1HB   MET  79           HB2      MET  79  -5.016  -3.686   5.650
  621   2HB   MET  79           HB1      MET  79  -4.585  -5.137   6.544
  622   1HG   MET  79           HG2      MET  79  -2.255  -3.466   6.200
  623   2HG   MET  79           HG1      MET  79  -3.563  -2.540   6.935
  624   1HE   MET  79           HE3      MET  79  -4.495  -2.631   8.700
  625   2HE   MET  79           HE2      MET  79  -4.732  -3.983   9.804
  626   3HE   MET  79           HE1      MET  79  -3.428  -2.835  10.096
  627    H    VAL  80           HN       VAL  80  -5.551  -4.510   3.171
  628    HA   VAL  80           HA       VAL  80  -6.678  -7.180   3.363
  629    HB   VAL  80           HB       VAL  80  -8.314  -6.329   1.721
  630   1HG1  VAL  80          HG13      VAL  80  -7.583  -4.739   4.156
  631   2HG1  VAL  80          HG12      VAL  80  -8.919  -4.199   3.140
  632   3HG1  VAL  80          HG11      VAL  80  -8.970  -5.795   3.889
  633   1HG2  VAL  80          HG22      VAL  80  -6.464  -3.932   1.682
  634   2HG2  VAL  80          HG21      VAL  80  -6.889  -4.969   0.322
  635   3HG2  VAL  80          HG23      VAL  80  -8.103  -3.915   1.041
  636    H    THR  81           HN       THR  81  -5.103  -5.342   0.717
  637    HA   THR  81           HA       THR  81  -5.226  -7.492  -1.175
  638    HB   THR  81           HB       THR  81  -2.937  -5.570  -1.257
  639    HG1  THR  81           HG1      THR  81  -5.670  -4.888  -1.572
  640   1HG2  THR  81          HG21      THR  81  -4.530  -7.196  -3.060
  641   2HG2  THR  81          HG23      THR  81  -4.492  -5.514  -3.590
  642   3HG2  THR  81          HG22      THR  81  -2.985  -6.398  -3.353
  643    H    THR  82           HN       THR  82  -3.422  -7.169   1.672
  644    HA   THR  82           HA       THR  82  -1.265  -8.968   0.693
  645    HB   THR  82           HB       THR  82  -0.523  -8.542   3.209
  646    HG1  THR  82           HG1      THR  82  -2.277  -7.417   3.900
  647   1HG2  THR  82          HG23      THR  82  -0.293  -6.776   0.798
  648   2HG2  THR  82          HG22      THR  82   0.415  -6.244   2.323
  649   3HG2  THR  82          HG21      THR  82   0.944  -7.756   1.584
  650    H    ALA  83           HN       ALA  83  -3.925  -8.779   3.015
  651    HA   ALA  83           HA       ALA  83  -3.417 -11.401   4.163
  652   1HB   ALA  83           HB3      ALA  83  -5.451  -9.268   4.431
  653   2HB   ALA  83           HB2      ALA  83  -6.043 -10.905   4.721
  654   3HB   ALA  83           HB1      ALA  83  -4.698 -10.271   5.670
  655    H    CYS  84           HN       CYS  84  -6.410 -10.395   2.505
  656    HA   CYS  84           HA       CYS  84  -6.540 -13.105   1.294
  657   1HB   CYS  84           HB2      CYS  84  -8.521 -12.116   2.526
  658   2HB   CYS  84           HB1      CYS  84  -8.640 -10.922   1.234
  659    HG   CYS  84           HG       CYS  84  -8.799 -13.170  -0.386
  660    H    HIS  85           HN       HIS  85  -4.945 -12.765  -0.381
  661    HA   HIS  85           HA       HIS  85  -6.058 -11.421  -2.741
  662   1HB   HIS  85           HB2      HIS  85  -4.919  -9.536  -1.740
  663   2HB   HIS  85           HB1      HIS  85  -3.474 -10.505  -1.456
  664    HD1  HIS  85           HD1      HIS  85  -5.522  -9.062  -4.307
  665    HD2  HIS  85           HD2      HIS  85  -1.738 -10.674  -3.637
  666    HE1  HIS  85           HE1      HIS  85  -4.208  -8.717  -6.443
  667    H    GLU  86           HN       GLU  86  -4.700 -11.886  -4.693
  668    HA   GLU  86           HA       GLU  86  -3.601 -14.612  -4.506
  669   1HB   GLU  86           HB2      GLU  86  -5.103 -13.562  -6.404
  670   2HB   GLU  86           HB1      GLU  86  -3.561 -12.967  -7.017
  671   1HG   GLU  86           HG2      GLU  86  -3.107 -14.997  -7.870
  672   2HG   GLU  86           HG1      GLU  86  -3.231 -15.707  -6.262
  673    H    PHE  87           HN       PHE  87  -2.020 -12.850  -3.073
  674    HA   PHE  87           HA       PHE  87   0.076 -11.550  -4.424
  675   1HB   PHE  87           HB2      PHE  87  -0.536 -11.980  -1.812
  676   2HB   PHE  87           HB1      PHE  87   0.851 -13.054  -1.997
  677    HD1  PHE  87           HD1      PHE  87   2.627 -11.781  -3.820
  678    HD2  PHE  87           HD2      PHE  87   0.123  -9.954  -0.848
  679    HE1  PHE  87           HE1      PHE  87   4.162  -9.837  -3.720
  680    HE2  PHE  87           HE2      PHE  87   1.659  -8.009  -0.749
  681    HZ   PHE  87           HZ       PHE  87   3.680  -7.951  -2.184
  682    H    PHE  88           HN       PHE  88  -0.218 -14.996  -3.539
  683    HA   PHE  88           HA       PHE  88   1.862 -15.568  -5.574
  684   1HB   PHE  88           HB2      PHE  88   2.006 -16.967  -2.915
  685   2HB   PHE  88           HB1      PHE  88   3.258 -16.791  -4.143
  686    HD1  PHE  88           HD1      PHE  88   4.267 -14.494  -4.552
  687    HD2  PHE  88           HD2      PHE  88   1.750 -15.361  -1.183
  688    HE1  PHE  88           HE1      PHE  88   5.116 -12.466  -3.397
  689    HE2  PHE  88           HE2      PHE  88   2.601 -13.334  -0.027
  690    HZ   PHE  88           HZ       PHE  88   4.285 -11.891  -1.134
  691    H    GLU  89           HN       GLU  89  -0.918 -15.998  -5.804
  692    HA   GLU  89           HA       GLU  89  -1.116 -18.968  -5.482
  693   1HB   GLU  89           HB2      GLU  89  -2.895 -17.012  -4.638
  694   2HB   GLU  89           HB1      GLU  89  -3.600 -17.575  -6.153
  695   1HG   GLU  89           HG2      GLU  89  -2.851 -19.943  -5.001
  696   2HG   GLU  89           HG1      GLU  89  -3.295 -18.991  -3.584
  697    H    HIS  90           HN       HIS  90  -1.665 -16.255  -7.685
  698    HA   HIS  90           HA       HIS  90  -0.945 -17.820  -9.992
  699   1HB   HIS  90           HB2      HIS  90  -3.679 -17.994  -9.152
  700   2HB   HIS  90           HB1      HIS  90  -3.614 -17.091 -10.665
  701    HD1  HIS  90           HD1      HIS  90  -4.504 -20.221 -10.099
  702    HD2  HIS  90           HD2      HIS  90  -1.068 -18.830 -12.002
  703    HE1  HIS  90           HE1      HIS  90  -3.687 -22.113 -11.573
  704    H    GLU  91           HN       GLU  91  -0.206 -15.296  -8.883
  705    HA   GLU  91           HA       GLU  91   0.322 -13.162  -9.722
  706   1HB   GLU  91           HB2      GLU  91  -0.426 -14.675 -12.018
  707   2HB   GLU  91           HB1      GLU  91  -1.210 -13.100 -12.147
  708   1HG   GLU  91           HG2      GLU  91   0.926 -11.965 -11.810
  709   2HG   GLU  91           HG1      GLU  91   1.735 -13.511 -11.556
  710   1H    MET   0           HT3      MET   0  -7.677  -1.909 -14.700
  711   2H    MET   0           HT2      MET   0  -8.242  -3.496 -14.925
  712   3H    MET   0           HT1      MET   0  -7.569  -2.636 -16.226
  713    HA   MET   0           HA       MET   0  -9.501  -1.713 -16.744
  714   1HB   MET   0           HB2      MET   0 -10.295  -3.977 -16.130
  715   2HB   MET   0           HB1      MET   0 -10.541  -3.431 -14.470
  716   1HG   MET   0           HG2      MET   0 -12.253  -1.895 -15.135
  717   2HG   MET   0           HG1      MET   0 -11.867  -2.103 -16.842
  718   1HE   MET   0           HE2      MET   0 -12.989  -3.037 -18.183
  719   2HE   MET   0           HE1      MET   0 -12.621  -4.760 -18.196
  720   3HE   MET   0           HE3      MET   0 -14.294  -4.211 -18.040
  721    H    SER   1           HN       SER   1  -8.970  -1.693 -13.235
  722    HA   SER   1           HA       SER   1 -10.336   0.968 -13.151
  723   1HB   SER   1           HB2      SER   1 -11.215   0.447 -11.102
  724   2HB   SER   1           HB1      SER   1 -11.016  -1.202 -11.686
  725    HG   SER   1           HG       SER   1  -8.803  -0.952 -10.744
  726    H    GLU   2           HN       GLU   2  -9.376   2.332 -11.231
  727    HA   GLU   2           HA       GLU   2  -6.526   2.631 -11.791
  728   1HB   GLU   2           HB2      GLU   2  -8.346   4.470 -11.293
  729   2HB   GLU   2           HB1      GLU   2  -7.934   4.137  -9.613
  730   1HG   GLU   2           HG2      GLU   2  -6.173   5.521  -9.861
  731   2HG   GLU   2           HG1      GLU   2  -5.467   4.311 -10.931
  732    H    LEU   3           HN       LEU   3  -8.482   1.367  -9.152
  733    HA   LEU   3           HA       LEU   3  -6.230   1.242  -7.295
  734   1HB   LEU   3           HB2      LEU   3  -8.699   1.425  -6.667
  735   2HB   LEU   3           HB1      LEU   3  -8.828  -0.281  -7.086
  736    HG   LEU   3           HG       LEU   3  -6.869  -0.682  -5.499
  737   1HD1  LEU   3          HD11      LEU   3  -7.566   2.185  -4.825
  738   2HD1  LEU   3          HD13      LEU   3  -6.724   1.123  -3.697
  739   3HD1  LEU   3          HD12      LEU   3  -5.986   1.527  -5.246
  740   1HD2  LEU   3          HD21      LEU   3  -9.680  -0.118  -4.926
  741   2HD2  LEU   3          HD23      LEU   3  -8.667  -1.446  -4.358
  742   3HD2  LEU   3          HD22      LEU   3  -8.651   0.102  -3.510
  743    H    GLU   4           HN       GLU   4  -8.160  -1.225  -9.011
  744    HA   GLU   4           HA       GLU   4  -6.675  -3.476  -8.221
  745   1HB   GLU   4           HB2      GLU   4  -8.744  -3.751  -9.441
  746   2HB   GLU   4           HB1      GLU   4  -8.089  -2.903 -10.839
  747   1HG   GLU   4           HG2      GLU   4  -6.250  -4.955 -10.348
  748   2HG   GLU   4           HG1      GLU   4  -7.823  -5.706 -10.096
  749    H    LYS   5           HN       LYS   5  -6.162  -1.482 -11.157
  750    HA   LYS   5           HA       LYS   5  -3.831  -2.898 -12.006
  751   1HB   LYS   5           HB2      LYS   5  -4.405   0.029 -12.512
  752   2HB   LYS   5           HB1      LYS   5  -3.474  -1.077 -13.522
  753   1HG   LYS   5           HG2      LYS   5  -6.225  -1.977 -12.942
  754   2HG   LYS   5           HG1      LYS   5  -6.119  -0.509 -13.916
  755   1HD   LYS   5           HD2      LYS   5  -5.891  -1.988 -15.633
  756   2HD   LYS   5           HD1      LYS   5  -4.209  -2.017 -15.106
  757   1HE   LYS   5           HE2      LYS   5  -4.625  -3.984 -13.734
  758   2HE   LYS   5           HE1      LYS   5  -6.346  -3.920 -14.108
  759   1HZ   LYS   5           HZ2      LYS   5  -4.430  -4.039 -16.321
  760   2HZ   LYS   5           HZ1      LYS   5  -4.748  -5.462 -15.449
  761   3HZ   LYS   5           HZ3      LYS   5  -6.014  -4.647 -16.228
  762    H    ALA   6           HN       ALA   6  -4.248  -0.171  -9.784
  763    HA   ALA   6           HA       ALA   6  -1.375   0.317  -9.583
  764   1HB   ALA   6           HB3      ALA   6  -3.240   2.033  -9.208
  765   2HB   ALA   6           HB2      ALA   6  -3.495   1.258  -7.647
  766   3HB   ALA   6           HB1      ALA   6  -1.945   2.014  -8.012
  767    H    MET   7           HN       MET   7  -3.640  -0.446  -6.949
  768    HA   MET   7           HA       MET   7  -1.872  -1.380  -5.062
  769   1HB   MET   7           HB2      MET   7  -4.172  -1.258  -4.460
  770   2HB   MET   7           HB1      MET   7  -4.652  -2.342  -5.769
  771   1HG   MET   7           HG2      MET   7  -4.592  -3.384  -3.442
  772   2HG   MET   7           HG1      MET   7  -3.676  -4.237  -4.682
  773   1HE   MET   7           HE2      MET   7  -3.754  -1.631  -2.053
  774   2HE   MET   7           HE1      MET   7  -3.451  -3.044  -1.049
  775   3HE   MET   7           HE3      MET   7  -2.243  -1.756  -1.158
  776    H    VAL   8           HN       VAL   8  -3.384  -3.362  -7.610
  777    HA   VAL   8           HA       VAL   8  -1.960  -5.754  -6.902
  778    HB   VAL   8           HB       VAL   8  -3.058  -5.069  -9.638
  779   1HG1  VAL   8          HG12      VAL   8  -2.223  -7.540  -8.173
  780   2HG1  VAL   8          HG11      VAL   8  -3.576  -7.656  -9.297
  781   3HG1  VAL   8          HG13      VAL   8  -1.998  -7.115  -9.869
  782   1HG2  VAL   8          HG22      VAL   8  -4.568  -4.782  -7.461
  783   2HG2  VAL   8          HG21      VAL   8  -5.207  -5.556  -8.911
  784   3HG2  VAL   8          HG23      VAL   8  -4.639  -6.540  -7.565
  785    H    ALA   9           HN       ALA   9  -1.211  -3.073  -9.091
  786    HA   ALA   9           HA       ALA   9   0.972  -4.266 -10.464
  787   1HB   ALA   9           HB2      ALA   9   0.454  -1.398  -9.637
  788   2HB   ALA   9           HB1      ALA   9   1.827  -1.872 -10.635
  789   3HB   ALA   9           HB3      ALA   9   0.185  -2.129 -11.218
  790    H    LEU  10           HN       LEU  10   0.828  -2.618  -7.313
  791    HA   LEU  10           HA       LEU  10   3.606  -2.606  -6.730
  792   1HB   LEU  10           HB2      LEU  10   1.151  -2.188  -5.294
  793   2HB   LEU  10           HB1      LEU  10   2.202  -3.228  -4.334
  794    HG   LEU  10           HG       LEU  10   3.553  -0.935  -5.624
  795   1HD1  LEU  10          HD11      LEU  10   1.584  -0.538  -3.351
  796   2HD1  LEU  10          HD13      LEU  10   2.720   0.674  -3.941
  797   3HD1  LEU  10          HD12      LEU  10   1.414   0.109  -4.983
  798   1HD2  LEU  10          HD22      LEU  10   3.651  -2.550  -3.130
  799   2HD2  LEU  10          HD21      LEU  10   4.971  -1.946  -4.130
  800   3HD2  LEU  10          HD23      LEU  10   4.170  -0.870  -2.985
  801    H    ILE  11           HN       ILE  11   1.150  -5.084  -5.878
  802    HA   ILE  11           HA       ILE  11   2.863  -6.975  -4.715
  803    HB   ILE  11           HB       ILE  11   0.410  -7.324  -6.454
  804   1HG1  ILE  11          HG12      ILE  11  -0.425  -8.150  -4.141
  805   2HG1  ILE  11          HG11      ILE  11   1.030  -7.386  -3.500
  806   1HG2  ILE  11          HG23      ILE  11   2.084  -9.422  -5.052
  807   2HG2  ILE  11          HG22      ILE  11   0.419  -9.699  -5.562
  808   3HG2  ILE  11          HG21      ILE  11   1.663  -9.356  -6.762
  809   1HD1  ILE  11          HD11      ILE  11  -0.811  -5.870  -5.338
  810   2HD1  ILE  11          HD13      ILE  11  -1.147  -5.971  -3.611
  811   3HD1  ILE  11          HD12      ILE  11   0.353  -5.237  -4.174
  812    H    ASP  12           HN       ASP  12   2.479  -6.054  -8.063
  813    HA   ASP  12           HA       ASP  12   3.804  -8.282  -9.277
  814   1HB   ASP  12           HB2      ASP  12   2.484  -6.267 -10.336
  815   2HB   ASP  12           HB1      ASP  12   4.066  -5.488 -10.358
  816    H    VAL  13           HN       VAL  13   5.045  -5.089  -8.227
  817    HA   VAL  13           HA       VAL  13   7.743  -5.403  -8.907
  818    HB   VAL  13           HB       VAL  13   6.556  -4.127  -6.421
  819   1HG1  VAL  13          HG12      VAL  13   9.238  -4.775  -6.928
  820   2HG1  VAL  13          HG11      VAL  13   9.099  -3.066  -7.343
  821   3HG1  VAL  13          HG13      VAL  13   8.644  -3.622  -5.733
  822   1HG2  VAL  13          HG23      VAL  13   6.301  -3.384  -9.059
  823   2HG2  VAL  13          HG22      VAL  13   6.200  -2.277  -7.690
  824   3HG2  VAL  13          HG21      VAL  13   7.723  -2.470  -8.556
  825    H    PHE  14           HN       PHE  14   5.986  -6.727  -6.135
  826    HA   PHE  14           HA       PHE  14   8.215  -7.753  -4.698
  827   1HB   PHE  14           HB2      PHE  14   5.612  -7.665  -4.159
  828   2HB   PHE  14           HB1      PHE  14   5.662  -9.309  -4.797
  829    HD1  PHE  14           HD1      PHE  14   7.573 -10.845  -3.871
  830    HD2  PHE  14           HD2      PHE  14   6.177  -7.284  -1.922
  831    HE1  PHE  14           HE1      PHE  14   8.512 -11.654  -1.723
  832    HE2  PHE  14           HE2      PHE  14   7.114  -8.089   0.228
  833    HZ   PHE  14           HZ       PHE  14   8.282 -10.276   0.329
  834    H    HIS  15           HN       HIS  15   6.276  -9.188  -7.319
  835    HA   HIS  15           HA       HIS  15   7.659 -11.722  -7.276
  836   1HB   HIS  15           HB2      HIS  15   5.388 -11.256  -8.328
  837   2HB   HIS  15           HB1      HIS  15   6.257 -10.483  -9.653
  838    HD1  HIS  15           HD1      HIS  15   7.909 -13.401  -8.075
  839    HD2  HIS  15           HD2      HIS  15   5.420 -12.700 -11.343
  840    HE1  HIS  15           HE1      HIS  15   7.995 -15.492  -9.505
  841    H    GLN  16           HN       GLN  16   8.444  -8.602  -8.510
  842    HA   GLN  16           HA       GLN  16  10.306  -9.551 -10.548
  843   1HB   GLN  16           HB2      GLN  16   9.053  -7.158 -10.080
  844   2HB   GLN  16           HB1      GLN  16  10.682  -6.822  -9.490
  845   1HG   GLN  16           HG2      GLN  16  10.717  -6.280 -11.814
  846   2HG   GLN  16           HG1      GLN  16  11.529  -7.840 -11.678
  847   1HE2  GLN  16          HE22      GLN  16   9.322  -8.949 -14.222
  848   2HE2  GLN  16          HE21      GLN  16  10.929  -8.596 -13.807
  849    H    TYR  17           HN       TYR  17  10.719  -7.912  -7.383
  850    HA   TYR  17           HA       TYR  17  13.578  -8.526  -7.363
  851   1HB   TYR  17           HB2      TYR  17  11.735  -7.418  -5.227
  852   2HB   TYR  17           HB1      TYR  17  13.484  -7.556  -5.061
  853    HD1  TYR  17           HD1      TYR  17  10.808  -6.041  -7.176
  854    HD2  TYR  17           HD2      TYR  17  14.920  -5.903  -5.948
  855    HE1  TYR  17           HE1      TYR  17  11.092  -3.885  -8.367
  856    HE2  TYR  17           HE2      TYR  17  15.205  -3.746  -7.139
  857    HH   TYR  17           HH       TYR  17  13.740  -2.659  -9.339
  858    H    SER  18           HN       SER  18  10.814  -9.507  -5.316
  859    HA   SER  18           HA       SER  18  12.383 -11.723  -4.192
  860   1HB   SER  18           HB2      SER  18  10.448 -10.220  -3.112
  861   2HB   SER  18           HB1      SER  18   9.439 -11.509  -3.764
  862    HG   SER  18           HG       SER  18  11.769 -12.210  -2.392
  863    H    GLY  19           HN       GLY  19  12.530 -12.424  -6.658
  864   1HA   GLY  19           HA2      GLY  19  10.878 -14.789  -6.926
  865   2HA   GLY  19           HA1      GLY  19  10.432 -13.550  -8.100
  866    H    ARG  20           HN       ARG  20  12.991 -12.451  -8.583
  867    HA   ARG  20           HA       ARG  20  14.160 -14.653 -10.188
  868   1HB   ARG  20           HB2      ARG  20  15.294 -12.915 -11.432
  869   2HB   ARG  20           HB1      ARG  20  13.615 -12.421 -11.230
  870   1HG   ARG  20           HG2      ARG  20  14.275 -11.040  -9.274
  871   2HG   ARG  20           HG1      ARG  20  15.958 -11.495  -9.540
  872   1HD   ARG  20           HD2      ARG  20  15.645 -10.583 -11.928
  873   2HD   ARG  20           HD1      ARG  20  14.170  -9.836 -11.319
  874    HE   ARG  20           HE       ARG  20  16.590  -9.269  -9.746
  875   1HH1  ARG  20          HH11      ARG  20  13.848  -7.796 -10.520
  876   2HH1  ARG  20          HH12      ARG  20  14.522  -6.371 -11.240
  877   1HH2  ARG  20          HH21      ARG  20  17.730  -7.670 -11.436
  878   2HH2  ARG  20          HH22      ARG  20  16.720  -6.299 -11.756
  879    H    GLU  21           HN       GLU  21  14.706 -12.966  -7.272
  880    HA   GLU  21           HA       GLU  21  17.620 -13.492  -7.297
  881   1HB   GLU  21           HB2      GLU  21  15.954 -11.580  -6.031
  882   2HB   GLU  21           HB1      GLU  21  16.629 -12.584  -4.747
  883   1HG   GLU  21           HG2      GLU  21  18.898 -12.236  -5.699
  884   2HG   GLU  21           HG1      GLU  21  18.202 -11.173  -6.921
  885    H    GLY  22           HN       GLY  22  17.889 -14.054  -4.505
  886   1HA   GLY  22           HA2      GLY  22  17.464 -16.908  -4.539
  887   2HA   GLY  22           HA1      GLY  22  18.045 -15.978  -3.160
  888    H    ASP  23           HN       ASP  23  16.159 -14.447  -2.304
  889    HA   ASP  23           HA       ASP  23  14.193 -16.110  -1.135
  890   1HB   ASP  23           HB2      ASP  23  13.760 -13.163  -1.601
  891   2HB   ASP  23           HB1      ASP  23  13.290 -14.139  -0.213
  892    H    LYS  24           HN       LYS  24  11.717 -14.976  -1.475
  893    HA   LYS  24           HA       LYS  24  11.035 -14.720  -4.300
  894   1HB   LYS  24           HB2      LYS  24  11.352 -17.184  -4.081
  895   2HB   LYS  24           HB1      LYS  24  10.129 -17.205  -2.811
  896   1HG   LYS  24           HG2      LYS  24   8.426 -16.441  -4.344
  897   2HG   LYS  24           HG1      LYS  24   9.622 -16.162  -5.609
  898   1HD   LYS  24           HD2      LYS  24  10.158 -18.734  -5.179
  899   2HD   LYS  24           HD1      LYS  24   8.492 -18.743  -4.604
  900   1HE   LYS  24           HE2      LYS  24   8.577 -19.274  -7.007
  901   2HE   LYS  24           HE1      LYS  24   7.753 -17.739  -6.738
  902   1HZ   LYS  24           HZ3      LYS  24  10.647 -17.707  -7.179
  903   2HZ   LYS  24           HZ2      LYS  24   9.633 -17.964  -8.518
  904   3HZ   LYS  24           HZ1      LYS  24   9.480 -16.549  -7.590
  905    H    HIS  25           HN       HIS  25   9.199 -16.111  -1.568
  906    HA   HIS  25           HA       HIS  25   7.175 -14.012  -1.937
  907   1HB   HIS  25           HB2      HIS  25   5.823 -15.700  -1.332
  908   2HB   HIS  25           HB1      HIS  25   7.211 -16.727  -1.022
  909    HD1  HIS  25           HD1      HIS  25   4.337 -15.581   0.654
  910    HD2  HIS  25           HD2      HIS  25   8.343 -15.855   1.767
  911    HE1  HIS  25           HE1      HIS  25   4.383 -15.539   3.185
  912    H    LYS  26           HN       LYS  26  10.037 -13.987  -0.453
  913    HA   LYS  26           HA       LYS  26   9.037 -12.227   1.744
  914   1HB   LYS  26           HB2      LYS  26  10.896 -13.058   3.166
  915   2HB   LYS  26           HB1      LYS  26   9.771 -14.350   2.738
  916   1HG   LYS  26           HG2      LYS  26  11.440 -14.615   0.672
  917   2HG   LYS  26           HG1      LYS  26  12.574 -13.896   1.816
  918   1HD   LYS  26           HD2      LYS  26  10.825 -16.163   2.716
  919   2HD   LYS  26           HD1      LYS  26  12.261 -16.512   1.752
  920   1HE   LYS  26           HE2      LYS  26  13.676 -15.352   3.366
  921   2HE   LYS  26           HE1      LYS  26  12.262 -14.867   4.301
  922   1HZ   LYS  26           HZ2      LYS  26  12.179 -17.645   3.898
  923   2HZ   LYS  26           HZ1      LYS  26  13.717 -17.238   4.497
  924   3HZ   LYS  26           HZ3      LYS  26  12.328 -16.792   5.361
  925    H    LEU  27           HN       LEU  27  10.026 -10.244   1.746
  926    HA   LEU  27           HA       LEU  27  12.201  -9.814  -0.221
  927   1HB   LEU  27           HB2      LEU  27   9.964  -8.292   0.640
  928   2HB   LEU  27           HB1      LEU  27  11.404  -7.410   1.147
  929    HG   LEU  27           HG       LEU  27  11.080  -8.529  -1.644
  930   1HD1  LEU  27          HD12      LEU  27   9.414  -6.631  -0.669
  931   2HD1  LEU  27          HD11      LEU  27  10.771  -5.614  -1.155
  932   3HD1  LEU  27          HD13      LEU  27   9.973  -6.649  -2.341
  933   1HD2  LEU  27          HD21      LEU  27  12.859  -6.378  -0.446
  934   2HD2  LEU  27          HD23      LEU  27  13.373  -8.004  -0.897
  935   3HD2  LEU  27          HD22      LEU  27  12.848  -6.869  -2.141
  936    H    LYS  28           HN       LYS  28  13.248  -7.463   1.130
  937    HA   LYS  28           HA       LYS  28  14.321  -8.476   3.689
  938   1HB   LYS  28           HB2      LYS  28  15.934  -8.090   1.177
  939   2HB   LYS  28           HB1      LYS  28  16.680  -7.864   2.758
  940   1HG   LYS  28           HG2      LYS  28  15.978 -10.138   3.414
  941   2HG   LYS  28           HG1      LYS  28  15.235 -10.366   1.831
  942   1HD   LYS  28           HD2      LYS  28  17.314 -11.342   1.479
  943   2HD   LYS  28           HD1      LYS  28  17.630  -9.688   0.952
  944   1HE   LYS  28           HE2      LYS  28  19.099  -9.334   2.629
  945   2HE   LYS  28           HE1      LYS  28  17.994 -10.004   3.829
  946   1HZ   LYS  28           HZ1      LYS  28  18.952 -12.069   2.171
  947   2HZ   LYS  28           HZ3      LYS  28  20.271 -11.189   2.774
  948   3HZ   LYS  28           HZ2      LYS  28  19.147 -11.875   3.847
  949    H    LYS  29           HN       LYS  29  15.651  -6.732   4.768
  950    HA   LYS  29           HA       LYS  29  14.331  -4.158   4.438
  951   1HB   LYS  29           HB2      LYS  29  16.755  -4.831   6.132
  952   2HB   LYS  29           HB1      LYS  29  15.681  -3.444   6.327
  953   1HG   LYS  29           HG2      LYS  29  13.835  -4.859   6.939
  954   2HG   LYS  29           HG1      LYS  29  14.733  -6.314   6.505
  955   1HD   LYS  29           HD2      LYS  29  15.248  -6.382   8.720
  956   2HD   LYS  29           HD1      LYS  29  16.438  -5.152   8.297
  957   1HE   LYS  29           HE2      LYS  29  15.358  -3.995   9.961
  958   2HE   LYS  29           HE1      LYS  29  14.299  -3.558   8.621
  959   1HZ   LYS  29           HZ2      LYS  29  13.476  -6.039   9.607
  960   2HZ   LYS  29           HZ1      LYS  29  13.663  -4.997  10.935
  961   3HZ   LYS  29           HZ3      LYS  29  12.641  -4.561   9.656
  962    H    SER  30           HN       SER  30  17.319  -5.602   3.371
  963    HA   SER  30           HA       SER  30  18.555  -3.046   2.639
  964   1HB   SER  30           HB2      SER  30  19.964  -4.984   3.204
  965   2HB   SER  30           HB1      SER  30  19.261  -5.900   1.874
  966    HG   SER  30           HG       SER  30  21.284  -4.872   1.369
  967    H    GLU  31           HN       GLU  31  16.687  -5.585   1.017
  968    HA   GLU  31           HA       GLU  31  16.985  -4.255  -1.593
  969   1HB   GLU  31           HB2      GLU  31  16.614  -6.856  -0.989
  970   2HB   GLU  31           HB1      GLU  31  14.925  -6.375  -1.150
  971   1HG   GLU  31           HG2      GLU  31  15.274  -5.590  -3.392
  972   2HG   GLU  31           HG1      GLU  31  17.024  -5.747  -3.236
  973    H    LEU  32           HN       LEU  32  14.940  -4.179   1.160
  974    HA   LEU  32           HA       LEU  32  12.623  -3.056  -0.245
  975   1HB   LEU  32           HB2      LEU  32  12.140  -4.246   1.796
  976   2HB   LEU  32           HB1      LEU  32  13.354  -3.327   2.687
  977    HG   LEU  32           HG       LEU  32  12.065  -1.297   2.498
  978   1HD1  LEU  32          HD12      LEU  32  10.801  -2.801   0.325
  979   2HD1  LEU  32          HD11      LEU  32   9.631  -1.983   1.358
  980   3HD1  LEU  32          HD13      LEU  32  10.907  -1.057   0.568
  981   1HD2  LEU  32          HD23      LEU  32  11.383  -2.954   4.251
  982   2HD2  LEU  32          HD22      LEU  32  10.055  -1.917   3.730
  983   3HD2  LEU  32          HD21      LEU  32  10.164  -3.576   3.137
  984    H    LYS  33           HN       LYS  33  15.374  -1.958   1.668
  985    HA   LYS  33           HA       LYS  33  14.726   0.808   1.856
  986   1HB   LYS  33           HB2      LYS  33  16.708  -0.638   2.856
  987   2HB   LYS  33           HB1      LYS  33  17.556  -0.087   1.417
  988   1HG   LYS  33           HG2      LYS  33  16.489   2.261   2.213
  989   2HG   LYS  33           HG1      LYS  33  16.634   1.468   3.781
  990   1HD   LYS  33           HD2      LYS  33  19.040   0.896   3.090
  991   2HD   LYS  33           HD1      LYS  33  18.823   2.067   1.790
  992   1HE   LYS  33           HE2      LYS  33  19.010   3.826   3.201
  993   2HE   LYS  33           HE1      LYS  33  17.940   3.084   4.390
  994   1HZ   LYS  33           HZ3      LYS  33  20.768   2.291   3.980
  995   2HZ   LYS  33           HZ2      LYS  33  20.254   3.391   5.168
  996   3HZ   LYS  33           HZ1      LYS  33  19.731   1.775   5.218
  997    H    GLU  34           HN       GLU  34  16.298  -1.090  -0.669
  998    HA   GLU  34           HA       GLU  34  16.846   1.237  -2.344
  999   1HB   GLU  34           HB2      GLU  34  17.865  -0.284  -3.810
 1000   2HB   GLU  34           HB1      GLU  34  18.034  -1.113  -2.267
 1001   1HG   GLU  34           HG2      GLU  34  16.206  -2.570  -2.728
 1002   2HG   GLU  34           HG1      GLU  34  15.698  -1.617  -4.118
 1003    H    LEU  35           HN       LEU  35  14.455  -1.332  -2.197
 1004    HA   LEU  35           HA       LEU  35  12.992  -0.893  -4.549
 1005   1HB   LEU  35           HB2      LEU  35  12.669  -2.458  -2.326
 1006   2HB   LEU  35           HB1      LEU  35  11.355  -1.295  -2.121
 1007    HG   LEU  35           HG       LEU  35  10.459  -3.099  -3.425
 1008   1HD1  LEU  35          HD13      LEU  35  10.367  -0.536  -4.251
 1009   2HD1  LEU  35          HD12      LEU  35  11.135  -1.256  -5.664
 1010   3HD1  LEU  35          HD11      LEU  35   9.562  -1.841  -5.125
 1011   1HD2  LEU  35          HD22      LEU  35  13.058  -3.517  -4.216
 1012   2HD2  LEU  35          HD21      LEU  35  11.656  -4.306  -4.939
 1013   3HD2  LEU  35          HD23      LEU  35  12.337  -2.862  -5.685
 1014    H    ILE  36           HN       ILE  36  12.660   0.793  -1.414
 1015    HA   ILE  36           HA       ILE  36  10.632   2.609  -2.477
 1016    HB   ILE  36           HB       ILE  36  12.165   3.175   0.034
 1017   1HG1  ILE  36          HG12      ILE  36  10.553   0.735  -0.557
 1018   2HG1  ILE  36          HG11      ILE  36  11.876   0.962   0.579
 1019   1HG2  ILE  36          HG23      ILE  36  10.259   4.587  -0.899
 1020   2HG2  ILE  36          HG22      ILE  36   9.195   3.231  -0.529
 1021   3HG2  ILE  36          HG21      ILE  36  10.067   4.048   0.768
 1022   1HD1  ILE  36          HD13      ILE  36   9.057   2.001   0.974
 1023   2HD1  ILE  36          HD12      ILE  36   9.732   0.569   1.752
 1024   3HD1  ILE  36          HD11      ILE  36  10.390   2.165   2.116
 1025    H    ASN  37           HN       ASN  37  13.979   3.019  -1.308
 1026    HA   ASN  37           HA       ASN  37  14.201   5.755  -2.114
 1027   1HB   ASN  37           HB2      ASN  37  15.684   4.501  -0.475
 1028   2HB   ASN  37           HB1      ASN  37  16.491   3.800  -1.877
 1029   1HD2  ASN  37          HD22      ASN  37  17.080   7.751  -0.966
 1030   2HD2  ASN  37          HD21      ASN  37  15.837   6.881  -0.206
 1031    H    ASN  38           HN       ASN  38  13.885   3.094  -4.116
 1032    HA   ASN  38           HA       ASN  38  15.591   4.345  -6.220
 1033   1HB   ASN  38           HB2      ASN  38  15.915   1.885  -5.564
 1034   2HB   ASN  38           HB1      ASN  38  14.358   1.588  -6.337
 1035   1HD2  ASN  38          HD22      ASN  38  15.798   1.498  -9.532
 1036   2HD2  ASN  38          HD21      ASN  38  14.548   1.010  -8.497
 1037    H    GLU  39           HN       GLU  39  12.454   2.623  -5.946
 1038    HA   GLU  39           HA       GLU  39  11.491   4.263  -8.242
 1039   1HB   GLU  39           HB2      GLU  39  10.349   1.728  -7.029
 1040   2HB   GLU  39           HB1      GLU  39   9.711   2.562  -8.447
 1041   1HG   GLU  39           HG2      GLU  39  11.250   1.609  -9.789
 1042   2HG   GLU  39           HG1      GLU  39  12.563   2.081  -8.710
 1043    H    LEU  40           HN       LEU  40  11.661   5.159  -5.370
 1044    HA   LEU  40           HA       LEU  40   8.867   6.123  -5.199
 1045   1HB   LEU  40           HB2      LEU  40   9.269   3.973  -3.769
 1046   2HB   LEU  40           HB1      LEU  40  10.140   5.066  -2.691
 1047    HG   LEU  40           HG       LEU  40   7.747   6.393  -3.377
 1048   1HD1  LEU  40          HD12      LEU  40   7.322   3.693  -3.782
 1049   2HD1  LEU  40          HD11      LEU  40   6.807   3.915  -2.111
 1050   3HD1  LEU  40          HD13      LEU  40   6.069   4.872  -3.395
 1051   1HD2  LEU  40          HD22      LEU  40   9.201   6.227  -1.211
 1052   2HD2  LEU  40          HD21      LEU  40   7.462   6.463  -1.045
 1053   3HD2  LEU  40          HD23      LEU  40   8.158   4.859  -0.821
 1054    H    SER  41           HN       SER  41  12.224   6.355  -4.157
 1055    HA   SER  41           HA       SER  41  12.041   8.638  -2.492
 1056   1HB   SER  41           HB2      SER  41  14.163   7.780  -2.393
 1057   2HB   SER  41           HB1      SER  41  14.171   7.330  -4.096
 1058    HG   SER  41           HG       SER  41  14.555   9.884  -2.929
 1059    H    HIS  42           HN       HIS  42  11.345   8.404  -5.817
 1060    HA   HIS  42           HA       HIS  42  12.286  10.904  -6.788
 1061   1HB   HIS  42           HB2      HIS  42  11.219   9.028  -8.144
 1062   2HB   HIS  42           HB1      HIS  42   9.659   9.610  -7.562
 1063    HD1  HIS  42           HD1      HIS  42   8.671  10.829  -9.520
 1064    HD2  HIS  42           HD2      HIS  42  12.674  11.832  -8.926
 1065    HE1  HIS  42           HE1      HIS  42   9.192  12.695 -11.151
 1066    H    PHE  43           HN       PHE  43   9.717  10.121  -4.592
 1067    HA   PHE  43           HA       PHE  43   8.530  12.825  -4.865
 1068   1HB   PHE  43           HB2      PHE  43   7.716  10.413  -3.218
 1069   2HB   PHE  43           HB1      PHE  43   6.856  11.954  -3.224
 1070    HD1  PHE  43           HD1      PHE  43   5.923  12.831  -5.410
 1071    HD2  PHE  43           HD2      PHE  43   7.383   8.818  -4.949
 1072    HE1  PHE  43           HE1      PHE  43   4.708  12.153  -7.462
 1073    HE2  PHE  43           HE2      PHE  43   6.170   8.139  -7.003
 1074    HZ   PHE  43           HZ       PHE  43   4.831   9.807  -8.259
 1075    H    LEU  44           HN       LEU  44  10.853  11.177  -2.993
 1076    HA   LEU  44           HA       LEU  44  10.526  12.495  -0.473
 1077   1HB   LEU  44           HB2      LEU  44  12.621  10.910  -1.816
 1078   2HB   LEU  44           HB1      LEU  44  13.226  12.076  -0.636
 1079    HG   LEU  44           HG       LEU  44  12.655   9.774   0.292
 1080   1HD1  LEU  44          HD13      LEU  44  11.828  12.423   1.278
 1081   2HD1  LEU  44          HD12      LEU  44  10.986  11.076   2.047
 1082   3HD1  LEU  44          HD11      LEU  44  12.746  11.157   2.091
 1083   1HD2  LEU  44          HD23      LEU  44  10.392  10.004  -1.190
 1084   2HD2  LEU  44          HD22      LEU  44  10.511   8.968   0.232
 1085   3HD2  LEU  44          HD21      LEU  44   9.799  10.577   0.369
 1086    H    GLU  45           HN       GLU  45  11.035  14.561   0.134
 1087    HA   GLU  45           HA       GLU  45  13.150  16.125  -0.947
 1088   1HB   GLU  45           HB2      GLU  45  11.481  17.816  -2.101
 1089   2HB   GLU  45           HB1      GLU  45  12.101  16.431  -3.002
 1090   1HG   GLU  45           HG2      GLU  45  10.099  15.250  -2.837
 1091   2HG   GLU  45           HG1      GLU  45   9.581  16.133  -1.401
 1092    H    GLU  46           HN       GLU  46   9.919  16.128   0.494
 1093    HA   GLU  46           HA       GLU  46  10.851  18.353   2.266
 1094   1HB   GLU  46           HB2      GLU  46   8.206  18.605   2.520
 1095   2HB   GLU  46           HB1      GLU  46   9.086  19.401   1.217
 1096   1HG   GLU  46           HG2      GLU  46   8.408  17.816  -0.380
 1097   2HG   GLU  46           HG1      GLU  46   8.003  16.614   0.844
 1098    H    ILE  47           HN       ILE  47   8.736  15.471   2.107
 1099    HA   ILE  47           HA       ILE  47   8.287  13.866   3.761
 1100    HB   ILE  47           HB       ILE  47  10.380  15.246   5.453
 1101   1HG1  ILE  47          HG12      ILE  47  11.016  12.962   3.610
 1102   2HG1  ILE  47          HG11      ILE  47  10.992  14.602   2.960
 1103   1HG2  ILE  47          HG22      ILE  47   8.715  13.120   5.974
 1104   2HG2  ILE  47          HG21      ILE  47  10.155  12.309   5.358
 1105   3HG2  ILE  47          HG23      ILE  47  10.276  13.385   6.752
 1106   1HD1  ILE  47          HD12      ILE  47  12.446  14.217   5.525
 1107   2HD1  ILE  47          HD11      ILE  47  13.190  13.523   4.085
 1108   3HD1  ILE  47          HD13      ILE  47  12.840  15.251   4.153
 1109    H    LYS  48           HN       LYS  48   6.473  13.974   4.970
 1110    HA   LYS  48           HA       LYS  48   5.983  16.474   6.536
 1111   1HB   LYS  48           HB2      LYS  48   4.258  14.660   4.949
 1112   2HB   LYS  48           HB1      LYS  48   3.570  15.213   6.475
 1113   1HG   LYS  48           HG2      LYS  48   3.996  17.548   5.850
 1114   2HG   LYS  48           HG1      LYS  48   4.747  17.021   4.344
 1115   1HD   LYS  48           HD2      LYS  48   2.710  16.261   3.445
 1116   2HD   LYS  48           HD1      LYS  48   1.935  16.187   5.027
 1117   1HE   LYS  48           HE2      LYS  48   2.523  18.811   4.978
 1118   2HE   LYS  48           HE1      LYS  48   2.380  18.529   3.243
 1119   1HZ   LYS  48           HZ2      LYS  48   0.241  17.241   4.050
 1120   2HZ   LYS  48           HZ1      LYS  48   0.347  18.357   5.328
 1121   3HZ   LYS  48           HZ3      LYS  48   0.216  18.910   3.731
 1122    H    GLU  49           HN       GLU  49   5.779  12.924   6.653
 1123    HA   GLU  49           HA       GLU  49   5.355  13.082   9.594
 1124   1HB   GLU  49           HB2      GLU  49   4.576  11.219   7.507
 1125   2HB   GLU  49           HB1      GLU  49   5.436  10.386   8.802
 1126   1HG   GLU  49           HG2      GLU  49   3.037  12.209   9.136
 1127   2HG   GLU  49           HG1      GLU  49   3.046  10.453   9.318
 1128    H    GLN  50           HN       GLN  50   7.527  13.721  10.129
 1129    HA   GLN  50           HA       GLN  50   9.878  12.410   9.219
 1130   1HB   GLN  50           HB2      GLN  50   9.857  14.568  10.468
 1131   2HB   GLN  50           HB1      GLN  50   9.407  13.689  11.928
 1132   1HG   GLN  50           HG2      GLN  50  11.677  13.647  12.241
 1133   2HG   GLN  50           HG1      GLN  50  11.560  12.237  11.186
 1134   1HE2  GLN  50          HE22      GLN  50  14.094  14.703   9.823
 1135   2HE2  GLN  50          HE21      GLN  50  13.903  13.986  11.349
 1136    H    GLU  51           HN       GLU  51   7.478  11.431  11.548
 1137    HA   GLU  51           HA       GLU  51   9.199   9.442  12.824
 1138   1HB   GLU  51           HB2      GLU  51   6.224   9.982  12.929
 1139   2HB   GLU  51           HB1      GLU  51   6.982   8.649  13.799
 1140   1HG   GLU  51           HG2      GLU  51   8.189  10.080  15.205
 1141   2HG   GLU  51           HG1      GLU  51   8.072  11.438  14.084
 1142    H    VAL  52           HN       VAL  52   6.773   9.469  10.245
 1143    HA   VAL  52           HA       VAL  52   6.594   6.603   9.989
 1144    HB   VAL  52           HB       VAL  52   6.064   8.827   8.004
 1145   1HG1  VAL  52          HG13      VAL  52   5.829   5.847   7.820
 1146   2HG1  VAL  52          HG12      VAL  52   4.596   6.836   7.039
 1147   3HG1  VAL  52          HG11      VAL  52   6.288   7.011   6.579
 1148   1HG2  VAL  52          HG23      VAL  52   4.672   8.627  10.146
 1149   2HG2  VAL  52          HG22      VAL  52   3.773   8.588   8.628
 1150   3HG2  VAL  52          HG21      VAL  52   4.094   7.089   9.502
 1151    H    VAL  53           HN       VAL  53   8.382   9.036   8.056
 1152    HA   VAL  53           HA       VAL  53   9.807   7.026   6.558
 1153    HB   VAL  53           HB       VAL  53  10.300   9.982   7.009
 1154   1HG1  VAL  53          HG11      VAL  53  11.924   7.901   5.590
 1155   2HG1  VAL  53          HG13      VAL  53  11.806   9.510   4.876
 1156   3HG1  VAL  53          HG12      VAL  53  12.462   9.313   6.501
 1157   1HG2  VAL  53          HG21      VAL  53   9.212   8.305   4.728
 1158   2HG2  VAL  53          HG23      VAL  53   8.363   9.549   5.646
 1159   3HG2  VAL  53          HG22      VAL  53   9.665  10.001   4.547
 1160    H    ASP  54           HN       ASP  54  10.408   8.699   9.592
 1161    HA   ASP  54           HA       ASP  54  13.182   7.829   9.771
 1162   1HB   ASP  54           HB2      ASP  54  12.448   9.833  10.979
 1163   2HB   ASP  54           HB1      ASP  54  11.279   8.876  11.889
 1164    H    LYS  55           HN       LYS  55  10.077   6.467  10.472
 1165    HA   LYS  55           HA       LYS  55  11.100   4.462  12.343
 1166   1HB   LYS  55           HB2      LYS  55   8.485   5.243  11.235
 1167   2HB   LYS  55           HB1      LYS  55   8.673   3.505  11.471
 1168   1HG   LYS  55           HG2      LYS  55   9.011   3.721  13.777
 1169   2HG   LYS  55           HG1      LYS  55   9.501   5.411  13.645
 1170   1HD   LYS  55           HD2      LYS  55   7.387   6.040  14.072
 1171   2HD   LYS  55           HD1      LYS  55   6.865   5.222  12.598
 1172   1HE   LYS  55           HE2      LYS  55   6.705   3.088  13.860
 1173   2HE   LYS  55           HE1      LYS  55   7.158   3.946  15.333
 1174   1HZ   LYS  55           HZ2      LYS  55   4.916   4.965  13.745
 1175   2HZ   LYS  55           HZ1      LYS  55   4.663   3.588  14.708
 1176   3HZ   LYS  55           HZ3      LYS  55   5.175   5.041  15.421
 1177    H    VAL  56           HN       VAL  56   9.899   4.405   8.962
 1178    HA   VAL  56           HA       VAL  56  10.603   1.633   8.575
 1179    HB   VAL  56           HB       VAL  56  10.267   2.158   6.172
 1180   1HG1  VAL  56          HG12      VAL  56   8.349   1.772   7.788
 1181   2HG1  VAL  56          HG11      VAL  56   8.167   3.525   7.862
 1182   3HG1  VAL  56          HG13      VAL  56   7.930   2.676   6.334
 1183   1HG2  VAL  56          HG22      VAL  56  10.375   4.955   7.258
 1184   2HG2  VAL  56          HG21      VAL  56  11.111   4.302   5.796
 1185   3HG2  VAL  56          HG23      VAL  56   9.379   4.618   5.845
 1186    H    MET  57           HN       MET  57  12.165   4.706   7.697
 1187    HA   MET  57           HA       MET  57  14.477   3.544   6.471
 1188   1HB   MET  57           HB2      MET  57  13.727   5.981   6.366
 1189   2HB   MET  57           HB1      MET  57  14.374   6.161   7.997
 1190   1HG   MET  57           HG2      MET  57  16.027   6.843   6.287
 1191   2HG   MET  57           HG1      MET  57  16.589   5.454   7.216
 1192   1HE   MET  57           HE3      MET  57  14.275   6.358   4.346
 1193   2HE   MET  57           HE2      MET  57  14.414   5.026   3.200
 1194   3HE   MET  57           HE1      MET  57  13.634   4.761   4.757
 1195    H    GLU  58           HN       GLU  58  13.501   3.986   9.780
 1196    HA   GLU  58           HA       GLU  58  16.166   3.730  10.921
 1197   1HB   GLU  58           HB2      GLU  58  13.382   3.834  11.938
 1198   2HB   GLU  58           HB1      GLU  58  14.524   2.938  12.937
 1199   1HG   GLU  58           HG2      GLU  58  16.028   4.865  13.009
 1200   2HG   GLU  58           HG1      GLU  58  14.961   5.767  11.933
 1201    H    THR  59           HN       THR  59  13.371   1.466  10.821
 1202    HA   THR  59           HA       THR  59  14.856  -0.798  11.732
 1203    HB   THR  59           HB       THR  59  12.727  -1.375   9.775
 1204    HG1  THR  59           HG1      THR  59  12.071   0.022  12.143
 1205   1HG2  THR  59          HG21      THR  59  13.131  -1.973  12.717
 1206   2HG2  THR  59          HG23      THR  59  11.868  -2.673  11.705
 1207   3HG2  THR  59          HG22      THR  59  13.561  -3.029  11.373
 1208    H    LEU  60           HN       LEU  60  14.655   0.813   8.690
 1209    HA   LEU  60           HA       LEU  60  15.613  -1.326   7.009
 1210   1HB   LEU  60           HB2      LEU  60  15.233   1.625   6.798
 1211   2HB   LEU  60           HB1      LEU  60  16.355   0.884   5.662
 1212    HG   LEU  60           HG       LEU  60  13.507  -0.035   6.136
 1213   1HD1  LEU  60          HD13      LEU  60  13.880   2.231   4.977
 1214   2HD1  LEU  60          HD12      LEU  60  14.616   1.308   3.666
 1215   3HD1  LEU  60          HD11      LEU  60  12.927   1.036   4.094
 1216   1HD2  LEU  60          HD21      LEU  60  15.743  -1.361   5.027
 1217   2HD2  LEU  60          HD23      LEU  60  14.056  -1.868   4.943
 1218   3HD2  LEU  60          HD22      LEU  60  14.743  -0.872   3.660
 1219    H    ASP  61           HN       ASP  61  17.237   1.548   8.382
 1220    HA   ASP  61           HA       ASP  61  19.874   0.609   7.614
 1221   1HB   ASP  61           HB2      ASP  61  18.830   3.048   8.308
 1222   2HB   ASP  61           HB1      ASP  61  19.695   2.608   9.780
 1223    H    GLU  62           HN       GLU  62  17.765  -0.201  10.142
 1224    HA   GLU  62           HA       GLU  62  19.731  -0.641  12.222
 1225   1HB   GLU  62           HB2      GLU  62  16.948  -0.687  12.063
 1226   2HB   GLU  62           HB1      GLU  62  17.389  -2.367  12.380
 1227   1HG   GLU  62           HG2      GLU  62  18.852  -0.332  13.970
 1228   2HG   GLU  62           HG1      GLU  62  17.135  -0.502  14.337
 1229    H    ASP  63           HN       ASP  63  17.999  -2.876  10.037
 1230    HA   ASP  63           HA       ASP  63  20.372  -4.668  10.155
 1231   1HB   ASP  63           HB2      ASP  63  18.277  -5.265  11.708
 1232   2HB   ASP  63           HB1      ASP  63  17.673  -5.944  10.195
 1233    H    GLY  64           HN       GLY  64  20.042  -3.103   8.010
 1234   1HA   GLY  64           HA2      GLY  64  18.327  -3.637   5.934
 1235   2HA   GLY  64           HA1      GLY  64  20.049  -3.379   5.660
 1236    H    ASP  65           HN       ASP  65  20.725  -5.839   7.232
 1237    HA   ASP  65           HA       ASP  65  20.339  -7.748   5.010
 1238   1HB   ASP  65           HB2      ASP  65  22.573  -7.389   6.160
 1239   2HB   ASP  65           HB1      ASP  65  21.879  -8.163   7.585
 1240    H    GLY  66           HN       GLY  66  17.975  -7.125   6.485
 1241   1HA   GLY  66           HA2      GLY  66  17.545  -9.616   8.060
 1242   2HA   GLY  66           HA1      GLY  66  16.593  -8.146   8.252
 1243    H    GLU  67           HN       GLU  67  14.846  -9.911   7.910
 1244    HA   GLU  67           HA       GLU  67  14.298 -10.117   4.976
 1245   1HB   GLU  67           HB2      GLU  67  13.116 -12.243   5.453
 1246   2HB   GLU  67           HB1      GLU  67  14.816 -12.334   5.914
 1247   1HG   GLU  67           HG2      GLU  67  14.305 -12.056   8.229
 1248   2HG   GLU  67           HG1      GLU  67  12.647 -11.573   7.876
 1249    H    CYS  68           HN       CYS  68  12.276  -9.428   4.333
 1250    HA   CYS  68           HA       CYS  68  10.481  -8.427   6.498
 1251   1HB   CYS  68           HB2      CYS  68  10.744  -7.605   3.592
 1252   2HB   CYS  68           HB1      CYS  68   9.518  -6.978   4.692
 1253    HG   CYS  68           HG       CYS  68  11.629  -6.154   6.212
 1254    H    ASP  69           HN       ASP  69   8.072  -8.460   5.726
 1255    HA   ASP  69           HA       ASP  69   7.574 -11.160   4.534
 1256   1HB   ASP  69           HB2      ASP  69   5.687  -9.569   6.291
 1257   2HB   ASP  69           HB1      ASP  69   5.568 -11.274   5.850
 1258    H    PHE  70           HN       PHE  70   5.029 -11.058   3.753
 1259    HA   PHE  70           HA       PHE  70   5.114  -9.268   1.458
 1260   1HB   PHE  70           HB2      PHE  70   2.756 -10.266   1.093
 1261   2HB   PHE  70           HB1      PHE  70   4.128 -11.370   1.004
 1262    HD1  PHE  70           HD2      PHE  70   1.399 -10.139   3.208
 1263    HD2  PHE  70           HD1      PHE  70   4.407 -13.140   2.582
 1264    HE1  PHE  70           HE2      PHE  70   0.432 -11.494   5.046
 1265    HE2  PHE  70           HE1      PHE  70   3.440 -14.494   4.419
 1266    HZ   PHE  70           HZ       PHE  70   1.452 -13.671   5.651
 1267    H    GLN  71           HN       GLN  71   3.223  -9.464   4.463
 1268    HA   GLN  71           HA       GLN  71   1.632  -7.122   3.736
 1269   1HB   GLN  71           HB2      GLN  71   0.433  -7.510   5.697
 1270   2HB   GLN  71           HB1      GLN  71   1.012  -9.130   5.324
 1271   1HG   GLN  71           HG2      GLN  71   1.819  -9.127   7.443
 1272   2HG   GLN  71           HG1      GLN  71   3.097  -8.094   6.803
 1273   1HE2  GLN  71          HE22      GLN  71   0.777  -5.202   7.841
 1274   2HE2  GLN  71          HE21      GLN  71   1.062  -5.871   6.307
 1275    H    GLU  72           HN       GLU  72   4.608  -7.748   5.440
 1276    HA   GLU  72           HA       GLU  72   4.701  -5.149   6.757
 1277   1HB   GLU  72           HB2      GLU  72   6.575  -7.455   6.384
 1278   2HB   GLU  72           HB1      GLU  72   7.260  -5.889   6.819
 1279   1HG   GLU  72           HG2      GLU  72   5.089  -6.100   8.518
 1280   2HG   GLU  72           HG1      GLU  72   5.698  -7.754   8.452
 1281    H    PHE  73           HN       PHE  73   6.504  -6.583   4.008
 1282    HA   PHE  73           HA       PHE  73   7.783  -4.169   3.213
 1283   1HB   PHE  73           HB2      PHE  73   8.609  -6.136   2.196
 1284   2HB   PHE  73           HB1      PHE  73   6.997  -6.692   1.749
 1285    HD1  PHE  73           HD2      PHE  73   9.684  -4.259   0.956
 1286    HD2  PHE  73           HD1      PHE  73   5.917  -5.931  -0.259
 1287    HE1  PHE  73           HE2      PHE  73   9.919  -3.182  -1.268
 1288    HE2  PHE  73           HE1      PHE  73   6.153  -4.855  -2.478
 1289    HZ   PHE  73           HZ       PHE  73   8.153  -3.481  -2.983
 1290    H    MET  74           HN       MET  74   4.507  -5.169   3.040
 1291    HA   MET  74           HA       MET  74   3.750  -3.414   0.828
 1292   1HB   MET  74           HB2      MET  74   2.562  -5.563   2.130
 1293   2HB   MET  74           HB1      MET  74   1.636  -4.185   2.709
 1294   1HG   MET  74           HG2      MET  74   0.514  -4.866   0.734
 1295   2HG   MET  74           HG1      MET  74   1.470  -3.465   0.249
 1296   1HE   MET  74           HE1      MET  74   3.037  -3.231  -0.998
 1297   2HE   MET  74           HE3      MET  74   4.432  -4.304  -0.826
 1298   3HE   MET  74           HE2      MET  74   3.525  -4.268  -2.336
 1299    H    ALA  75           HN       ALA  75   2.815  -3.451   4.254
 1300    HA   ALA  75           HA       ALA  75   1.883  -0.763   4.218
 1301   1HB   ALA  75           HB3      ALA  75   1.943  -2.841   6.078
 1302   2HB   ALA  75           HB2      ALA  75   2.939  -1.585   6.815
 1303   3HB   ALA  75           HB1      ALA  75   1.276  -1.232   6.350
 1304    H    PHE  76           HN       PHE  76   5.031  -2.000   4.114
 1305    HA   PHE  76           HA       PHE  76   6.357   0.226   5.464
 1306   1HB   PHE  76           HB2      PHE  76   7.131  -2.276   4.112
 1307   2HB   PHE  76           HB1      PHE  76   8.257  -0.945   3.851
 1308    HD1  PHE  76           HD2      PHE  76   8.026   0.568   6.375
 1309    HD2  PHE  76           HD1      PHE  76   8.177  -3.671   5.686
 1310    HE1  PHE  76           HE2      PHE  76   8.949   0.230   8.653
 1311    HE2  PHE  76           HE1      PHE  76   9.100  -4.008   7.962
 1312    HZ   PHE  76           HZ       PHE  76   9.486  -2.056   9.446
 1313    H    VAL  77           HN       VAL  77   5.799  -0.805   2.105
 1314    HA   VAL  77           HA       VAL  77   7.115   1.484   0.921
 1315    HB   VAL  77           HB       VAL  77   5.059  -0.471  -0.166
 1316   1HG1  VAL  77          HG13      VAL  77   5.519   1.965  -1.249
 1317   2HG1  VAL  77          HG12      VAL  77   6.861   1.074  -1.964
 1318   3HG1  VAL  77          HG11      VAL  77   5.204   0.532  -2.228
 1319   1HG2  VAL  77          HG22      VAL  77   7.781  -0.764   0.484
 1320   2HG2  VAL  77          HG21      VAL  77   6.808  -1.857  -0.502
 1321   3HG2  VAL  77          HG23      VAL  77   7.743  -0.571  -1.268
 1322    H    SER  78           HN       SER  78   3.895   0.861   2.143
 1323    HA   SER  78           HA       SER  78   2.697   3.184   0.841
 1324   1HB   SER  78           HB2      SER  78   1.702   1.530   3.178
 1325   2HB   SER  78           HB1      SER  78   0.748   2.678   2.245
 1326    HG   SER  78           HG       SER  78   2.131   0.648   0.902
 1327    H    MET  79           HN       MET  79   3.609   2.418   4.222
 1328    HA   MET  79           HA       MET  79   2.961   4.799   5.471
 1329   1HB   MET  79           HB2      MET  79   5.397   3.043   5.821
 1330   2HB   MET  79           HB1      MET  79   5.007   4.371   6.906
 1331   1HG   MET  79           HG2      MET  79   2.667   2.736   6.469
 1332   2HG   MET  79           HG1      MET  79   4.010   1.737   7.022
 1333   1HE   MET  79           HE3      MET  79   5.027   1.619   8.739
 1334   2HE   MET  79           HE2      MET  79   5.314   2.828   9.990
 1335   3HE   MET  79           HE1      MET  79   4.028   1.642  10.199
 1336    H    VAL  80           HN       VAL  80   5.811   4.167   3.439
 1337    HA   VAL  80           HA       VAL  80   6.940   6.803   3.906
 1338    HB   VAL  80           HB       VAL  80   8.497   6.170   2.097
 1339   1HG1  VAL  80          HG13      VAL  80   7.887   4.289   4.349
 1340   2HG1  VAL  80          HG12      VAL  80   9.174   3.888   3.214
 1341   3HG1  VAL  80          HG11      VAL  80   9.258   5.381   4.149
 1342   1HG2  VAL  80          HG22      VAL  80   6.652   3.782   1.850
 1343   2HG2  VAL  80          HG21      VAL  80   7.008   4.980   0.609
 1344   3HG2  VAL  80          HG23      VAL  80   8.258   3.855   1.135
 1345    H    THR  81           HN       THR  81   5.243   5.288   1.131
 1346    HA   THR  81           HA       THR  81   5.270   7.653  -0.485
 1347    HB   THR  81           HB       THR  81   2.985   5.738  -0.696
 1348    HG1  THR  81           HG1      THR  81   5.699   5.121  -1.220
 1349   1HG2  THR  81          HG21      THR  81   4.485   7.584  -2.360
 1350   2HG2  THR  81          HG23      THR  81   4.424   5.980  -3.090
 1351   3HG2  THR  81          HG22      THR  81   2.930   6.816  -2.675
 1352    H    THR  82           HN       THR  82   3.606   6.971   2.381
 1353    HA   THR  82           HA       THR  82   1.402   8.861   1.734
 1354    HB   THR  82           HB       THR  82   0.783   8.124   4.209
 1355    HG1  THR  82           HG1      THR  82   2.570   6.937   4.674
 1356   1HG2  THR  82          HG23      THR  82   0.439   6.664   1.612
 1357   2HG2  THR  82          HG22      THR  82  -0.193   5.945   3.092
 1358   3HG2  THR  82          HG21      THR  82  -0.760   7.531   2.571
 1359    H    ALA  83           HN       ALA  83   4.170   8.410   3.887
 1360    HA   ALA  83           HA       ALA  83   3.713  10.869   5.370
 1361   1HB   ALA  83           HB3      ALA  83   5.761   8.734   5.280
 1362   2HB   ALA  83           HB2      ALA  83   6.363  10.329   5.740
 1363   3HB   ALA  83           HB1      ALA  83   5.068   9.573   6.666
 1364    H    CYS  84           HN       CYS  84   6.625  10.095   3.465
 1365    HA   CYS  84           HA       CYS  84   6.691  12.933   2.590
 1366   1HB   CYS  84           HB2      CYS  84   8.730  11.817   3.597
 1367   2HB   CYS  84           HB1      CYS  84   8.790  10.790   2.164
 1368    HG   CYS  84           HG       CYS  84   8.866  13.220   0.827
 1369    H    HIS  85           HN       HIS  85   5.018  12.787   0.963
 1370    HA   HIS  85           HA       HIS  85   6.019  11.750  -1.594
 1371   1HB   HIS  85           HB2      HIS  85   4.931   9.747  -0.779
 1372   2HB   HIS  85           HB1      HIS  85   3.501  10.665  -0.312
 1373    HD1  HIS  85           HD1      HIS  85   5.411   9.596  -3.411
 1374    HD2  HIS  85           HD2      HIS  85   1.661  11.085  -2.372
 1375    HE1  HIS  85           HE1      HIS  85   3.997   9.504  -5.511
 1376    H    GLU  86           HN       GLU  86   4.567  12.440  -3.408
 1377    HA   GLU  86           HA       GLU  86   3.472  15.114  -2.835
 1378   1HB   GLU  86           HB2      GLU  86   4.883  14.314  -4.917
 1379   2HB   GLU  86           HB1      GLU  86   3.314  13.787  -5.525
 1380   1HG   GLU  86           HG2      GLU  86   2.815  15.902  -6.101
 1381   2HG   GLU  86           HG1      GLU  86   3.016  16.412  -4.425
 1382    H    PHE  87           HN       PHE  87   1.966  13.176  -1.558
 1383    HA   PHE  87           HA       PHE  87  -0.190  12.036  -2.959
 1384   1HB   PHE  87           HB2      PHE  87   0.546  12.149  -0.345
 1385   2HB   PHE  87           HB1      PHE  87  -0.851  13.226  -0.332
 1386    HD1  PHE  87           HD1      PHE  87  -2.711  12.171  -2.213
 1387    HD2  PHE  87           HD2      PHE  87  -0.062  10.016   0.391
 1388    HE1  PHE  87           HE1      PHE  87  -4.234  10.218  -2.279
 1389    HE2  PHE  87           HE2      PHE  87  -1.588   8.060   0.323
 1390    HZ   PHE  87           HZ       PHE  87  -3.676   8.162  -1.012
 1391    H    PHE  88           HN       PHE  88   0.139  15.350  -1.672
 1392    HA   PHE  88           HA       PHE  88  -2.039  16.150  -3.521
 1393   1HB   PHE  88           HB2      PHE  88  -2.056  17.213  -0.707
 1394   2HB   PHE  88           HB1      PHE  88  -3.366  17.177  -1.887
 1395    HD1  PHE  88           HD1      PHE  88  -4.389  14.941  -2.528
 1396    HD2  PHE  88           HD2      PHE  88  -1.714  15.409   0.800
 1397    HE1  PHE  88           HE1      PHE  88  -5.178  12.782  -1.592
 1398    HE2  PHE  88           HE2      PHE  88  -2.504  13.252   1.737
 1399    HZ   PHE  88           HZ       PHE  88  -4.236  11.940   0.542
 1400    H    GLU  89           HN       GLU  89   0.728  16.628  -3.827
 1401    HA   GLU  89           HA       GLU  89   0.934  19.535  -3.153
 1402   1HB   GLU  89           HB2      GLU  89   2.756  17.505  -2.639
 1403   2HB   GLU  89           HB1      GLU  89   3.387  18.255  -4.105
 1404   1HG   GLU  89           HG2      GLU  89   2.689  20.459  -2.636
 1405   2HG   GLU  89           HG1      GLU  89   3.204  19.345  -1.369
 1406    H    HIS  90           HN       HIS  90   1.381  17.117  -5.695
 1407    HA   HIS  90           HA       HIS  90   0.548  18.946  -7.756
 1408   1HB   HIS  90           HB2      HIS  90   3.320  19.036  -7.029
 1409   2HB   HIS  90           HB1      HIS  90   3.183  18.325  -8.638
 1410    HD1  HIS  90           HD1      HIS  90   4.094  21.369  -7.733
 1411    HD2  HIS  90           HD2      HIS  90   0.571  20.193  -9.629
 1412    HE1  HIS  90           HE1      HIS  90   3.202  23.420  -8.924
 1413    H    GLU  91           HN       GLU  91  -0.133  16.299  -6.933
 1414    HA   GLU  91           HA       GLU  91  -0.695  14.279  -8.002
 1415   1HB   GLU  91           HB2      GLU  91  -0.062  16.067 -10.126
 1416   2HB   GLU  91           HB1      GLU  91   0.718  14.526 -10.485
 1417   1HG   GLU  91           HG2      GLU  91  -1.396  13.342 -10.191
 1418   2HG   GLU  91           HG1      GLU  91  -2.196  14.839  -9.711
   
  No H/Q in entry =        1418
  Start of MODEL   18
    1   1H    MET   0           HT3      MET   0   6.162   4.360 -14.750
    2   2H    MET   0           HT2      MET   0   6.332   6.048 -14.844
    3   3H    MET   0           HT1      MET   0   5.988   5.146 -16.243
    4    HA   MET   0           HA       MET   0   8.150   5.054 -16.652
    5   1HB   MET   0           HB2      MET   0   8.031   6.724 -14.333
    6   2HB   MET   0           HB1      MET   0   9.417   5.646 -14.160
    7   1HG   MET   0           HG2      MET   0   9.473   6.444 -16.844
    8   2HG   MET   0           HG1      MET   0   9.066   7.909 -15.951
    9   1HE   MET   0           HE3      MET   0  11.634   7.643 -17.635
   10   2HE   MET   0           HE2      MET   0  11.243   9.068 -16.673
   11   3HE   MET   0           HE1      MET   0  12.849   8.352 -16.562
   12    H    SER   1           HN       SER   1   7.595   3.928 -13.295
   13    HA   SER   1           HA       SER   1   9.032   1.414 -14.054
   14   1HB   SER   1           HB2      SER   1   9.708   1.280 -11.635
   15   2HB   SER   1           HB1      SER   1  10.415   2.646 -12.493
   16    HG   SER   1           HG       SER   1   7.954   2.901 -11.147
   17    H    GLU   2           HN       GLU   2   8.424  -0.275 -12.111
   18    HA   GLU   2           HA       GLU   2   5.544  -0.688 -12.428
   19   1HB   GLU   2           HB2      GLU   2   7.416  -2.274 -10.660
   20   2HB   GLU   2           HB1      GLU   2   5.918  -2.818 -11.414
   21   1HG   GLU   2           HG2      GLU   2   8.483  -2.073 -12.844
   22   2HG   GLU   2           HG1      GLU   2   7.832  -3.701 -12.646
   23    H    LEU   3           HN       LEU   3   7.757  -0.032  -9.717
   24    HA   LEU   3           HA       LEU   3   5.624   0.015  -7.749
   25   1HB   LEU   3           HB2      LEU   3   8.210  -0.383  -7.469
   26   2HB   LEU   3           HB1      LEU   3   8.262   1.371  -7.327
   27    HG   LEU   3           HG       LEU   3   6.327   1.070  -5.617
   28   1HD1  LEU   3          HD13      LEU   3   5.950  -1.325  -6.165
   29   2HD1  LEU   3          HD12      LEU   3   7.570  -1.699  -5.580
   30   3HD1  LEU   3          HD11      LEU   3   6.346  -1.096  -4.462
   31   1HD2  LEU   3          HD22      LEU   3   8.975   1.466  -5.335
   32   2HD2  LEU   3          HD21      LEU   3   7.904   1.264  -3.949
   33   3HD2  LEU   3          HD23      LEU   3   8.848  -0.102  -4.537
   34    H    GLU   4           HN       GLU   4   7.573   2.568  -9.323
   35    HA   GLU   4           HA       GLU   4   6.262   4.731  -7.983
   36   1HB   GLU   4           HB2      GLU   4   8.392   5.047  -9.148
   37   2HB   GLU   4           HB1      GLU   4   7.621   4.686 -10.693
   38   1HG   GLU   4           HG2      GLU   4   5.983   6.657  -9.746
   39   2HG   GLU   4           HG1      GLU   4   7.540   7.162  -9.087
   40    H    LYS   5           HN       LYS   5   5.658   3.346 -11.237
   41    HA   LYS   5           HA       LYS   5   3.411   5.082 -11.754
   42   1HB   LYS   5           HB2      LYS   5   4.874   3.596 -13.379
   43   2HB   LYS   5           HB1      LYS   5   3.640   2.383 -13.039
   44   1HG   LYS   5           HG2      LYS   5   2.936   3.616 -14.998
   45   2HG   LYS   5           HG1      LYS   5   1.896   4.098 -13.658
   46   1HD   LYS   5           HD2      LYS   5   2.602   6.238 -13.770
   47   2HD   LYS   5           HD1      LYS   5   4.295   5.741 -13.784
   48   1HE   LYS   5           HE2      LYS   5   4.426   6.164 -15.989
   49   2HE   LYS   5           HE1      LYS   5   3.103   5.041 -16.301
   50   1HZ   LYS   5           HZ1      LYS   5   2.037   7.372 -15.177
   51   2HZ   LYS   5           HZ3      LYS   5   3.070   7.836 -16.440
   52   3HZ   LYS   5           HZ2      LYS   5   1.796   6.753 -16.742
   53    H    ALA   6           HN       ALA   6   3.694   1.833 -10.346
   54    HA   ALA   6           HA       ALA   6   0.791   1.480 -10.257
   55   1HB   ALA   6           HB2      ALA   6   2.446  -0.420 -10.428
   56   2HB   ALA   6           HB1      ALA   6   2.910  -0.088  -8.759
   57   3HB   ALA   6           HB3      ALA   6   1.265  -0.603  -9.132
   58    H    MET   7           HN       MET   7   3.175   1.490  -7.587
   59    HA   MET   7           HA       MET   7   1.449   1.896  -5.460
   60   1HB   MET   7           HB2      MET   7   3.850   1.574  -5.132
   61   2HB   MET   7           HB1      MET   7   4.186   3.139  -5.876
   62   1HG   MET   7           HG2      MET   7   4.238   3.274  -3.399
   63   2HG   MET   7           HG1      MET   7   2.957   4.279  -4.081
   64   1HE   MET   7           HE1      MET   7   3.773   2.849  -1.342
   65   2HE   MET   7           HE3      MET   7   2.309   3.802  -1.056
   66   3HE   MET   7           HE2      MET   7   2.366   2.103  -0.589
   67    H    VAL   8           HN       VAL   8   3.032   4.484  -7.341
   68    HA   VAL   8           HA       VAL   8   1.628   6.621  -6.060
   69    HB   VAL   8           HB       VAL   8   2.651   6.600  -8.911
   70   1HG1  VAL   8          HG12      VAL   8   1.209   8.522  -8.136
   71   2HG1  VAL   8          HG11      VAL   8   2.422   8.852  -6.898
   72   3HG1  VAL   8          HG13      VAL   8   2.843   8.990  -8.605
   73   1HG2  VAL   8          HG23      VAL   8   4.295   5.816  -7.087
   74   2HG2  VAL   8          HG22      VAL   8   4.804   7.183  -8.079
   75   3HG2  VAL   8          HG21      VAL   8   4.184   7.458  -6.451
   76    H    ALA   9           HN       ALA   9   0.842   4.628  -8.902
   77    HA   ALA   9           HA       ALA   9  -1.406   6.059  -9.846
   78   1HB   ALA   9           HB2      ALA   9  -0.607   3.173  -9.847
   79   2HB   ALA   9           HB1      ALA   9  -2.276   3.566 -10.264
   80   3HB   ALA   9           HB3      ALA   9  -0.949   4.242 -11.209
   81    H    LEU  10           HN       LEU  10  -1.078   3.832  -7.114
   82    HA   LEU  10           HA       LEU  10  -3.807   3.569  -6.399
   83   1HB   LEU  10           HB2      LEU  10  -1.362   2.829  -5.282
   84   2HB   LEU  10           HB1      LEU  10  -2.031   3.952  -4.098
   85    HG   LEU  10           HG       LEU  10  -3.606   1.649  -5.271
   86   1HD1  LEU  10          HD12      LEU  10  -1.921   1.826  -2.763
   87   2HD1  LEU  10          HD11      LEU  10  -3.191   0.621  -2.974
   88   3HD1  LEU  10          HD13      LEU  10  -1.803   0.637  -4.060
   89   1HD2  LEU  10          HD23      LEU  10  -4.016   3.662  -3.062
   90   2HD2  LEU  10          HD22      LEU  10  -5.107   3.241  -4.382
   91   3HD2  LEU  10          HD21      LEU  10  -4.867   2.118  -3.042
   92    H    ILE  11           HN       ILE  11  -1.424   6.070  -5.486
   93    HA   ILE  11           HA       ILE  11  -3.140   7.641  -3.861
   94    HB   ILE  11           HB       ILE  11  -0.789   8.343  -5.630
   95   1HG1  ILE  11          HG12      ILE  11   0.295   8.730  -3.446
   96   2HG1  ILE  11          HG11      ILE  11  -1.217   8.345  -2.623
   97   1HG2  ILE  11          HG22      ILE  11  -2.807  10.134  -4.513
   98   2HG2  ILE  11          HG21      ILE  11  -1.194  10.489  -3.892
   99   3HG2  ILE  11          HG23      ILE  11  -1.491  10.492  -5.631
  100   1HD1  ILE  11          HD12      ILE  11   0.174   6.420  -4.502
  101   2HD1  ILE  11          HD11      ILE  11   0.448   6.431  -2.759
  102   3HD1  ILE  11          HD13      ILE  11  -1.156   6.072  -3.399
  103    H    ASP  12           HN       ASP  12  -2.820   7.371  -7.350
  104    HA   ASP  12           HA       ASP  12  -4.338   9.652  -8.125
  105   1HB   ASP  12           HB2      ASP  12  -2.984   7.865  -9.533
  106   2HB   ASP  12           HB1      ASP  12  -4.555   7.073  -9.646
  107    H    VAL  13           HN       VAL  13  -5.396   6.273  -7.554
  108    HA   VAL  13           HA       VAL  13  -8.129   6.565  -8.078
  109    HB   VAL  13           HB       VAL  13  -6.793   4.982  -5.852
  110   1HG1  VAL  13          HG11      VAL  13  -9.536   5.569  -6.237
  111   2HG1  VAL  13          HG13      VAL  13  -9.303   3.917  -6.810
  112   3HG1  VAL  13          HG12      VAL  13  -8.844   4.351  -5.163
  113   1HG2  VAL  13          HG22      VAL  13  -6.828   4.672  -8.669
  114   2HG2  VAL  13          HG21      VAL  13  -6.257   3.511  -7.468
  115   3HG2  VAL  13          HG23      VAL  13  -7.931   3.458  -8.020
  116    H    PHE  14           HN       PHE  14  -6.441   7.212  -5.000
  117    HA   PHE  14           HA       PHE  14  -8.544   8.007  -3.384
  118   1HB   PHE  14           HB2      PHE  14  -5.840   8.161  -3.172
  119   2HB   PHE  14           HB1      PHE  14  -6.237   9.869  -3.363
  120    HD1  PHE  14           HD2      PHE  14  -8.130   7.082  -1.725
  121    HD2  PHE  14           HD1      PHE  14  -6.112  10.842  -1.231
  122    HE1  PHE  14           HE2      PHE  14  -8.873   7.171   0.639
  123    HE2  PHE  14           HE1      PHE  14  -6.856  10.930   1.133
  124    HZ   PHE  14           HZ       PHE  14  -8.237   9.095   2.069
  125    H    HIS  15           HN       HIS  15  -6.716  10.288  -5.462
  126    HA   HIS  15           HA       HIS  15  -8.435  12.499  -5.128
  127   1HB   HIS  15           HB2      HIS  15  -6.324  12.799  -6.244
  128   2HB   HIS  15           HB1      HIS  15  -6.764  11.648  -7.507
  129    HD1  HIS  15           HD1      HIS  15  -8.268  12.478  -9.409
  130    HD2  HIS  15           HD2      HIS  15  -7.694  15.339  -6.430
  131    HE1  HIS  15           HE1      HIS  15  -9.195  14.654 -10.317
  132    H    GLN  16           HN       GLN  16  -8.724   9.710  -7.282
  133    HA   GLN  16           HA       GLN  16 -10.847  10.707  -8.910
  134   1HB   GLN  16           HB2      GLN  16  -9.385   8.379  -8.822
  135   2HB   GLN  16           HB1      GLN  16 -10.972   7.833  -8.279
  136   1HG   GLN  16           HG2      GLN  16 -11.448   7.719 -10.501
  137   2HG   GLN  16           HG1      GLN  16 -11.653   9.466 -10.370
  138   1HE2  GLN  16          HE22      GLN  16  -8.691  10.221 -12.173
  139   2HE2  GLN  16          HE21      GLN  16  -9.943  10.842 -11.209
  140    H    TYR  17           HN       TYR  17 -10.853   9.093  -5.754
  141    HA   TYR  17           HA       TYR  17 -13.823   9.322  -5.688
  142   1HB   TYR  17           HB2      TYR  17 -11.883   7.828  -3.892
  143   2HB   TYR  17           HB1      TYR  17 -13.631   7.871  -3.659
  144    HD1  TYR  17           HD2      TYR  17 -10.954   6.870  -6.057
  145    HD2  TYR  17           HD1      TYR  17 -15.075   6.466  -4.914
  146    HE1  TYR  17           HE2      TYR  17 -11.216   5.003  -7.671
  147    HE2  TYR  17           HE1      TYR  17 -15.336   4.598  -6.527
  148    HH   TYR  17           HH       TYR  17 -14.326   3.287  -7.999
  149    H    SER  18           HN       SER  18 -11.552  11.430  -5.184
  150    HA   SER  18           HA       SER  18 -12.710  12.404  -2.601
  151   1HB   SER  18           HB2      SER  18 -10.139  11.651  -2.826
  152   2HB   SER  18           HB1      SER  18  -9.988  13.304  -3.417
  153    HG   SER  18           HG       SER  18 -11.434  12.715  -1.067
  154    H    GLY  19           HN       GLY  19 -12.375  12.956  -5.897
  155   1HA   GLY  19           HA2      GLY  19 -12.215  15.871  -5.801
  156   2HA   GLY  19           HA1      GLY  19 -12.556  14.901  -7.234
  157    H    ARG  20           HN       ARG  20 -14.711  13.485  -5.562
  158    HA   ARG  20           HA       ARG  20 -16.929  15.081  -6.462
  159   1HB   ARG  20           HB2      ARG  20 -16.929  12.868  -4.385
  160   2HB   ARG  20           HB1      ARG  20 -18.321  13.449  -5.301
  161   1HG   ARG  20           HG2      ARG  20 -15.846  12.161  -6.491
  162   2HG   ARG  20           HG1      ARG  20 -17.413  11.377  -6.292
  163   1HD   ARG  20           HD2      ARG  20 -18.003  13.776  -7.603
  164   2HD   ARG  20           HD1      ARG  20 -16.525  13.204  -8.378
  165    HE   ARG  20           HE       ARG  20 -18.991  12.151  -9.010
  166   1HH1  ARG  20          HH11      ARG  20 -15.986  11.075  -9.367
  167   2HH1  ARG  20          HH12      ARG  20 -16.282   9.398  -9.053
  168   1HH2  ARG  20          HH21      ARG  20 -19.461   9.925  -7.777
  169   2HH2  ARG  20          HH22      ARG  20 -18.248   8.747  -8.154
  170    H    GLU  21           HN       GLU  21 -18.610  14.831  -4.072
  171    HA   GLU  21           HA       GLU  21 -18.224  17.381  -2.914
  172   1HB   GLU  21           HB2      GLU  21 -19.647  16.316  -0.983
  173   2HB   GLU  21           HB1      GLU  21 -20.364  16.494  -2.585
  174   1HG   GLU  21           HG2      GLU  21 -18.869  13.998  -2.318
  175   2HG   GLU  21           HG1      GLU  21 -20.177  14.121  -1.141
  176    H    GLY  22           HN       GLY  22 -18.251  14.911  -0.455
  177   1HA   GLY  22           HA2      GLY  22 -16.830  14.717   1.417
  178   2HA   GLY  22           HA1      GLY  22 -15.610  14.444   0.172
  179    H    ASP  23           HN       ASP  23 -13.895  15.776   0.383
  180    HA   ASP  23           HA       ASP  23 -14.378  18.635   1.048
  181   1HB   ASP  23           HB2      ASP  23 -13.827  17.604   3.193
  182   2HB   ASP  23           HB1      ASP  23 -12.414  16.819   2.485
  183    H    LYS  24           HN       LYS  24 -11.760  16.281   0.377
  184    HA   LYS  24           HA       LYS  24 -11.026  17.381  -2.130
  185   1HB   LYS  24           HB2      LYS  24 -10.466  19.290  -0.396
  186   2HB   LYS  24           HB1      LYS  24  -9.054  18.290  -0.054
  187   1HG   LYS  24           HG2      LYS  24  -8.247  18.468  -2.273
  188   2HG   LYS  24           HG1      LYS  24  -9.803  19.039  -2.881
  189   1HD   LYS  24           HD2      LYS  24  -8.740  21.073  -2.743
  190   2HD   LYS  24           HD1      LYS  24  -9.333  20.980  -1.083
  191   1HE   LYS  24           HE2      LYS  24  -7.238  20.365  -0.231
  192   2HE   LYS  24           HE1      LYS  24  -6.665  19.784  -1.793
  193   1HZ   LYS  24           HZ3      LYS  24  -7.381  22.613  -1.548
  194   2HZ   LYS  24           HZ2      LYS  24  -5.923  22.097  -0.846
  195   3HZ   LYS  24           HZ1      LYS  24  -6.193  21.877  -2.509
  196    H    HIS  25           HN       HIS  25  -9.538  16.130   0.883
  197    HA   HIS  25           HA       HIS  25  -8.361  13.937  -0.767
  198   1HB   HIS  25           HB2      HIS  25  -6.972  15.775   1.166
  199   2HB   HIS  25           HB1      HIS  25  -6.367  14.138   0.908
  200    HD1  HIS  25           HD1      HIS  25  -7.045  13.947  -2.149
  201    HD2  HIS  25           HD2      HIS  25  -5.053  17.141  -0.357
  202    HE1  HIS  25           HE1      HIS  25  -5.721  15.083  -3.984
  203    H    LYS  26           HN       LYS  26 -10.706  14.153   1.130
  204    HA   LYS  26           HA       LYS  26  -9.769  12.094   3.094
  205   1HB   LYS  26           HB2      LYS  26 -11.458  12.876   4.641
  206   2HB   LYS  26           HB1      LYS  26 -10.534  14.278   4.102
  207   1HG   LYS  26           HG2      LYS  26 -12.280  14.775   2.418
  208   2HG   LYS  26           HG1      LYS  26 -13.212  13.392   2.991
  209   1HD   LYS  26           HD2      LYS  26 -12.336  15.396   5.022
  210   2HD   LYS  26           HD1      LYS  26 -13.647  15.858   3.934
  211   1HE   LYS  26           HE2      LYS  26 -13.737  13.175   5.273
  212   2HE   LYS  26           HE1      LYS  26 -14.196  14.611   6.189
  213   1HZ   LYS  26           HZ3      LYS  26 -15.335  13.827   3.562
  214   2HZ   LYS  26           HZ2      LYS  26 -16.090  13.583   5.065
  215   3HZ   LYS  26           HZ1      LYS  26 -15.806  15.161   4.498
  216    H    LEU  27           HN       LEU  27 -10.737  10.128   2.905
  217    HA   LEU  27           HA       LEU  27 -12.921   9.854   0.919
  218   1HB   LEU  27           HB2      LEU  27 -10.685   8.342   1.383
  219   2HB   LEU  27           HB1      LEU  27 -11.901   7.439   2.286
  220    HG   LEU  27           HG       LEU  27 -13.362   7.701   0.150
  221   1HD1  LEU  27          HD11      LEU  27 -11.825   9.363  -0.908
  222   2HD1  LEU  27          HD13      LEU  27 -10.593   8.104  -1.023
  223   3HD1  LEU  27          HD12      LEU  27 -12.101   7.948  -1.925
  224   1HD2  LEU  27          HD23      LEU  27 -11.828   5.686   1.100
  225   2HD2  LEU  27          HD22      LEU  27 -12.747   5.556  -0.400
  226   3HD2  LEU  27          HD21      LEU  27 -11.030   5.950  -0.450
  227    H    LYS  28           HN       LYS  28 -14.108   7.509   1.958
  228    HA   LYS  28           HA       LYS  28 -15.160   8.328   4.619
  229   1HB   LYS  28           HB2      LYS  28 -16.578   8.534   2.110
  230   2HB   LYS  28           HB1      LYS  28 -17.365   7.343   3.145
  231   1HG   LYS  28           HG2      LYS  28 -17.900   8.896   4.766
  232   2HG   LYS  28           HG1      LYS  28 -16.504   9.911   4.402
  233   1HD   LYS  28           HD2      LYS  28 -18.231  11.201   3.517
  234   2HD   LYS  28           HD1      LYS  28 -17.741  10.270   2.100
  235   1HE   LYS  28           HE2      LYS  28 -20.145  10.147   2.240
  236   2HE   LYS  28           HE1      LYS  28 -19.508   8.571   2.714
  237   1HZ   LYS  28           HZ3      LYS  28 -20.236  10.722   4.625
  238   2HZ   LYS  28           HZ2      LYS  28 -21.255   9.428   4.210
  239   3HZ   LYS  28           HZ1      LYS  28 -19.782   9.131   5.007
  240    H    LYS  29           HN       LYS  29 -16.787   6.451   5.322
  241    HA   LYS  29           HA       LYS  29 -15.214   3.990   5.213
  242   1HB   LYS  29           HB2      LYS  29 -17.975   4.359   6.402
  243   2HB   LYS  29           HB1      LYS  29 -16.776   3.134   6.826
  244   1HG   LYS  29           HG2      LYS  29 -16.488   6.125   7.255
  245   2HG   LYS  29           HG1      LYS  29 -16.797   4.924   8.511
  246   1HD   LYS  29           HD2      LYS  29 -14.655   3.802   7.940
  247   2HD   LYS  29           HD1      LYS  29 -14.336   5.061   6.746
  248   1HE   LYS  29           HE2      LYS  29 -13.301   6.154   8.440
  249   2HE   LYS  29           HE1      LYS  29 -14.930   6.530   9.004
  250   1HZ   LYS  29           HZ2      LYS  29 -13.432   4.081   9.763
  251   2HZ   LYS  29           HZ1      LYS  29 -13.482   5.492  10.707
  252   3HZ   LYS  29           HZ3      LYS  29 -14.907   4.623  10.408
  253    H    SER  30           HN       SER  30 -18.178   5.227   3.770
  254    HA   SER  30           HA       SER  30 -18.925   2.631   2.642
  255   1HB   SER  30           HB2      SER  30 -20.811   3.964   2.972
  256   2HB   SER  30           HB1      SER  30 -19.982   5.437   2.478
  257    HG   SER  30           HG       SER  30 -21.566   4.199   0.992
  258    H    GLU  31           HN       GLU  31 -17.265   5.554   1.552
  259    HA   GLU  31           HA       GLU  31 -17.091   4.607  -1.217
  260   1HB   GLU  31           HB2      GLU  31 -17.047   7.086  -0.211
  261   2HB   GLU  31           HB1      GLU  31 -15.313   6.767  -0.150
  262   1HG   GLU  31           HG2      GLU  31 -15.466   6.051  -2.580
  263   2HG   GLU  31           HG1      GLU  31 -17.115   6.682  -2.582
  264    H    LEU  32           HN       LEU  32 -15.247   4.436   1.728
  265    HA   LEU  32           HA       LEU  32 -12.765   3.606   0.416
  266   1HB   LEU  32           HB2      LEU  32 -12.580   4.706   2.567
  267   2HB   LEU  32           HB1      LEU  32 -13.684   3.545   3.306
  268    HG   LEU  32           HG       LEU  32 -12.098   1.739   2.980
  269   1HD1  LEU  32          HD12      LEU  32 -10.412   3.832   1.573
  270   2HD1  LEU  32          HD11      LEU  32  -9.874   2.196   1.962
  271   3HD1  LEU  32          HD13      LEU  32 -11.193   2.444   0.816
  272   1HD2  LEU  32          HD22      LEU  32 -11.281   4.245   4.342
  273   2HD2  LEU  32          HD21      LEU  32 -11.435   2.611   4.990
  274   3HD2  LEU  32          HD23      LEU  32  -9.995   3.067   4.080
  275    H    LYS  33           HN       LYS  33 -15.471   2.056   2.115
  276    HA   LYS  33           HA       LYS  33 -14.415  -0.614   2.028
  277   1HB   LYS  33           HB2      LYS  33 -16.545   0.464   3.241
  278   2HB   LYS  33           HB1      LYS  33 -17.358  -0.148   1.804
  279   1HG   LYS  33           HG2      LYS  33 -15.461  -1.936   3.297
  280   2HG   LYS  33           HG1      LYS  33 -17.102  -1.710   3.903
  281   1HD   LYS  33           HD2      LYS  33 -17.987  -2.362   1.669
  282   2HD   LYS  33           HD1      LYS  33 -16.335  -2.668   1.129
  283   1HE   LYS  33           HE2      LYS  33 -16.480  -4.746   1.981
  284   2HE   LYS  33           HE1      LYS  33 -16.643  -4.042   3.589
  285   1HZ   LYS  33           HZ3      LYS  33 -19.045  -3.821   3.156
  286   2HZ   LYS  33           HZ2      LYS  33 -18.838  -4.636   1.679
  287   3HZ   LYS  33           HZ1      LYS  33 -18.521  -5.435   3.145
  288    H    GLU  34           HN       GLU  34 -16.336   1.333  -0.198
  289    HA   GLU  34           HA       GLU  34 -16.680  -0.863  -2.089
  290   1HB   GLU  34           HB2      GLU  34 -18.112   0.563  -3.183
  291   2HB   GLU  34           HB1      GLU  34 -18.040   1.442  -1.661
  292   1HG   GLU  34           HG2      GLU  34 -17.466   3.209  -2.951
  293   2HG   GLU  34           HG1      GLU  34 -15.867   2.480  -2.970
  294    H    LEU  35           HN       LEU  35 -14.444   1.757  -1.562
  295    HA   LEU  35           HA       LEU  35 -13.106   1.828  -4.062
  296   1HB   LEU  35           HB2      LEU  35 -12.728   3.024  -1.613
  297   2HB   LEU  35           HB1      LEU  35 -11.348   1.922  -1.686
  298    HG   LEU  35           HG       LEU  35 -10.784   4.110  -2.679
  299   1HD1  LEU  35          HD12      LEU  35 -10.577   1.545  -3.967
  300   2HD1  LEU  35          HD11      LEU  35 -10.731   2.796  -5.198
  301   3HD1  LEU  35          HD13      LEU  35  -9.436   2.885  -4.005
  302   1HD2  LEU  35          HD21      LEU  35 -13.401   3.742  -3.863
  303   2HD2  LEU  35          HD23      LEU  35 -12.405   5.196  -3.802
  304   3HD2  LEU  35          HD22      LEU  35 -12.198   4.040  -5.118
  305    H    ILE  36           HN       ILE  36 -12.618  -0.296  -1.249
  306    HA   ILE  36           HA       ILE  36 -10.569  -1.861  -2.629
  307    HB   ILE  36           HB       ILE  36 -11.926  -2.948  -0.215
  308   1HG1  ILE  36          HG12      ILE  36 -10.532  -0.277  -0.324
  309   2HG1  ILE  36          HG11      ILE  36 -11.986  -0.732   0.558
  310   1HG2  ILE  36          HG23      ILE  36  -9.048  -2.520  -1.069
  311   2HG2  ILE  36          HG22      ILE  36  -9.538  -3.324   0.422
  312   3HG2  ILE  36          HG21      ILE  36  -9.947  -4.034  -1.140
  313   1HD1  ILE  36          HD12      ILE  36 -10.120  -2.418   1.667
  314   2HD1  ILE  36          HD11      ILE  36  -9.162  -0.969   1.359
  315   3HD1  ILE  36          HD13      ILE  36 -10.611  -0.871   2.359
  316    H    ASN  37           HN       ASN  37 -13.756  -2.735  -1.257
  317    HA   ASN  37           HA       ASN  37 -13.987  -5.251  -2.481
  318   1HB   ASN  37           HB2      ASN  37 -15.495  -4.009  -0.727
  319   2HB   ASN  37           HB1      ASN  37 -16.410  -3.514  -2.152
  320   1HD2  ASN  37          HD22      ASN  37 -16.260  -7.529  -1.232
  321   2HD2  ASN  37          HD21      ASN  37 -14.985  -6.525  -0.736
  322    H    ASN  38           HN       ASN  38 -14.003  -2.228  -4.091
  323    HA   ASN  38           HA       ASN  38 -15.557  -3.384  -6.352
  324   1HB   ASN  38           HB2      ASN  38 -16.010  -1.029  -5.337
  325   2HB   ASN  38           HB1      ASN  38 -14.579  -0.541  -6.247
  326   1HD2  ASN  38          HD22      ASN  38 -16.168  -1.287  -9.448
  327   2HD2  ASN  38          HD21      ASN  38 -14.675  -1.487  -8.668
  328    H    GLU  39           HN       GLU  39 -12.579  -1.403  -5.938
  329    HA   GLU  39           HA       GLU  39 -11.523  -2.779  -8.376
  330   1HB   GLU  39           HB2      GLU  39 -10.579  -0.162  -7.179
  331   2HB   GLU  39           HB1      GLU  39 -10.145  -0.834  -8.751
  332   1HG   GLU  39           HG2      GLU  39 -12.619  -0.756  -9.338
  333   2HG   GLU  39           HG1      GLU  39 -12.852   0.194  -7.869
  334    H    LEU  40           HN       LEU  40 -11.370  -3.858  -5.619
  335    HA   LEU  40           HA       LEU  40  -8.476  -4.346  -5.609
  336   1HB   LEU  40           HB2      LEU  40  -9.417  -2.301  -4.009
  337   2HB   LEU  40           HB1      LEU  40  -9.434  -3.659  -2.898
  338    HG   LEU  40           HG       LEU  40  -7.279  -2.278  -3.005
  339   1HD1  LEU  40          HD11      LEU  40  -7.496  -4.554  -2.007
  340   2HD1  LEU  40          HD13      LEU  40  -7.046  -5.242  -3.568
  341   3HD1  LEU  40          HD12      LEU  40  -5.898  -4.239  -2.681
  342   1HD2  LEU  40          HD23      LEU  40  -7.396  -2.349  -5.615
  343   2HD2  LEU  40          HD22      LEU  40  -5.824  -2.517  -4.833
  344   3HD2  LEU  40          HD21      LEU  40  -6.663  -3.944  -5.438
  345    H    SER  41           HN       SER  41 -10.672  -4.859  -2.856
  346    HA   SER  41           HA       SER  41 -11.530  -6.834  -1.955
  347   1HB   SER  41           HB2      SER  41 -11.488  -7.370  -4.897
  348   2HB   SER  41           HB1      SER  41 -11.782  -8.721  -3.805
  349    HG   SER  41           HG       SER  41 -13.525  -6.991  -4.615
  350    H    HIS  42           HN       HIS  42  -8.438  -6.456  -2.849
  351    HA   HIS  42           HA       HIS  42  -6.488  -7.796  -2.749
  352   1HB   HIS  42           HB2      HIS  42  -6.333  -8.968  -0.568
  353   2HB   HIS  42           HB1      HIS  42  -6.993  -7.340  -0.393
  354    HD1  HIS  42           HD1      HIS  42  -8.092 -10.963  -0.499
  355    HD2  HIS  42           HD2      HIS  42  -9.614  -7.240   0.599
  356    HE1  HIS  42           HE1      HIS  42 -10.306 -11.406   0.645
  357    H    PHE  43           HN       PHE  43  -8.761  -9.000  -4.313
  358    HA   PHE  43           HA       PHE  43  -9.221 -11.053  -5.349
  359   1HB   PHE  43           HB2      PHE  43  -6.625 -11.953  -4.064
  360   2HB   PHE  43           HB1      PHE  43  -7.402 -12.643  -5.491
  361    HD1  PHE  43           HD2      PHE  43  -8.047 -10.705  -7.316
  362    HD2  PHE  43           HD1      PHE  43  -4.810 -10.557  -4.494
  363    HE1  PHE  43           HE2      PHE  43  -6.870  -9.067  -8.756
  364    HE2  PHE  43           HE1      PHE  43  -3.632  -8.917  -5.936
  365    HZ   PHE  43           HZ       PHE  43  -4.662  -8.174  -8.068
  366    H    LEU  44           HN       LEU  44 -10.983 -11.937  -4.337
  367    HA   LEU  44           HA       LEU  44 -10.704 -13.084  -1.625
  368   1HB   LEU  44           HB2      LEU  44 -12.782 -11.798  -2.966
  369   2HB   LEU  44           HB1      LEU  44 -13.273 -13.492  -2.961
  370    HG   LEU  44           HG       LEU  44 -12.150 -12.576  -0.398
  371   1HD1  LEU  44          HD11      LEU  44 -13.878 -10.787  -1.707
  372   2HD1  LEU  44          HD13      LEU  44 -14.901 -11.659  -0.565
  373   3HD1  LEU  44          HD12      LEU  44 -13.475 -10.796   0.010
  374   1HD2  LEU  44          HD23      LEU  44 -14.302 -14.310  -1.478
  375   2HD2  LEU  44          HD22      LEU  44 -13.209 -14.587  -0.121
  376   3HD2  LEU  44          HD21      LEU  44 -14.635 -13.570   0.088
  377    H    GLU  45           HN       GLU  45 -10.329 -15.233  -1.321
  378    HA   GLU  45           HA       GLU  45 -11.454 -17.245  -3.096
  379   1HB   GLU  45           HB2      GLU  45  -9.192 -18.207  -3.709
  380   2HB   GLU  45           HB1      GLU  45  -9.582 -16.680  -4.504
  381   1HG   GLU  45           HG2      GLU  45  -8.207 -15.437  -2.972
  382   2HG   GLU  45           HG1      GLU  45  -7.983 -16.849  -1.938
  383    H    GLU  46           HN       GLU  46  -9.145 -16.466  -0.528
  384    HA   GLU  46           HA       GLU  46 -10.162 -18.795   0.988
  385   1HB   GLU  46           HB2      GLU  46  -8.298 -19.999   0.516
  386   2HB   GLU  46           HB1      GLU  46  -7.508 -18.612  -0.225
  387   1HG   GLU  46           HG2      GLU  46  -6.583 -17.893   1.821
  388   2HG   GLU  46           HG1      GLU  46  -7.719 -18.847   2.774
  389    H    ILE  47           HN       ILE  47  -7.791 -16.115   1.102
  390    HA   ILE  47           HA       ILE  47  -7.454 -14.467   2.737
  391    HB   ILE  47           HB       ILE  47 -10.244 -15.293   3.591
  392   1HG1  ILE  47          HG12      ILE  47  -9.981 -12.738   2.242
  393   2HG1  ILE  47          HG11      ILE  47  -9.347 -14.039   1.232
  394   1HG2  ILE  47          HG21      ILE  47  -8.742 -13.984   5.234
  395   2HG2  ILE  47          HG23      ILE  47  -8.876 -12.648   4.088
  396   3HG2  ILE  47          HG22      ILE  47 -10.323 -13.294   4.862
  397   1HD1  ILE  47          HD11      ILE  47 -11.651 -15.162   2.236
  398   2HD1  ILE  47          HD13      ILE  47 -12.120 -13.473   2.035
  399   3HD1  ILE  47          HD12      ILE  47 -11.513 -14.391   0.657
  400    H    LYS  48           HN       LYS  48  -5.810 -15.360   3.984
  401    HA   LYS  48           HA       LYS  48  -6.473 -17.431   5.987
  402   1HB   LYS  48           HB2      LYS  48  -4.324 -17.353   4.533
  403   2HB   LYS  48           HB1      LYS  48  -3.781 -16.110   5.663
  404   1HG   LYS  48           HG2      LYS  48  -4.136 -17.673   7.547
  405   2HG   LYS  48           HG1      LYS  48  -4.662 -18.916   6.412
  406   1HD   LYS  48           HD2      LYS  48  -2.534 -19.475   5.929
  407   2HD   LYS  48           HD1      LYS  48  -2.121 -17.795   5.586
  408   1HE   LYS  48           HE2      LYS  48  -0.786 -18.745   7.470
  409   2HE   LYS  48           HE1      LYS  48  -1.758 -17.357   7.959
  410   1HZ   LYS  48           HZ3      LYS  48  -3.378 -19.559   8.282
  411   2HZ   LYS  48           HZ2      LYS  48  -1.865 -20.035   8.889
  412   3HZ   LYS  48           HZ1      LYS  48  -2.636 -18.652   9.507
  413    H    GLU  49           HN       GLU  49  -5.346 -14.051   5.885
  414    HA   GLU  49           HA       GLU  49  -5.319 -13.858   8.808
  415   1HB   GLU  49           HB2      GLU  49  -4.690 -12.070   6.522
  416   2HB   GLU  49           HB1      GLU  49  -5.276 -11.275   7.983
  417   1HG   GLU  49           HG2      GLU  49  -3.088 -13.353   8.086
  418   2HG   GLU  49           HG1      GLU  49  -2.735 -11.647   7.808
  419    H    GLN  50           HN       GLN  50  -7.624 -14.633   8.984
  420    HA   GLN  50           HA       GLN  50  -9.827 -13.104   7.997
  421   1HB   GLN  50           HB2      GLN  50  -9.964 -15.414   8.993
  422   2HB   GLN  50           HB1      GLN  50  -9.724 -14.687  10.582
  423   1HG   GLN  50           HG2      GLN  50 -11.768 -13.469  10.448
  424   2HG   GLN  50           HG1      GLN  50 -11.929 -13.787   8.719
  425   1HE2  GLN  50          HE22      GLN  50 -13.568 -16.867   9.200
  426   2HE2  GLN  50          HE21      GLN  50 -13.070 -15.660   8.114
  427    H    GLU  51           HN       GLU  51  -7.616 -12.570  10.628
  428    HA   GLU  51           HA       GLU  51  -9.340 -10.672  12.031
  429   1HB   GLU  51           HB2      GLU  51  -6.484 -11.575  12.283
  430   2HB   GLU  51           HB1      GLU  51  -7.007 -10.105  13.108
  431   1HG   GLU  51           HG2      GLU  51  -8.933 -12.250  13.469
  432   2HG   GLU  51           HG1      GLU  51  -7.330 -12.734  14.026
  433    H    VAL  52           HN       VAL  52  -6.949 -10.533   9.472
  434    HA   VAL  52           HA       VAL  52  -6.521  -7.666   9.666
  435    HB   VAL  52           HB       VAL  52  -6.019  -9.594   7.375
  436   1HG1  VAL  52          HG12      VAL  52  -5.624  -6.677   7.719
  437   2HG1  VAL  52          HG11      VAL  52  -4.247  -7.560   7.061
  438   3HG1  VAL  52          HG13      VAL  52  -5.807  -7.622   6.241
  439   1HG2  VAL  52          HG21      VAL  52  -4.824  -9.713   9.765
  440   2HG2  VAL  52          HG23      VAL  52  -3.925  -9.978   8.271
  441   3HG2  VAL  52          HG22      VAL  52  -3.866  -8.406   9.071
  442    H    VAL  53           HN       VAL  53  -8.506  -9.755   7.555
  443    HA   VAL  53           HA       VAL  53  -9.681  -7.436   6.217
  444    HB   VAL  53           HB       VAL  53 -10.373 -10.390   6.194
  445   1HG1  VAL  53          HG13      VAL  53 -12.055  -8.220   5.530
  446   2HG1  VAL  53          HG12      VAL  53 -11.464  -8.855   3.996
  447   3HG1  VAL  53          HG11      VAL  53 -12.301  -9.920   5.126
  448   1HG2  VAL  53          HG23      VAL  53  -8.233  -9.592   5.103
  449   2HG2  VAL  53          HG22      VAL  53  -9.369 -10.368   3.998
  450   3HG2  VAL  53          HG21      VAL  53  -9.226  -8.609   4.024
  451    H    ASP  54           HN       ASP  54 -10.469  -9.491   8.947
  452    HA   ASP  54           HA       ASP  54 -13.201  -8.474   9.158
  453   1HB   ASP  54           HB2      ASP  54 -11.462 -10.067  11.068
  454   2HB   ASP  54           HB1      ASP  54 -13.135  -9.621  11.404
  455    H    LYS  55           HN       LYS  55 -10.031  -7.513  10.207
  456    HA   LYS  55           HA       LYS  55 -11.015  -5.776  12.347
  457   1HB   LYS  55           HB2      LYS  55  -8.779  -6.670  12.577
  458   2HB   LYS  55           HB1      LYS  55  -8.318  -6.050  10.991
  459   1HG   LYS  55           HG2      LYS  55  -9.336  -3.848  12.467
  460   2HG   LYS  55           HG1      LYS  55  -8.220  -4.710  13.530
  461   1HD   LYS  55           HD2      LYS  55  -6.683  -4.771  11.401
  462   2HD   LYS  55           HD1      LYS  55  -7.684  -3.416  10.875
  463   1HE   LYS  55           HE2      LYS  55  -6.955  -2.030  12.588
  464   2HE   LYS  55           HE1      LYS  55  -6.579  -3.381  13.660
  465   1HZ   LYS  55           HZ2      LYS  55  -4.838  -3.914  11.820
  466   2HZ   LYS  55           HZ1      LYS  55  -5.000  -2.261  11.456
  467   3HZ   LYS  55           HZ3      LYS  55  -4.501  -2.743  13.003
  468    H    VAL  56           HN       VAL  56  -9.636  -5.255   9.072
  469    HA   VAL  56           HA       VAL  56 -10.178  -2.410   9.141
  470    HB   VAL  56           HB       VAL  56  -9.677  -2.524   6.719
  471   1HG1  VAL  56          HG13      VAL  56  -7.955  -3.672   8.828
  472   2HG1  VAL  56          HG12      VAL  56  -7.446  -4.030   7.178
  473   3HG1  VAL  56          HG11      VAL  56  -7.627  -2.355   7.701
  474   1HG2  VAL  56          HG22      VAL  56  -9.949  -5.471   7.262
  475   2HG2  VAL  56          HG21      VAL  56 -10.630  -4.521   5.941
  476   3HG2  VAL  56          HG23      VAL  56  -8.908  -4.905   5.957
  477    H    MET  57           HN       MET  57 -11.762  -5.214   7.656
  478    HA   MET  57           HA       MET  57 -13.957  -3.787   6.487
  479   1HB   MET  57           HB2      MET  57 -13.269  -6.190   6.020
  480   2HB   MET  57           HB1      MET  57 -13.994  -6.617   7.571
  481   1HG   MET  57           HG2      MET  57 -15.999  -6.741   6.565
  482   2HG   MET  57           HG1      MET  57 -15.892  -5.019   6.199
  483   1HE   MET  57           HE1      MET  57 -13.989  -4.326   4.605
  484   2HE   MET  57           HE3      MET  57 -12.933  -5.678   4.174
  485   3HE   MET  57           HE2      MET  57 -13.924  -4.901   2.939
  486    H    GLU  58           HN       GLU  58 -13.230  -4.757   9.756
  487    HA   GLU  58           HA       GLU  58 -15.960  -4.645  10.739
  488   1HB   GLU  58           HB2      GLU  58 -13.257  -4.900  11.911
  489   2HB   GLU  58           HB1      GLU  58 -14.424  -4.065  12.934
  490   1HG   GLU  58           HG2      GLU  58 -15.987  -5.931  12.747
  491   2HG   GLU  58           HG1      GLU  58 -14.900  -6.764  11.634
  492    H    THR  59           HN       THR  59 -13.216  -2.329  10.958
  493    HA   THR  59           HA       THR  59 -14.778  -0.229  12.133
  494    HB   THR  59           HB       THR  59 -12.375   0.087  10.307
  495    HG1  THR  59           HG1      THR  59 -12.395  -0.147  13.125
  496   1HG2  THR  59          HG22      THR  59 -13.543   1.808  12.513
  497   2HG2  THR  59          HG21      THR  59 -12.017   2.130  11.690
  498   3HG2  THR  59          HG23      THR  59 -13.533   2.182  10.789
  499    H    LEU  60           HN       LEU  60 -14.378  -1.389   8.885
  500    HA   LEU  60           HA       LEU  60 -15.414   0.891   7.476
  501   1HB   LEU  60           HB2      LEU  60 -14.881  -1.982   6.912
  502   2HB   LEU  60           HB1      LEU  60 -16.033  -1.178   5.849
  503    HG   LEU  60           HG       LEU  60 -13.319  -0.023   6.509
  504   1HD1  LEU  60          HD12      LEU  60 -14.111  -2.150   4.617
  505   2HD1  LEU  60          HD11      LEU  60 -13.155  -0.849   3.907
  506   3HD1  LEU  60          HD13      LEU  60 -12.521  -1.765   5.275
  507   1HD2  LEU  60          HD22      LEU  60 -15.614   1.030   5.268
  508   2HD2  LEU  60          HD21      LEU  60 -13.992   1.721   5.236
  509   3HD2  LEU  60          HD23      LEU  60 -14.517   0.642   3.944
  510    H    ASP  61           HN       ASP  61 -16.957  -2.179   8.442
  511    HA   ASP  61           HA       ASP  61 -19.617  -1.199   7.745
  512   1HB   ASP  61           HB2      ASP  61 -18.410  -3.715   8.199
  513   2HB   ASP  61           HB1      ASP  61 -19.638  -3.532   9.452
  514    H    GLU  62           HN       GLU  62 -17.586  -0.755  10.396
  515    HA   GLU  62           HA       GLU  62 -19.654  -0.775  12.460
  516   1HB   GLU  62           HB2      GLU  62 -17.171  -1.209  12.851
  517   2HB   GLU  62           HB1      GLU  62 -16.931   0.525  12.632
  518   1HG   GLU  62           HG2      GLU  62 -17.216   0.408  14.939
  519   2HG   GLU  62           HG1      GLU  62 -18.872   0.711  14.411
  520    H    ASP  63           HN       ASP  63 -17.816   1.735  10.729
  521    HA   ASP  63           HA       ASP  63 -19.495   3.841  11.915
  522   1HB   ASP  63           HB2      ASP  63 -17.093   3.785  10.118
  523   2HB   ASP  63           HB1      ASP  63 -18.072   5.250  10.216
  524    H    GLY  64           HN       GLY  64 -18.587   3.248   8.518
  525   1HA   GLY  64           HA2      GLY  64 -20.054   2.988   6.650
  526   2HA   GLY  64           HA1      GLY  64 -21.427   3.246   7.728
  527    H    ASP  65           HN       ASP  65 -20.666   5.671   8.916
  528    HA   ASP  65           HA       ASP  65 -20.651   7.512   6.557
  529   1HB   ASP  65           HB2      ASP  65 -22.810   7.297   7.970
  530   2HB   ASP  65           HB1      ASP  65 -21.915   8.165   9.219
  531    H    GLY  66           HN       GLY  66 -18.297   6.584   7.977
  532   1HA   GLY  66           HA2      GLY  66 -17.510   8.966   9.564
  533   2HA   GLY  66           HA1      GLY  66 -16.644   7.431   9.543
  534    H    GLU  67           HN       GLU  67 -15.192   9.728   9.141
  535    HA   GLU  67           HA       GLU  67 -14.748   9.815   6.186
  536   1HB   GLU  67           HB2      GLU  67 -13.502  11.936   6.679
  537   2HB   GLU  67           HB1      GLU  67 -15.205  12.014   7.135
  538   1HG   GLU  67           HG2      GLU  67 -14.613  12.489   9.251
  539   2HG   GLU  67           HG1      GLU  67 -13.768  10.943   9.355
  540    H    CYS  68           HN       CYS  68 -12.874   8.929   5.420
  541    HA   CYS  68           HA       CYS  68 -10.928   7.899   7.407
  542   1HB   CYS  68           HB2      CYS  68 -10.738   7.468   4.432
  543   2HB   CYS  68           HB1      CYS  68 -10.192   6.416   5.740
  544    HG   CYS  68           HG       CYS  68 -12.378   5.281   5.554
  545    H    ASP  69           HN       ASP  69  -8.539   8.138   6.734
  546    HA   ASP  69           HA       ASP  69  -8.140  10.933   5.740
  547   1HB   ASP  69           HB2      ASP  69  -6.425   9.251   7.598
  548   2HB   ASP  69           HB1      ASP  69  -6.009  10.871   7.035
  549    H    PHE  70           HN       PHE  70  -5.337  10.690   5.327
  550    HA   PHE  70           HA       PHE  70  -5.385   9.182   2.789
  551   1HB   PHE  70           HB2      PHE  70  -2.828  10.420   3.500
  552   2HB   PHE  70           HB1      PHE  70  -3.828  10.662   2.070
  553    HD1  PHE  70           HD2      PHE  70  -5.802  12.243   2.190
  554    HD2  PHE  70           HD1      PHE  70  -2.862  11.967   5.312
  555    HE1  PHE  70           HE2      PHE  70  -6.547  14.434   3.084
  556    HE2  PHE  70           HE1      PHE  70  -3.606  14.160   6.205
  557    HZ   PHE  70           HZ       PHE  70  -5.449  15.392   5.092
  558    H    GLN  71           HN       GLN  71  -3.544   9.238   5.837
  559    HA   GLN  71           HA       GLN  71  -1.872   6.987   5.122
  560   1HB   GLN  71           HB2      GLN  71  -2.385   8.632   7.539
  561   2HB   GLN  71           HB1      GLN  71  -1.823   6.986   7.841
  562   1HG   GLN  71           HG2      GLN  71  -0.253   7.967   5.711
  563   2HG   GLN  71           HG1      GLN  71  -0.319   9.264   6.904
  564   1HE2  GLN  71          HE22      GLN  71   2.107   6.198   7.628
  565   2HE2  GLN  71          HE21      GLN  71   1.500   6.606   6.095
  566    H    GLU  72           HN       GLU  72  -5.087   7.319   6.388
  567    HA   GLU  72           HA       GLU  72  -5.192   4.629   7.504
  568   1HB   GLU  72           HB2      GLU  72  -7.053   6.914   7.154
  569   2HB   GLU  72           HB1      GLU  72  -7.802   5.318   7.174
  570   1HG   GLU  72           HG2      GLU  72  -5.811   5.431   9.240
  571   2HG   GLU  72           HG1      GLU  72  -6.874   6.831   9.393
  572    H    PHE  73           HN       PHE  73  -6.672   6.165   4.617
  573    HA   PHE  73           HA       PHE  73  -7.664   3.696   3.546
  574   1HB   PHE  73           HB2      PHE  73  -8.694   5.436   2.451
  575   2HB   PHE  73           HB1      PHE  73  -7.289   6.486   2.584
  576    HD1  PHE  73           HD1      PHE  73  -8.781   3.675   0.659
  577    HD2  PHE  73           HD2      PHE  73  -5.662   6.621   0.835
  578    HE1  PHE  73           HE1      PHE  73  -8.174   3.174  -1.694
  579    HE2  PHE  73           HE2      PHE  73  -5.056   6.121  -1.516
  580    HZ   PHE  73           HZ       PHE  73  -6.310   4.397  -2.781
  581    H    MET  74           HN       MET  74  -4.492   5.097   3.639
  582    HA   MET  74           HA       MET  74  -3.462   3.542   1.382
  583   1HB   MET  74           HB2      MET  74  -2.540   5.692   3.004
  584   2HB   MET  74           HB1      MET  74  -1.395   4.370   3.203
  585   1HG   MET  74           HG2      MET  74  -0.862   5.919   1.280
  586   2HG   MET  74           HG1      MET  74  -1.023   4.222   0.828
  587   1HE   MET  74           HE1      MET  74  -2.281   3.233  -0.333
  588   2HE   MET  74           HE3      MET  74  -3.946   3.570  -0.827
  589   3HE   MET  74           HE2      MET  74  -2.602   4.058  -1.857
  590    H    ALA  75           HN       ALA  75  -3.003   3.432   4.918
  591    HA   ALA  75           HA       ALA  75  -1.598   0.905   4.790
  592   1HB   ALA  75           HB1      ALA  75  -1.473   2.619   6.679
  593   2HB   ALA  75           HB3      ALA  75  -3.050   2.028   7.201
  594   3HB   ALA  75           HB2      ALA  75  -1.660   0.940   7.187
  595    H    PHE  76           HN       PHE  76  -4.892   1.783   4.582
  596    HA   PHE  76           HA       PHE  76  -5.957  -0.736   5.632
  597   1HB   PHE  76           HB2      PHE  76  -7.035   1.803   4.642
  598   2HB   PHE  76           HB1      PHE  76  -7.952   0.412   4.075
  599    HD1  PHE  76           HD1      PHE  76  -6.419   1.829   7.186
  600    HD2  PHE  76           HD2      PHE  76  -9.529  -0.596   5.486
  601    HE1  PHE  76           HE1      PHE  76  -7.462   1.598   9.425
  602    HE2  PHE  76           HE2      PHE  76 -10.572  -0.826   7.723
  603    HZ   PHE  76           HZ       PHE  76  -9.539   0.270   9.694
  604    H    VAL  77           HN       VAL  77  -5.330   0.701   2.444
  605    HA   VAL  77           HA       VAL  77  -6.459  -1.479   0.926
  606    HB   VAL  77           HB       VAL  77  -4.331   0.555   0.195
  607   1HG1  VAL  77          HG11      VAL  77  -5.443  -1.737  -1.223
  608   2HG1  VAL  77          HG13      VAL  77  -5.742  -0.229  -2.088
  609   3HG1  VAL  77          HG12      VAL  77  -4.093  -0.695  -1.670
  610   1HG2  VAL  77          HG23      VAL  77  -6.859   1.130   0.886
  611   2HG2  VAL  77          HG22      VAL  77  -6.037   1.985  -0.418
  612   3HG2  VAL  77          HG21      VAL  77  -7.149   0.669  -0.791
  613    H    SER  78           HN       SER  78  -3.367  -0.977   2.495
  614    HA   SER  78           HA       SER  78  -2.034  -3.113   1.007
  615   1HB   SER  78           HB2      SER  78  -1.218  -1.690   3.553
  616   2HB   SER  78           HB1      SER  78  -0.188  -2.764   2.608
  617    HG   SER  78           HG       SER  78  -1.474  -0.643   1.309
  618    H    MET  79           HN       MET  79  -3.463  -2.826   4.278
  619    HA   MET  79           HA       MET  79  -2.642  -5.368   5.231
  620   1HB   MET  79           HB2      MET  79  -5.317  -4.142   5.897
  621   2HB   MET  79           HB1      MET  79  -4.264  -5.105   6.929
  622   1HG   MET  79           HG2      MET  79  -2.786  -2.831   6.027
  623   2HG   MET  79           HG1      MET  79  -4.336  -2.275   6.661
  624   1HE   MET  79           HE3      MET  79  -5.061  -2.082   8.472
  625   2HE   MET  79           HE2      MET  79  -4.972  -3.285   9.756
  626   3HE   MET  79           HE1      MET  79  -4.036  -1.800   9.886
  627    H    VAL  80           HN       VAL  80  -5.511  -4.452   3.335
  628    HA   VAL  80           HA       VAL  80  -6.623  -7.124   3.431
  629    HB   VAL  80           HB       VAL  80  -8.052  -6.156   1.491
  630   1HG1  VAL  80          HG13      VAL  80  -8.417  -6.249   4.127
  631   2HG1  VAL  80          HG12      VAL  80  -8.287  -4.496   3.970
  632   3HG1  VAL  80          HG11      VAL  80  -9.539  -5.371   3.085
  633   1HG2  VAL  80          HG21      VAL  80  -6.092  -4.176   1.598
  634   2HG2  VAL  80          HG23      VAL  80  -7.646  -4.050   0.774
  635   3HG2  VAL  80          HG22      VAL  80  -7.472  -3.451   2.424
  636    H    THR  81           HN       THR  81  -4.778  -5.320   0.934
  637    HA   THR  81           HA       THR  81  -4.968  -7.350  -1.066
  638    HB   THR  81           HB       THR  81  -2.491  -5.675  -0.787
  639    HG1  THR  81           HG1      THR  81  -5.119  -4.827  -1.020
  640   1HG2  THR  81          HG22      THR  81  -4.200  -6.766  -3.018
  641   2HG2  THR  81          HG21      THR  81  -3.092  -5.425  -3.306
  642   3HG2  THR  81          HG23      THR  81  -2.470  -6.980  -2.748
  643    H    THR  82           HN       THR  82  -3.398  -7.468   1.940
  644    HA   THR  82           HA       THR  82  -1.676  -9.712   0.960
  645    HB   THR  82           HB       THR  82  -0.507  -9.037   3.310
  646    HG1  THR  82           HG1      THR  82  -0.425  -6.704   3.241
  647   1HG2  THR  82          HG23      THR  82  -0.069  -8.025   0.506
  648   2HG2  THR  82          HG22      THR  82   1.024  -7.581   1.818
  649   3HG2  THR  82          HG21      THR  82   0.820  -9.277   1.376
  650    H    ALA  83           HN       ALA  83  -4.430  -9.038   2.648
  651    HA   ALA  83           HA       ALA  83  -4.096 -10.771   4.946
  652   1HB   ALA  83           HB3      ALA  83  -6.105  -9.012   3.908
  653   2HB   ALA  83           HB2      ALA  83  -6.845 -10.583   4.215
  654   3HB   ALA  83           HB1      ALA  83  -6.006  -9.734   5.513
  655    H    CYS  84           HN       CYS  84  -4.192 -11.505   1.708
  656    HA   CYS  84           HA       CYS  84  -5.852 -13.928   1.975
  657   1HB   CYS  84           HB2      CYS  84  -4.652 -12.394  -0.236
  658   2HB   CYS  84           HB1      CYS  84  -4.605 -14.144  -0.460
  659    HG   CYS  84           HG       CYS  84  -7.170 -14.233  -0.343
  660    H    HIS  85           HN       HIS  85  -4.881 -16.067   1.315
  661    HA   HIS  85           HA       HIS  85  -2.596 -16.679   2.922
  662   1HB   HIS  85           HB2      HIS  85  -4.262 -18.383   2.354
  663   2HB   HIS  85           HB1      HIS  85  -3.843 -18.251   0.647
  664    HD1  HIS  85           HD1      HIS  85  -1.695 -18.646   3.790
  665    HD2  HIS  85           HD2      HIS  85  -2.240 -20.417   0.055
  666    HE1  HIS  85           HE1      HIS  85   0.022 -20.503   3.620
  667    H    GLU  86           HN       GLU  86  -2.553 -17.579  -0.498
  668    HA   GLU  86           HA       GLU  86   0.267 -16.759  -0.644
  669   1HB   GLU  86           HB2      GLU  86   0.043 -17.708  -3.006
  670   2HB   GLU  86           HB1      GLU  86  -0.233 -18.851  -1.691
  671   1HG   GLU  86           HG2      GLU  86  -2.699 -17.498  -2.357
  672   2HG   GLU  86           HG1      GLU  86  -2.001 -18.227  -3.803
  673    H    PHE  87           HN       PHE  87  -2.857 -15.653  -1.743
  674    HA   PHE  87           HA       PHE  87  -3.440 -13.913  -3.256
  675   1HB   PHE  87           HB2      PHE  87  -2.929 -11.802  -2.273
  676   2HB   PHE  87           HB1      PHE  87  -3.011 -12.947  -0.936
  677    HD1  PHE  87           HD2      PHE  87  -0.822 -13.984  -0.089
  678    HD2  PHE  87           HD1      PHE  87  -0.960 -10.564  -2.686
  679    HE1  PHE  87           HE2      PHE  87   1.502 -13.403   0.555
  680    HE2  PHE  87           HE1      PHE  87   1.361  -9.982  -2.042
  681    HZ   PHE  87           HZ       PHE  87   2.592 -11.403  -0.422
  682    H    PHE  88           HN       PHE  88  -1.413 -15.460  -4.489
  683    HA   PHE  88           HA       PHE  88   0.034 -13.296  -5.944
  684   1HB   PHE  88           HB2      PHE  88   1.134 -15.849  -4.791
  685   2HB   PHE  88           HB1      PHE  88   1.873 -15.135  -6.226
  686    HD1  PHE  88           HD2      PHE  88   1.838 -12.325  -5.896
  687    HD2  PHE  88           HD1      PHE  88   2.341 -15.329  -2.864
  688    HE1  PHE  88           HE2      PHE  88   3.024 -10.683  -4.466
  689    HE2  PHE  88           HE1      PHE  88   3.527 -13.685  -1.435
  690    HZ   PHE  88           HZ       PHE  88   3.869 -11.363  -2.235
  691    H    GLU  89           HN       GLU  89  -1.231 -16.601  -5.977
  692    HA   GLU  89           HA       GLU  89  -0.915 -16.888  -8.858
  693   1HB   GLU  89           HB2      GLU  89  -1.614 -18.576  -6.668
  694   2HB   GLU  89           HB1      GLU  89  -2.937 -18.642  -7.834
  695   1HG   GLU  89           HG2      GLU  89  -1.678 -20.068  -9.045
  696   2HG   GLU  89           HG1      GLU  89  -0.609 -18.708  -9.394
  697    H    HIS  90           HN       HIS  90  -2.341 -16.249 -10.410
  698    HA   HIS  90           HA       HIS  90  -5.030 -15.295  -9.510
  699   1HB   HIS  90           HB2      HIS  90  -4.838 -13.673 -11.475
  700   2HB   HIS  90           HB1      HIS  90  -3.789 -13.337 -10.098
  701    HD1  HIS  90           HD1      HIS  90  -1.291 -14.589 -10.366
  702    HD2  HIS  90           HD2      HIS  90  -3.434 -13.748 -13.843
  703    HE1  HIS  90           HE1      HIS  90   0.381 -14.640 -12.267
  704    H    GLU  91           HN       GLU  91  -3.566 -17.712 -11.127
  705    HA   GLU  91           HA       GLU  91  -5.600 -17.800 -13.311
  706   1HB   GLU  91           HB2      GLU  91  -2.912 -18.195 -13.493
  707   2HB   GLU  91           HB1      GLU  91  -3.457 -19.850 -13.218
  708   1HG   GLU  91           HG2      GLU  91  -4.988 -18.231 -15.203
  709   2HG   GLU  91           HG1      GLU  91  -3.374 -18.765 -15.674
  710   1H    MET   0           HT3      MET   0  -6.754  -2.457 -14.860
  711   2H    MET   0           HT2      MET   0  -6.935  -4.122 -15.150
  712   3H    MET   0           HT1      MET   0  -6.655  -3.056 -16.443
  713    HA   MET   0           HA       MET   0  -8.834  -2.917 -16.736
  714   1HB   MET   0           HB2      MET   0  -8.611  -4.857 -14.646
  715   2HB   MET   0           HB1      MET   0  -9.983  -3.811 -14.278
  716   1HG   MET   0           HG2      MET   0 -10.170  -4.276 -17.034
  717   2HG   MET   0           HG1      MET   0  -9.728  -5.839 -16.344
  718   1HE   MET   0           HE3      MET   0 -12.371  -5.374 -17.861
  719   2HE   MET   0           HE2      MET   0 -11.941  -6.905 -17.099
  720   3HE   MET   0           HE1      MET   0 -13.537  -6.210 -16.826
  721    H    SER   1           HN       SER   1  -8.116  -2.209 -13.298
  722    HA   SER   1           HA       SER   1  -9.576   0.378 -13.680
  723   1HB   SER   1           HB2      SER   1 -10.135   0.216 -11.233
  724   2HB   SER   1           HB1      SER   1 -10.888  -1.037 -12.216
  725    HG   SER   1           HG       SER   1  -8.367  -1.451 -11.027
  726    H    GLU   2           HN       GLU   2  -8.868   1.819 -11.576
  727    HA   GLU   2           HA       GLU   2  -6.006   2.271 -11.976
  728   1HB   GLU   2           HB2      GLU   2  -7.786   3.628  -9.945
  729   2HB   GLU   2           HB1      GLU   2  -6.324   4.262 -10.695
  730   1HG   GLU   2           HG2      GLU   2  -8.955   3.694 -12.083
  731   2HG   GLU   2           HG1      GLU   2  -8.289   5.286 -11.721
  732    H    LEU   3           HN       LEU   3  -8.090   1.287  -9.264
  733    HA   LEU   3           HA       LEU   3  -5.867   1.005  -7.419
  734   1HB   LEU   3           HB2      LEU   3  -8.435   1.362  -6.971
  735   2HB   LEU   3           HB1      LEU   3  -8.487  -0.399  -7.040
  736    HG   LEU   3           HG       LEU   3  -6.472  -0.303  -5.399
  737   1HD1  LEU   3          HD13      LEU   3  -6.110   2.141  -5.671
  738   2HD1  LEU   3          HD12      LEU   3  -7.700   2.440  -4.969
  739   3HD1  LEU   3          HD11      LEU   3  -6.427   1.706  -3.991
  740   1HD2  LEU   3          HD22      LEU   3  -9.105  -0.734  -5.043
  741   2HD2  LEU   3          HD21      LEU   3  -7.970  -0.702  -3.695
  742   3HD2  LEU   3          HD23      LEU   3  -8.933   0.725  -4.069
  743    H    GLU   4           HN       GLU   4  -7.898  -1.342  -9.197
  744    HA   GLU   4           HA       GLU   4  -6.534  -3.650  -8.191
  745   1HB   GLU   4           HB2      GLU   4  -8.719  -3.824  -9.285
  746   2HB   GLU   4           HB1      GLU   4  -8.021  -3.277 -10.809
  747   1HG   GLU   4           HG2      GLU   4  -6.348  -5.345 -10.185
  748   2HG   GLU   4           HG1      GLU   4  -7.873  -5.930  -9.519
  749    H    LYS   5           HN       LYS   5  -6.080  -1.878 -11.278
  750    HA   LYS   5           HA       LYS   5  -3.867  -3.535 -12.106
  751   1HB   LYS   5           HB2      LYS   5  -5.399  -1.864 -13.469
  752   2HB   LYS   5           HB1      LYS   5  -4.146  -0.700 -13.042
  753   1HG   LYS   5           HG2      LYS   5  -3.541  -1.684 -15.167
  754   2HG   LYS   5           HG1      LYS   5  -2.440  -2.324 -13.945
  755   1HD   LYS   5           HD2      LYS   5  -3.159  -4.435 -14.283
  756   2HD   LYS   5           HD1      LYS   5  -4.849  -3.944 -14.157
  757   1HE   LYS   5           HE2      LYS   5  -5.086  -4.095 -16.388
  758   2HE   LYS   5           HE1      LYS   5  -3.775  -2.939 -16.624
  759   1HZ   LYS   5           HZ1      LYS   5  -2.667  -5.389 -15.842
  760   2HZ   LYS   5           HZ3      LYS   5  -3.761  -5.698 -17.102
  761   3HZ   LYS   5           HZ2      LYS   5  -2.498  -4.584 -17.330
  762    H    ALA   6           HN       ALA   6  -4.069  -0.481 -10.304
  763    HA   ALA   6           HA       ALA   6  -1.165  -0.138 -10.309
  764   1HB   ALA   6           HB2      ALA   6  -2.817   1.767 -10.171
  765   2HB   ALA   6           HB1      ALA   6  -3.202   1.234  -8.535
  766   3HB   ALA   6           HB3      ALA   6  -1.574   1.792  -8.919
  767    H    MET   7           HN       MET   7  -3.418  -0.476  -7.552
  768    HA   MET   7           HA       MET   7  -1.596  -1.134  -5.571
  769   1HB   MET   7           HB2      MET   7  -3.977  -0.858  -5.096
  770   2HB   MET   7           HB1      MET   7  -4.355  -2.323  -6.006
  771   1HG   MET   7           HG2      MET   7  -4.289  -2.756  -3.565
  772   2HG   MET   7           HG1      MET   7  -3.047  -3.669  -4.423
  773   1HE   MET   7           HE1      MET   7  -3.726  -2.587  -1.496
  774   2HE   MET   7           HE3      MET   7  -2.254  -3.564  -1.395
  775   3HE   MET   7           HE2      MET   7  -2.283  -1.936  -0.725
  776    H    VAL   8           HN       VAL   8  -3.277  -3.477  -7.676
  777    HA   VAL   8           HA       VAL   8  -1.823  -5.752  -6.731
  778    HB   VAL   8           HB       VAL   8  -2.980  -5.387  -9.507
  779   1HG1  VAL   8          HG12      VAL   8  -1.510  -7.385  -9.038
  780   2HG1  VAL   8          HG11      VAL   8  -2.664  -7.866  -7.795
  781   3HG1  VAL   8          HG13      VAL   8  -3.167  -7.797  -9.484
  782   1HG2  VAL   8          HG23      VAL   8  -4.532  -4.832  -7.526
  783   2HG2  VAL   8          HG22      VAL   8  -5.093  -6.068  -8.651
  784   3HG2  VAL   8          HG21      VAL   8  -4.398  -6.539  -7.099
  785    H    ALA   9           HN       ALA   9  -1.163  -3.427  -9.344
  786    HA   ALA   9           HA       ALA   9   1.030  -4.729 -10.558
  787   1HB   ALA   9           HB2      ALA   9   0.245  -1.865 -10.173
  788   2HB   ALA   9           HB1      ALA   9   1.891  -2.202 -10.712
  789   3HB   ALA   9           HB3      ALA   9   0.517  -2.760 -11.669
  790    H    LEU  10           HN       LEU  10   0.842  -2.851  -7.565
  791    HA   LEU  10           HA       LEU  10   3.603  -2.673  -6.952
  792   1HB   LEU  10           HB2      LEU  10   1.217  -2.078  -5.640
  793   2HB   LEU  10           HB1      LEU  10   1.938  -3.336  -4.634
  794    HG   LEU  10           HG       LEU  10   3.464  -0.904  -5.593
  795   1HD1  LEU  10          HD12      LEU  10   1.899  -1.389  -3.047
  796   2HD1  LEU  10          HD11      LEU  10   3.163  -0.165  -3.170
  797   3HD1  LEU  10          HD13      LEU  10   1.724  -0.051  -4.183
  798   1HD2  LEU  10          HD23      LEU  10   3.970  -3.171  -3.665
  799   2HD2  LEU  10          HD22      LEU  10   4.998  -2.591  -4.974
  800   3HD2  LEU  10          HD21      LEU  10   4.828  -1.640  -3.499
  801    H    ILE  11           HN       ILE  11   1.256  -5.270  -6.237
  802    HA   ILE  11           HA       ILE  11   3.040  -7.025  -4.897
  803    HB   ILE  11           HB       ILE  11   0.605  -7.510  -6.625
  804   1HG1  ILE  11          HG12      ILE  11  -0.376  -8.161  -4.457
  805   2HG1  ILE  11          HG11      ILE  11   1.175  -7.877  -3.665
  806   1HG2  ILE  11          HG22      ILE  11   2.666  -9.421  -5.830
  807   2HG2  ILE  11          HG21      ILE  11   1.084  -9.851  -5.181
  808   3HG2  ILE  11          HG23      ILE  11   1.296  -9.642  -6.920
  809   1HD1  ILE  11          HD12      ILE  11  -0.296  -5.741  -5.230
  810   2HD1  ILE  11          HD11      ILE  11  -0.487  -5.963  -3.490
  811   3HD1  ILE  11          HD13      ILE  11   1.087  -5.527  -4.156
  812    H    ASP  12           HN       ASP  12   2.556  -6.333  -8.308
  813    HA   ASP  12           HA       ASP  12   4.025  -8.500  -9.424
  814   1HB   ASP  12           HB2      ASP  12   2.614  -6.558 -10.542
  815   2HB   ASP  12           HB1      ASP  12   4.181  -5.755 -10.630
  816    H    VAL  13           HN       VAL  13   5.125  -5.215  -8.499
  817    HA   VAL  13           HA       VAL  13   7.828  -5.436  -9.183
  818    HB   VAL  13           HB       VAL  13   6.607  -4.138  -6.721
  819   1HG1  VAL  13          HG11      VAL  13   9.325  -4.670  -7.302
  820   2HG1  VAL  13          HG13      VAL  13   9.072  -2.961  -7.660
  821   3HG1  VAL  13          HG12      VAL  13   8.691  -3.593  -6.058
  822   1HG2  VAL  13          HG22      VAL  13   6.508  -3.487  -9.478
  823   2HG2  VAL  13          HG21      VAL  13   6.000  -2.480  -8.121
  824   3HG2  VAL  13          HG23      VAL  13   7.646  -2.360  -8.740
  825    H    PHE  14           HN       PHE  14   6.285  -6.455  -6.129
  826    HA   PHE  14           HA       PHE  14   8.458  -7.438  -4.721
  827   1HB   PHE  14           HB2      PHE  14   5.766  -7.620  -4.404
  828   2HB   PHE  14           HB1      PHE  14   6.148  -9.292  -4.818
  829    HD1  PHE  14           HD2      PHE  14   8.128  -6.722  -2.946
  830    HD2  PHE  14           HD1      PHE  14   6.121 -10.518  -2.817
  831    HE1  PHE  14           HE2      PHE  14   8.983  -7.097  -0.647
  832    HE2  PHE  14           HE1      PHE  14   6.975 -10.892  -0.518
  833    HZ   PHE  14           HZ       PHE  14   8.406  -9.182   0.567
  834    H    HIS  15           HN       HIS  15   6.525  -9.452  -6.973
  835    HA   HIS  15           HA       HIS  15   8.248 -11.685  -6.990
  836   1HB   HIS  15           HB2      HIS  15   6.086 -11.850  -8.035
  837   2HB   HIS  15           HB1      HIS  15   6.470 -10.553  -9.167
  838    HD1  HIS  15           HD1      HIS  15   7.879 -11.143 -11.224
  839    HD2  HIS  15           HD2      HIS  15   7.435 -14.347  -8.590
  840    HE1  HIS  15           HE1      HIS  15   8.752 -13.191 -12.432
  841    H    GLN  16           HN       GLN  16   8.445  -8.654  -8.801
  842    HA   GLN  16           HA       GLN  16  10.486  -9.442 -10.635
  843   1HB   GLN  16           HB2      GLN  16   9.039  -7.144 -10.198
  844   2HB   GLN  16           HB1      GLN  16  10.653  -6.666  -9.669
  845   1HG   GLN  16           HG2      GLN  16  11.024  -6.282 -11.880
  846   2HG   GLN  16           HG1      GLN  16  11.227  -8.033 -11.971
  847   1HE2  GLN  16          HE22      GLN  16   8.179  -8.567 -13.711
  848   2HE2  GLN  16          HE21      GLN  16   9.474  -9.299 -12.889
  849    H    TYR  17           HN       TYR  17  10.649  -8.224  -7.311
  850    HA   TYR  17           HA       TYR  17  13.617  -8.455  -7.412
  851   1HB   TYR  17           HB2      TYR  17  11.771  -7.193  -5.360
  852   2HB   TYR  17           HB1      TYR  17  13.528  -7.261  -5.216
  853    HD1  TYR  17           HD2      TYR  17  10.744  -5.980  -7.347
  854    HD2  TYR  17           HD1      TYR  17  14.916  -5.712  -6.359
  855    HE1  TYR  17           HE2      TYR  17  10.937  -3.931  -8.734
  856    HE2  TYR  17           HE1      TYR  17  15.108  -3.662  -7.745
  857    HH   TYR  17           HH       TYR  17  14.037  -2.183  -8.998
  858    H    SER  18           HN       SER  18  11.365 -10.612  -7.062
  859    HA   SER  18           HA       SER  18  12.639 -11.891  -4.674
  860   1HB   SER  18           HB2      SER  18  10.064 -11.120  -4.686
  861   2HB   SER  18           HB1      SER  18   9.878 -12.690  -5.463
  862    HG   SER  18           HG       SER  18  11.436 -12.389  -3.130
  863    H    GLY  19           HN       GLY  19  12.146 -12.040  -7.993
  864   1HA   GLY  19           HA2      GLY  19  11.978 -14.945  -8.243
  865   2HA   GLY  19           HA1      GLY  19  12.256 -13.807  -9.562
  866    H    ARG  20           HN       ARG  20  14.493 -12.601  -7.835
  867    HA   ARG  20           HA       ARG  20  16.659 -14.073  -9.024
  868   1HB   ARG  20           HB2      ARG  20  16.766 -12.129  -6.695
  869   2HB   ARG  20           HB1      ARG  20  18.112 -12.593  -7.740
  870   1HG   ARG  20           HG2      ARG  20  15.589 -11.171  -8.648
  871   2HG   ARG  20           HG1      ARG  20  17.167 -10.416  -8.428
  872   1HD   ARG  20           HD2      ARG  20  17.683 -12.637 -10.047
  873   2HD   ARG  20           HD1      ARG  20  16.173 -11.977 -10.677
  874    HE   ARG  20           HE       ARG  20  18.609 -10.852 -11.292
  875   1HH1  ARG  20          HH11      ARG  20  15.596  -9.745 -11.375
  876   2HH1  ARG  20          HH12      ARG  20  15.914  -8.118 -10.874
  877   1HH2  ARG  20          HH21      ARG  20  19.147  -8.791  -9.822
  878   2HH2  ARG  20          HH22      ARG  20  17.922  -7.578  -9.996
  879    H    GLU  21           HN       GLU  21  18.452 -14.112  -6.702
  880    HA   GLU  21           HA       GLU  21  18.110 -16.784  -5.844
  881   1HB   GLU  21           HB2      GLU  21  19.628 -15.961  -3.867
  882   2HB   GLU  21           HB1      GLU  21  20.268 -15.941  -5.511
  883   1HG   GLU  21           HG2      GLU  21  18.798 -13.498  -4.875
  884   2HG   GLU  21           HG1      GLU  21  20.160 -13.763  -3.784
  885    H    GLY  22           HN       GLY  22  18.264 -14.633  -3.108
  886   1HA   GLY  22           HA2      GLY  22  16.934 -14.670  -1.162
  887   2HA   GLY  22           HA1      GLY  22  15.658 -14.249  -2.305
  888    H    ASP  23           HN       ASP  23  13.950 -15.600  -2.178
  889    HA   ASP  23           HA       ASP  23  14.452 -18.518  -1.886
  890   1HB   ASP  23           HB2      ASP  23  14.007 -17.756   0.390
  891   2HB   ASP  23           HB1      ASP  23  12.565 -16.893  -0.151
  892    H    LYS  24           HN       LYS  24  11.816 -16.103  -2.145
  893    HA   LYS  24           HA       LYS  24  10.957 -16.892  -4.729
  894   1HB   LYS  24           HB2      LYS  24  10.472 -18.998  -3.214
  895   2HB   LYS  24           HB1      LYS  24   9.082 -18.049  -2.689
  896   1HG   LYS  24           HG2      LYS  24   8.170 -17.958  -4.872
  897   2HG   LYS  24           HG1      LYS  24   9.694 -18.446  -5.617
  898   1HD   LYS  24           HD2      LYS  24   8.630 -20.485  -5.676
  899   2HD   LYS  24           HD1      LYS  24   9.301 -20.593  -4.049
  900   1HE   LYS  24           HE2      LYS  24   7.252 -20.091  -3.030
  901   2HE   LYS  24           HE1      LYS  24   6.607 -19.323  -4.482
  902   1HZ   LYS  24           HZ3      LYS  24   7.323 -22.160  -4.615
  903   2HZ   LYS  24           HZ2      LYS  24   5.901 -21.736  -3.787
  904   3HZ   LYS  24           HZ1      LYS  24   6.094 -21.314  -5.423
  905    H    HIS  25           HN       HIS  25   9.620 -16.019  -1.521
  906    HA   HIS  25           HA       HIS  25   8.376 -13.643  -2.837
  907   1HB   HIS  25           HB2      HIS  25   7.071 -15.705  -1.077
  908   2HB   HIS  25           HB1      HIS  25   6.462 -14.049  -1.106
  909    HD1  HIS  25           HD1      HIS  25   6.994 -13.486  -4.145
  910    HD2  HIS  25           HD2      HIS  25   5.077 -16.878  -2.663
  911    HE1  HIS  25           HE1      HIS  25   5.580 -14.393  -6.041
  912    H    LYS  26           HN       LYS  26  10.808 -14.084  -1.092
  913    HA   LYS  26           HA       LYS  26   9.973 -12.281   1.149
  914   1HB   LYS  26           HB2      LYS  26  11.730 -13.242   2.508
  915   2HB   LYS  26           HB1      LYS  26  10.776 -14.570   1.847
  916   1HG   LYS  26           HG2      LYS  26  12.437 -14.857   0.036
  917   2HG   LYS  26           HG1      LYS  26  13.403 -13.552   0.728
  918   1HD   LYS  26           HD2      LYS  26  12.615 -15.790   2.541
  919   2HD   LYS  26           HD1      LYS  26  13.870 -16.113   1.344
  920   1HE   LYS  26           HE2      LYS  26  14.035 -13.613   2.993
  921   2HE   LYS  26           HE1      LYS  26  14.531 -15.149   3.706
  922   1HZ   LYS  26           HZ3      LYS  26  15.548 -14.049   1.141
  923   2HZ   LYS  26           HZ2      LYS  26  16.373 -13.990   2.626
  924   3HZ   LYS  26           HZ1      LYS  26  16.056 -15.486   1.887
  925    H    LEU  27           HN       LEU  27  10.939 -10.306   1.153
  926    HA   LEU  27           HA       LEU  27  13.027  -9.788  -0.884
  927   1HB   LEU  27           HB2      LEU  27  10.822  -8.347  -0.136
  928   2HB   LEU  27           HB1      LEU  27  12.084  -7.559   0.811
  929    HG   LEU  27           HG       LEU  27  13.439  -7.557  -1.407
  930   1HD1  LEU  27          HD11      LEU  27  11.847  -9.081  -2.585
  931   2HD1  LEU  27          HD13      LEU  27  10.617  -7.819  -2.489
  932   3HD1  LEU  27          HD12      LEU  27  12.081  -7.552  -3.435
  933   1HD2  LEU  27          HD23      LEU  27  11.962  -5.674  -0.149
  934   2HD2  LEU  27          HD22      LEU  27  12.810  -5.361  -1.665
  935   3HD2  LEU  27          HD21      LEU  27  11.089  -5.749  -1.681
  936    H    LYS  28           HN       LYS  28  14.272  -7.586   0.375
  937    HA   LYS  28           HA       LYS  28  15.447  -8.720   2.864
  938   1HB   LYS  28           HB2      LYS  28  16.743  -8.617   0.285
  939   2HB   LYS  28           HB1      LYS  28  17.583  -7.560   1.419
  940   1HG   LYS  28           HG2      LYS  28  18.188  -9.297   2.812
  941   2HG   LYS  28           HG1      LYS  28  16.771 -10.264   2.394
  942   1HD   LYS  28           HD2      LYS  28  18.449 -11.433   1.280
  943   2HD   LYS  28           HD1      LYS  28  17.897 -10.338   0.011
  944   1HE   LYS  28           HE2      LYS  28  20.305 -10.229   0.050
  945   2HE   LYS  28           HE1      LYS  28  19.698  -8.724   0.741
  946   1HZ   LYS  28           HZ3      LYS  28  20.506 -11.090   2.343
  947   2HZ   LYS  28           HZ2      LYS  28  21.510  -9.753   2.040
  948   3HZ   LYS  28           HZ1      LYS  28  20.077  -9.558   2.934
  949    H    LYS  29           HN       LYS  29  17.113  -6.940   3.711
  950    HA   LYS  29           HA       LYS  29  15.546  -4.486   3.976
  951   1HB   LYS  29           HB2      LYS  29  18.360  -4.994   4.980
  952   2HB   LYS  29           HB1      LYS  29  17.187  -3.831   5.605
  953   1HG   LYS  29           HG2      LYS  29  16.907  -6.852   5.683
  954   2HG   LYS  29           HG1      LYS  29  17.280  -5.813   7.057
  955   1HD   LYS  29           HD2      LYS  29  15.117  -4.632   6.727
  956   2HD   LYS  29           HD1      LYS  29  14.738  -5.737   5.406
  957   1HE   LYS  29           HE2      LYS  29  13.780  -7.031   7.002
  958   2HE   LYS  29           HE1      LYS  29  15.431  -7.469   7.439
  959   1HZ   LYS  29           HZ2      LYS  29  13.981  -5.133   8.558
  960   2HZ   LYS  29           HZ1      LYS  29  14.072  -6.650   9.322
  961   3HZ   LYS  29           HZ3      LYS  29  15.484  -5.747   9.064
  962    H    SER  30           HN       SER  30  18.434  -5.534   2.255
  963    HA   SER  30           HA       SER  30  19.137  -2.818   1.416
  964   1HB   SER  30           HB2      SER  30  21.032  -4.179   1.494
  965   2HB   SER  30           HB1      SER  30  20.173  -5.583   0.864
  966    HG   SER  30           HG       SER  30  21.691  -4.171  -0.534
  967    H    GLU  31           HN       GLU  31  17.416  -5.591   0.060
  968    HA   GLU  31           HA       GLU  31  17.115  -4.314  -2.563
  969   1HB   GLU  31           HB2      GLU  31  17.107  -6.897  -1.864
  970   2HB   GLU  31           HB1      GLU  31  15.380  -6.589  -1.684
  971   1HG   GLU  31           HG2      GLU  31  15.419  -5.584  -4.013
  972   2HG   GLU  31           HG1      GLU  31  17.063  -6.207  -4.169
  973    H    LEU  32           HN       LEU  32  15.411  -4.504   0.464
  974    HA   LEU  32           HA       LEU  32  12.873  -3.526  -0.621
  975   1HB   LEU  32           HB2      LEU  32  12.787  -4.880   1.389
  976   2HB   LEU  32           HB1      LEU  32  13.929  -3.814   2.210
  977    HG   LEU  32           HG       LEU  32  12.337  -1.985   2.179
  978   1HD1  LEU  32          HD12      LEU  32  10.578  -3.893   0.609
  979   2HD1  LEU  32          HD11      LEU  32  10.066  -2.319   1.218
  980   3HD1  LEU  32          HD13      LEU  32  11.328  -2.422  -0.009
  981   1HD2  LEU  32          HD22      LEU  32  11.576  -4.641   3.265
  982   2HD2  LEU  32          HD21      LEU  32  11.767  -3.097   4.098
  983   3HD2  LEU  32          HD23      LEU  32  10.283  -3.441   3.209
  984    H    LYS  33           HN       LYS  33  15.665  -2.189   1.124
  985    HA   LYS  33           HA       LYS  33  14.617   0.471   1.411
  986   1HB   LYS  33           HB2      LYS  33  16.797  -0.745   2.384
  987   2HB   LYS  33           HB1      LYS  33  17.544   0.039   0.994
  988   1HG   LYS  33           HG2      LYS  33  15.727   1.630   2.782
  989   2HG   LYS  33           HG1      LYS  33  17.395   1.334   3.277
  990   1HD   LYS  33           HD2      LYS  33  18.175   2.253   1.099
  991   2HD   LYS  33           HD1      LYS  33  16.502   2.621   0.679
  992   1HE   LYS  33           HE2      LYS  33  16.695   4.580   1.767
  993   2HE   LYS  33           HE1      LYS  33  16.932   3.685   3.270
  994   1HZ   LYS  33           HZ3      LYS  33  19.309   3.523   2.701
  995   2HZ   LYS  33           HZ2      LYS  33  19.036   4.511   1.345
  996   3HZ   LYS  33           HZ1      LYS  33  18.791   5.125   2.910
  997    H    GLU  34           HN       GLU  34  16.422  -1.189  -1.122
  998    HA   GLU  34           HA       GLU  34  16.685   1.221  -2.747
  999   1HB   GLU  34           HB2      GLU  34  18.056  -0.060  -4.071
 1000   2HB   GLU  34           HB1      GLU  34  18.054  -1.116  -2.665
 1001   1HG   GLU  34           HG2      GLU  34  17.412  -2.715  -4.131
 1002   2HG   GLU  34           HG1      GLU  34  15.817  -1.993  -3.985
 1003    H    LEU  35           HN       LEU  35  14.465  -1.448  -2.436
 1004    HA   LEU  35           HA       LEU  35  13.011  -1.216  -4.860
 1005   1HB   LEU  35           HB2      LEU  35  12.744  -2.702  -2.560
 1006   2HB   LEU  35           HB1      LEU  35  11.367  -1.600  -2.434
 1007    HG   LEU  35           HG       LEU  35  10.745  -3.651  -3.657
 1008   1HD1  LEU  35          HD12      LEU  35  10.490  -0.949  -4.614
 1009   2HD1  LEU  35          HD11      LEU  35  10.580  -2.041  -5.993
 1010   3HD1  LEU  35          HD13      LEU  35   9.343  -2.278  -4.760
 1011   1HD2  LEU  35          HD21      LEU  35  13.306  -3.139  -4.909
 1012   2HD2  LEU  35          HD23      LEU  35  12.308  -4.591  -4.976
 1013   3HD2  LEU  35          HD22      LEU  35  12.043  -3.284  -6.133
 1014    H    ILE  36           HN       ILE  36  12.666   0.550  -1.791
 1015    HA   ILE  36           HA       ILE  36  10.560   2.267  -2.874
 1016    HB   ILE  36           HB       ILE  36  12.033   3.056  -0.413
 1017   1HG1  ILE  36          HG12      ILE  36  10.625   0.416  -0.778
 1018   2HG1  ILE  36          HG11      ILE  36  12.121   0.762   0.083
 1019   1HG2  ILE  36          HG23      ILE  36   9.116   2.729  -1.177
 1020   2HG2  ILE  36          HG22      ILE  36   9.680   3.348   0.375
 1021   3HG2  ILE  36          HG21      ILE  36  10.018   4.244  -1.105
 1022   1HD1  ILE  36          HD12      ILE  36  10.317   2.297   1.473
 1023   2HD1  ILE  36          HD11      ILE  36   9.339   0.895   1.037
 1024   3HD1  ILE  36          HD13      ILE  36  10.835   0.679   1.949
 1025    H    ASN  37           HN       ASN  37  13.811   2.973  -1.558
 1026    HA   ASN  37           HA       ASN  37  13.997   5.622  -2.477
 1027   1HB   ASN  37           HB2      ASN  37  15.581   4.176  -0.959
 1028   2HB   ASN  37           HB1      ASN  37  16.424   3.860  -2.476
 1029   1HD2  ASN  37          HD22      ASN  37  16.334   7.734  -1.071
 1030   2HD2  ASN  37          HD21      ASN  37  15.081   6.673  -0.640
 1031    H    ASN  38           HN       ASN  38  13.921   2.815  -4.441
 1032    HA   ASN  38           HA       ASN  38  15.371   4.241  -6.615
 1033   1HB   ASN  38           HB2      ASN  38  15.862   1.780  -5.914
 1034   2HB   ASN  38           HB1      ASN  38  14.387   1.404  -6.810
 1035   1HD2  ASN  38          HD22      ASN  38  15.827   2.536  -9.967
 1036   2HD2  ASN  38          HD21      ASN  38  14.372   2.639  -9.100
 1037    H    GLU  39           HN       GLU  39  12.406   2.220  -6.305
 1038    HA   GLU  39           HA       GLU  39  11.243   3.880  -8.507
 1039   1HB   GLU  39           HB2      GLU  39  10.348   1.135  -7.592
 1040   2HB   GLU  39           HB1      GLU  39   9.841   1.992  -9.050
 1041   1HG   GLU  39           HG2      GLU  39  12.284   1.990  -9.757
 1042   2HG   GLU  39           HG1      GLU  39  12.583   0.870  -8.426
 1043    H    LEU  40           HN       LEU  40  11.227   4.614  -5.636
 1044    HA   LEU  40           HA       LEU  40   8.337   5.094  -5.430
 1045   1HB   LEU  40           HB2      LEU  40   9.346   2.871  -4.135
 1046   2HB   LEU  40           HB1      LEU  40   9.420   4.086  -2.870
 1047    HG   LEU  40           HG       LEU  40   7.257   2.724  -3.043
 1048   1HD1  LEU  40          HD11      LEU  40   7.532   4.861  -1.789
 1049   2HD1  LEU  40          HD13      LEU  40   7.011   5.733  -3.231
 1050   3HD1  LEU  40          HD12      LEU  40   5.901   4.628  -2.420
 1051   1HD2  LEU  40          HD23      LEU  40   7.249   3.111  -5.628
 1052   2HD2  LEU  40          HD22      LEU  40   5.718   3.181  -4.757
 1053   3HD2  LEU  40          HD21      LEU  40   6.534   4.672  -5.225
 1054    H    SER  41           HN       SER  41  10.663   5.270  -2.740
 1055    HA   SER  41           HA       SER  41  11.573   7.123  -1.649
 1056   1HB   SER  41           HB2      SER  41  11.393   8.013  -4.499
 1057   2HB   SER  41           HB1      SER  41  11.745   9.222  -3.268
 1058    HG   SER  41           HG       SER  41  13.441   7.606  -4.362
 1059    H    HIS  42           HN       HIS  42   8.440   6.853  -2.439
 1060    HA   HIS  42           HA       HIS  42   6.501   8.168  -2.085
 1061   1HB   HIS  42           HB2      HIS  42   6.457   9.065   0.228
 1062   2HB   HIS  42           HB1      HIS  42   7.117   7.429   0.174
 1063    HD1  HIS  42           HD1      HIS  42   8.225  11.040   0.455
 1064    HD2  HIS  42           HD2      HIS  42   9.782   7.213   1.022
 1065    HE1  HIS  42           HE1      HIS  42  10.492  11.343   1.540
 1066    H    PHE  43           HN       PHE  43   8.704   9.558  -3.596
 1067    HA   PHE  43           HA       PHE  43   9.122  11.721  -4.395
 1068   1HB   PHE  43           HB2      PHE  43   6.594  12.454  -2.892
 1069   2HB   PHE  43           HB1      PHE  43   7.305  13.313  -4.259
 1070    HD1  PHE  43           HD2      PHE  43   7.856  11.613  -6.333
 1071    HD2  PHE  43           HD1      PHE  43   4.756  11.117  -3.402
 1072    HE1  PHE  43           HE2      PHE  43   6.604  10.161  -7.905
 1073    HE2  PHE  43           HE1      PHE  43   3.504   9.664  -4.975
 1074    HZ   PHE  43           HZ       PHE  43   4.429   9.186  -7.225
 1075    H    LEU  44           HN       LEU  44  10.934  12.478  -3.370
 1076    HA   LEU  44           HA       LEU  44  10.789  13.286  -0.527
 1077   1HB   LEU  44           HB2      LEU  44  12.796  12.176  -2.111
 1078   2HB   LEU  44           HB1      LEU  44  13.294  13.857  -1.922
 1079    HG   LEU  44           HG       LEU  44  12.290  12.635   0.559
 1080   1HD1  LEU  44          HD11      LEU  44  13.946  11.021  -1.036
 1081   2HD1  LEU  44          HD13      LEU  44  15.026  11.749   0.154
 1082   3HD1  LEU  44          HD12      LEU  44  13.625  10.820   0.687
 1083   1HD2  LEU  44          HD23      LEU  44  14.396  14.491  -0.403
 1084   2HD2  LEU  44          HD22      LEU  44  13.369  14.599   1.027
 1085   3HD2  LEU  44          HD21      LEU  44  14.800  13.567   1.045
 1086    H    GLU  45           HN       GLU  45  10.439  15.382   0.052
 1087    HA   GLU  45           HA       GLU  45  11.485  17.597  -1.518
 1088   1HB   GLU  45           HB2      GLU  45   9.202  18.622  -1.903
 1089   2HB   GLU  45           HB1      GLU  45   9.547  17.204  -2.895
 1090   1HG   GLU  45           HG2      GLU  45   8.240  15.782  -1.461
 1091   2HG   GLU  45           HG1      GLU  45   8.072  17.058  -0.254
 1092    H    GLU  46           HN       GLU  46   9.298  16.507   1.043
 1093    HA   GLU  46           HA       GLU  46  10.397  18.637   2.780
 1094   1HB   GLU  46           HB2      GLU  46   8.518  19.885   2.545
 1095   2HB   GLU  46           HB1      GLU  46   7.687  18.599   1.679
 1096   1HG   GLU  46           HG2      GLU  46   6.857  17.634   3.665
 1097   2HG   GLU  46           HG1      GLU  46   8.041  18.468   4.671
 1098    H    ILE  47           HN       ILE  47   8.021  15.959   2.679
 1099    HA   ILE  47           HA       ILE  47   7.756  14.124   4.117
 1100    HB   ILE  47           HB       ILE  47  10.587  14.844   4.933
 1101   1HG1  ILE  47          HG12      ILE  47  10.250  12.472   3.299
 1102   2HG1  ILE  47          HG11      ILE  47   9.574  13.884   2.483
 1103   1HG2  ILE  47          HG21      ILE  47   9.159  13.343   6.474
 1104   2HG2  ILE  47          HG23      ILE  47   9.233  12.156   5.170
 1105   3HG2  ILE  47          HG22      ILE  47  10.717  12.705   5.948
 1106   1HD1  ILE  47          HD11      ILE  47  11.927  14.881   3.509
 1107   2HD1  ILE  47          HD13      ILE  47  12.379  13.230   3.082
 1108   3HD1  ILE  47          HD12      ILE  47  11.711  14.308   1.855
 1109    H    LYS  48           HN       LYS  48   6.176  14.857   5.539
 1110    HA   LYS  48           HA       LYS  48   6.943  16.669   7.744
 1111   1HB   LYS  48           HB2      LYS  48   4.727  16.764   6.393
 1112   2HB   LYS  48           HB1      LYS  48   4.233  15.393   7.389
 1113   1HG   LYS  48           HG2      LYS  48   4.683  16.715   9.430
 1114   2HG   LYS  48           HG1      LYS  48   5.161  18.088   8.430
 1115   1HD   LYS  48           HD2      LYS  48   3.015  18.699   8.118
 1116   2HD   LYS  48           HD1      LYS  48   2.578  17.072   7.594
 1117   1HE   LYS  48           HE2      LYS  48   1.338  17.784   9.640
 1118   2HE   LYS  48           HE1      LYS  48   2.326  16.348   9.912
 1119   1HZ   LYS  48           HZ3      LYS  48   3.970  18.496  10.422
 1120   2HZ   LYS  48           HZ2      LYS  48   2.488  18.894  11.153
 1121   3HZ   LYS  48           HZ1      LYS  48   3.282  17.447  11.562
 1122    H    GLU  49           HN       GLU  49   5.798  13.323   7.288
 1123    HA   GLU  49           HA       GLU  49   5.909  12.777  10.162
 1124   1HB   GLU  49           HB2      GLU  49   5.164  11.279   7.710
 1125   2HB   GLU  49           HB1      GLU  49   5.815  10.314   9.034
 1126   1HG   GLU  49           HG2      GLU  49   3.644  12.361   9.492
 1127   2HG   GLU  49           HG1      GLU  49   3.270  10.700   9.026
 1128    H    GLN  50           HN       GLN  50   8.223  13.529  10.323
 1129    HA   GLN  50           HA       GLN  50  10.370  12.134   9.056
 1130   1HB   GLN  50           HB2      GLN  50  10.563  14.307  10.316
 1131   2HB   GLN  50           HB1      GLN  50  10.397  13.390  11.815
 1132   1HG   GLN  50           HG2      GLN  50  12.426  12.203  11.439
 1133   2HG   GLN  50           HG1      GLN  50  12.507  12.728   9.757
 1134   1HE2  GLN  50          HE22      GLN  50  14.179  15.729  10.529
 1135   2HE2  GLN  50          HE21      GLN  50  13.627  14.662   9.330
 1136    H    GLU  51           HN       GLU  51   8.284  11.280  11.703
 1137    HA   GLU  51           HA       GLU  51  10.065   9.229  12.784
 1138   1HB   GLU  51           HB2      GLU  51   7.228  10.090  13.278
 1139   2HB   GLU  51           HB1      GLU  51   7.782   8.531  13.894
 1140   1HG   GLU  51           HG2      GLU  51   9.734  10.620  14.421
 1141   2HG   GLU  51           HG1      GLU  51   8.160  11.029  15.106
 1142    H    VAL  52           HN       VAL  52   7.554   9.398  10.343
 1143    HA   VAL  52           HA       VAL  52   7.124   6.529  10.208
 1144    HB   VAL  52           HB       VAL  52   6.522   8.721   8.193
 1145   1HG1  VAL  52          HG12      VAL  52   6.131   5.782   8.200
 1146   2HG1  VAL  52          HG11      VAL  52   4.727   6.737   7.718
 1147   3HG1  VAL  52          HG13      VAL  52   6.248   6.901   6.840
 1148   1HG2  VAL  52          HG21      VAL  52   5.443   8.546  10.634
 1149   2HG2  VAL  52          HG23      VAL  52   4.475   8.989   9.227
 1150   3HG2  VAL  52          HG22      VAL  52   4.447   7.331   9.833
 1151    H    VAL  53           HN       VAL  53   9.015   8.862   8.275
 1152    HA   VAL  53           HA       VAL  53  10.115   6.724   6.613
 1153    HB   VAL  53           HB       VAL  53  10.819   9.660   6.915
 1154   1HG1  VAL  53          HG13      VAL  53  12.459   7.590   5.914
 1155   2HG1  VAL  53          HG12      VAL  53  11.797   8.407   4.498
 1156   3HG1  VAL  53          HG11      VAL  53  12.691   9.326   5.708
 1157   1HG2  VAL  53          HG23      VAL  53   8.626   8.999   5.836
 1158   2HG2  VAL  53          HG22      VAL  53   9.711   9.905   4.781
 1159   3HG2  VAL  53          HG21      VAL  53   9.562   8.155   4.602
 1160    H    ASP  54           HN       ASP  54  11.041   8.433   9.531
 1161    HA   ASP  54           HA       ASP  54  13.777   7.403   9.488
 1162   1HB   ASP  54           HB2      ASP  54  12.136   8.748  11.657
 1163   2HB   ASP  54           HB1      ASP  54  13.822   8.268  11.857
 1164    H    LYS  55           HN       LYS  55  10.655   6.315  10.561
 1165    HA   LYS  55           HA       LYS  55  11.732   4.333  12.427
 1166   1HB   LYS  55           HB2      LYS  55   9.514   5.189  12.867
 1167   2HB   LYS  55           HB1      LYS  55   8.975   4.766  11.243
 1168   1HG   LYS  55           HG2      LYS  55  10.053   2.403  12.391
 1169   2HG   LYS  55           HG1      LYS  55   8.991   3.126  13.602
 1170   1HD   LYS  55           HD2      LYS  55   7.356   3.445  11.571
 1171   2HD   LYS  55           HD1      LYS  55   8.325   2.165  10.838
 1172   1HE   LYS  55           HE2      LYS  55   7.672   0.579  12.404
 1173   2HE   LYS  55           HE1      LYS  55   7.353   1.790  13.646
 1174   1HZ   LYS  55           HZ2      LYS  55   5.530   2.539  11.968
 1175   2HZ   LYS  55           HZ1      LYS  55   5.667   0.943  11.400
 1176   3HZ   LYS  55           HZ3      LYS  55   5.243   1.233  13.016
 1177    H    VAL  56           HN       VAL  56  10.197   4.212   9.182
 1178    HA   VAL  56           HA       VAL  56  10.730   1.380   8.881
 1179    HB   VAL  56           HB       VAL  56  10.114   1.787   6.516
 1180   1HG1  VAL  56          HG13      VAL  56   8.500   2.667   8.826
 1181   2HG1  VAL  56          HG12      VAL  56   7.914   3.224   7.257
 1182   3HG1  VAL  56          HG11      VAL  56   8.113   1.498   7.564
 1183   1HG2  VAL  56          HG22      VAL  56  10.424   4.647   7.399
 1184   2HG2  VAL  56          HG21      VAL  56  11.038   3.866   5.942
 1185   3HG2  VAL  56          HG23      VAL  56   9.321   4.242   6.085
 1186    H    MET  57           HN       MET  57  12.253   4.347   7.673
 1187    HA   MET  57           HA       MET  57  14.384   3.076   6.239
 1188   1HB   MET  57           HB2      MET  57  13.686   5.517   6.098
 1189   2HB   MET  57           HB1      MET  57  14.485   5.754   7.654
 1190   1HG   MET  57           HG2      MET  57  16.440   6.002   6.576
 1191   2HG   MET  57           HG1      MET  57  16.309   4.336   6.010
 1192   1HE   MET  57           HE1      MET  57  14.330   3.841   4.436
 1193   2HE   MET  57           HE3      MET  57  13.260   5.233   4.221
 1194   3HE   MET  57           HE2      MET  57  14.188   4.613   2.858
 1195    H    GLU  58           HN       GLU  58  13.818   3.640   9.631
 1196    HA   GLU  58           HA       GLU  58  16.591   3.413  10.464
 1197   1HB   GLU  58           HB2      GLU  58  13.947   3.520  11.783
 1198   2HB   GLU  58           HB1      GLU  58  15.158   2.568  12.642
 1199   1HG   GLU  58           HG2      GLU  58  16.718   4.446  12.608
 1200   2HG   GLU  58           HG1      GLU  58  15.583   5.406  11.658
 1201    H    THR  59           HN       THR  59  13.850   1.083  10.528
 1202    HA   THR  59           HA       THR  59  15.457  -1.141  11.367
 1203    HB   THR  59           HB       THR  59  12.969  -1.237   9.631
 1204    HG1  THR  59           HG1      THR  59  13.124  -1.347  12.452
 1205   1HG2  THR  59          HG22      THR  59  14.233  -3.211  11.556
 1206   2HG2  THR  59          HG21      THR  59  12.668  -3.433  10.771
 1207   3HG2  THR  59          HG23      THR  59  14.139  -3.372   9.802
 1208    H    LEU  60           HN       LEU  60  14.909   0.405   8.305
 1209    HA   LEU  60           HA       LEU  60  15.867  -1.685   6.584
 1210   1HB   LEU  60           HB2      LEU  60  15.321   1.234   6.397
 1211   2HB   LEU  60           HB1      LEU  60  16.416   0.567   5.192
 1212    HG   LEU  60           HG       LEU  60  13.732  -0.664   5.834
 1213   1HD1  LEU  60          HD12      LEU  60  14.443   1.679   4.179
 1214   2HD1  LEU  60          HD11      LEU  60  13.449   0.474   3.361
 1215   3HD1  LEU  60          HD13      LEU  60  12.884   1.214   4.859
 1216   1HD2  LEU  60          HD22      LEU  60  15.962  -1.555   4.370
 1217   2HD2  LEU  60          HD21      LEU  60  14.337  -2.239   4.330
 1218   3HD2  LEU  60          HD23      LEU  60  14.804  -1.010   3.154
 1219    H    ASP  61           HN       ASP  61  17.467   1.246   7.841
 1220    HA   ASP  61           HA       ASP  61  20.087   0.363   6.906
 1221   1HB   ASP  61           HB2      ASP  61  18.912   2.803   7.718
 1222   2HB   ASP  61           HB1      ASP  61  20.198   2.471   8.880
 1223    H    GLU  62           HN       GLU  62  18.181  -0.405   9.575
 1224    HA   GLU  62           HA       GLU  62  20.345  -0.631  11.528
 1225   1HB   GLU  62           HB2      GLU  62  17.885  -0.252  12.085
 1226   2HB   GLU  62           HB1      GLU  62  17.628  -1.948  11.670
 1227   1HG   GLU  62           HG2      GLU  62  18.024  -2.111  13.959
 1228   2HG   GLU  62           HG1      GLU  62  19.651  -2.346  13.319
 1229    H    ASP  63           HN       ASP  63  18.417  -2.915   9.595
 1230    HA   ASP  63           HA       ASP  63  20.141  -5.148  10.438
 1231   1HB   ASP  63           HB2      ASP  63  17.657  -4.877   8.775
 1232   2HB   ASP  63           HB1      ASP  63  18.634  -6.342   8.648
 1233    H    GLY  64           HN       GLY  64  19.076  -4.147   7.184
 1234   1HA   GLY  64           HA2      GLY  64  20.453  -3.660   5.294
 1235   2HA   GLY  64           HA1      GLY  64  21.875  -4.045   6.266
 1236    H    ASP  65           HN       ASP  65  21.161  -6.598   7.188
 1237    HA   ASP  65           HA       ASP  65  21.026  -8.138   4.625
 1238   1HB   ASP  65           HB2      ASP  65  23.251  -8.093   5.952
 1239   2HB   ASP  65           HB1      ASP  65  22.413  -9.108   7.127
 1240    H    GLY  66           HN       GLY  66  18.745  -7.393   6.258
 1241   1HA   GLY  66           HA2      GLY  66  18.025  -9.952   7.579
 1242   2HA   GLY  66           HA1      GLY  66  17.165  -8.426   7.784
 1243    H    GLU  67           HN       GLU  67  15.687 -10.660   7.176
 1244    HA   GLU  67           HA       GLU  67  15.103 -10.388   4.257
 1245   1HB   GLU  67           HB2      GLU  67  13.873 -12.554   4.549
 1246   2HB   GLU  67           HB1      GLU  67  15.595 -12.685   4.909
 1247   1HG   GLU  67           HG2      GLU  67  15.102 -13.415   6.978
 1248   2HG   GLU  67           HG1      GLU  67  14.270 -11.894   7.308
 1249    H    CYS  68           HN       CYS  68  13.198  -9.418   3.692
 1250    HA   CYS  68           HA       CYS  68  11.353  -8.639   5.879
 1251   1HB   CYS  68           HB2      CYS  68  11.024  -7.851   2.990
 1252   2HB   CYS  68           HB1      CYS  68  10.545  -6.967   4.438
 1253    HG   CYS  68           HG       CYS  68  12.725  -5.814   4.290
 1254    H    ASP  69           HN       ASP  69   8.934  -8.798   5.296
 1255    HA   ASP  69           HA       ASP  69   8.477 -11.453   3.989
 1256   1HB   ASP  69           HB2      ASP  69   6.858 -10.013   6.116
 1257   2HB   ASP  69           HB1      ASP  69   6.409 -11.553   5.380
 1258    H    PHE  70           HN       PHE  70   5.658 -11.166   3.740
 1259    HA   PHE  70           HA       PHE  70   5.591  -9.361   1.405
 1260   1HB   PHE  70           HB2      PHE  70   3.066 -10.680   2.079
 1261   2HB   PHE  70           HB1      PHE  70   3.997 -10.744   0.587
 1262    HD1  PHE  70           HD2      PHE  70   5.967 -12.325   0.421
 1263    HD2  PHE  70           HD1      PHE  70   3.179 -12.436   3.687
 1264    HE1  PHE  70           HE2      PHE  70   6.744 -14.608   1.008
 1265    HE2  PHE  70           HE1      PHE  70   3.955 -14.719   4.273
 1266    HZ   PHE  70           HZ       PHE  70   5.737 -15.805   2.933
 1267    H    GLN  71           HN       GLN  71   3.897  -9.789   4.506
 1268    HA   GLN  71           HA       GLN  71   2.202  -7.471   4.148
 1269   1HB   GLN  71           HB2      GLN  71   2.822  -9.397   6.321
 1270   2HB   GLN  71           HB1      GLN  71   2.282  -7.802   6.847
 1271   1HG   GLN  71           HG2      GLN  71   0.609  -8.517   4.690
 1272   2HG   GLN  71           HG1      GLN  71   0.726  -9.951   5.711
 1273   1HE2  GLN  71          HE22      GLN  71  -1.651  -6.999   6.914
 1274   2HE2  GLN  71          HE21      GLN  71  -1.117  -7.215   5.317
 1275    H    GLU  72           HN       GLU  72   5.473  -7.949   5.213
 1276    HA   GLU  72           HA       GLU  72   5.641  -5.414   6.639
 1277   1HB   GLU  72           HB2      GLU  72   7.475  -7.638   5.929
 1278   2HB   GLU  72           HB1      GLU  72   8.230  -6.055   6.106
 1279   1HG   GLU  72           HG2      GLU  72   6.338  -6.422   8.234
 1280   2HG   GLU  72           HG1      GLU  72   7.402  -7.827   8.167
 1281    H    PHE  73           HN       PHE  73   6.977  -6.586   3.522
 1282    HA   PHE  73           HA       PHE  73   7.927  -4.004   2.712
 1283   1HB   PHE  73           HB2      PHE  73   8.897  -5.596   1.368
 1284   2HB   PHE  73           HB1      PHE  73   7.495  -6.657   1.438
 1285    HD1  PHE  73           HD1      PHE  73   8.906  -3.630  -0.200
 1286    HD2  PHE  73           HD2      PHE  73   5.786  -6.580  -0.236
 1287    HE1  PHE  73           HE1      PHE  73   8.191  -2.847  -2.443
 1288    HE2  PHE  73           HE2      PHE  73   5.072  -5.800  -2.478
 1289    HZ   PHE  73           HZ       PHE  73   6.272  -3.932  -3.582
 1290    H    MET  74           HN       MET  74   4.757  -5.410   2.783
 1291    HA   MET  74           HA       MET  74   3.628  -3.594   0.782
 1292   1HB   MET  74           HB2      MET  74   2.775  -5.926   2.173
 1293   2HB   MET  74           HB1      MET  74   1.646  -4.639   2.584
 1294   1HG   MET  74           HG2      MET  74   1.016  -5.944   0.514
 1295   2HG   MET  74           HG1      MET  74   1.162  -4.205   0.265
 1296   1HE   MET  74           HE1      MET  74   2.368  -3.079  -0.825
 1297   2HE   MET  74           HE3      MET  74   4.007  -3.350  -1.435
 1298   3HE   MET  74           HE2      MET  74   2.613  -3.711  -2.451
 1299    H    ALA  75           HN       ALA  75   3.337  -3.915   4.322
 1300    HA   ALA  75           HA       ALA  75   1.939  -1.395   4.568
 1301   1HB   ALA  75           HB1      ALA  75   1.896  -3.326   6.239
 1302   2HB   ALA  75           HB3      ALA  75   3.499  -2.799   6.753
 1303   3HB   ALA  75           HB2      ALA  75   2.115  -1.721   6.938
 1304    H    PHE  76           HN       PHE  76   5.215  -2.235   4.100
 1305    HA   PHE  76           HA       PHE  76   6.340   0.140   5.397
 1306   1HB   PHE  76           HB2      PHE  76   7.359  -2.258   4.057
 1307   2HB   PHE  76           HB1      PHE  76   8.254  -0.807   3.620
 1308    HD1  PHE  76           HD1      PHE  76   6.864  -2.594   6.606
 1309    HD2  PHE  76           HD2      PHE  76   9.900   0.024   5.066
 1310    HE1  PHE  76           HE1      PHE  76   8.013  -2.636   8.804
 1311    HE2  PHE  76           HE2      PHE  76  11.050  -0.018   7.265
 1312    HZ   PHE  76           HZ       PHE  76  10.105  -1.348   9.133
 1313    H    VAL  77           HN       VAL  77   5.557  -0.901   2.091
 1314    HA   VAL  77           HA       VAL  77   6.622   1.450   0.797
 1315    HB   VAL  77           HB       VAL  77   4.452  -0.483  -0.074
 1316   1HG1  VAL  77          HG11      VAL  77   5.506   1.967  -1.254
 1317   2HG1  VAL  77          HG13      VAL  77   5.758   0.575  -2.309
 1318   3HG1  VAL  77          HG12      VAL  77   4.131   0.985  -1.762
 1319   1HG2  VAL  77          HG23      VAL  77   7.008  -1.134   0.424
 1320   2HG2  VAL  77          HG22      VAL  77   6.120  -1.825  -0.935
 1321   3HG2  VAL  77          HG21      VAL  77   7.220  -0.472  -1.198
 1322    H    SER  78           HN       SER  78   3.605   0.756   2.437
 1323    HA   SER  78           HA       SER  78   2.211   3.055   1.282
 1324   1HB   SER  78           HB2      SER  78   1.511   1.332   3.673
 1325   2HB   SER  78           HB1      SER  78   0.443   2.510   2.914
 1326    HG   SER  78           HG       SER  78   1.656   0.566   1.310
 1327    H    MET  79           HN       MET  79   3.793   2.375   4.424
 1328    HA   MET  79           HA       MET  79   3.028   4.781   5.715
 1329   1HB   MET  79           HB2      MET  79   5.727   3.487   6.102
 1330   2HB   MET  79           HB1      MET  79   4.728   4.317   7.290
 1331   1HG   MET  79           HG2      MET  79   3.200   2.166   6.191
 1332   2HG   MET  79           HG1      MET  79   4.776   1.539   6.679
 1333   1HE   MET  79           HE3      MET  79   5.585   1.129   8.417
 1334   2HE   MET  79           HE2      MET  79   5.563   2.167   9.840
 1335   3HE   MET  79           HE1      MET  79   4.627   0.674   9.833
 1336    H    VAL  80           HN       VAL  80   5.802   4.106   3.591
 1337    HA   VAL  80           HA       VAL  80   6.928   6.749   3.955
 1338    HB   VAL  80           HB       VAL  80   8.260   6.026   1.849
 1339   1HG1  VAL  80          HG13      VAL  80   8.750   5.799   4.456
 1340   2HG1  VAL  80          HG12      VAL  80   8.605   4.078   4.094
 1341   3HG1  VAL  80          HG11      VAL  80   9.815   5.055   3.263
 1342   1HG2  VAL  80          HG21      VAL  80   6.298   4.044   1.806
 1343   2HG2  VAL  80          HG23      VAL  80   7.811   4.022   0.901
 1344   3HG2  VAL  80          HG22      VAL  80   7.712   3.226   2.473
 1345    H    THR  81           HN       THR  81   4.960   5.260   1.348
 1346    HA   THR  81           HA       THR  81   5.062   7.519  -0.398
 1347    HB   THR  81           HB       THR  81   2.594   5.817  -0.208
 1348    HG1  THR  81           HG1      THR  81   5.204   5.008  -0.665
 1349   1HG2  THR  81          HG22      THR  81   4.199   7.175  -2.368
 1350   2HG2  THR  81          HG21      THR  81   3.074   5.877  -2.764
 1351   3HG2  THR  81          HG23      THR  81   2.485   7.352  -1.994
 1352    H    THR  82           HN       THR  82   3.638   7.267   2.671
 1353    HA   THR  82           HA       THR  82   1.880   9.612   2.052
 1354    HB   THR  82           HB       THR  82   0.820   8.652   4.355
 1355    HG1  THR  82           HG1      THR  82   0.725   6.347   4.008
 1356   1HG2  THR  82          HG23      THR  82   0.245   7.989   1.472
 1357   2HG2  THR  82          HG22      THR  82  -0.785   7.388   2.771
 1358   3HG2  THR  82          HG21      THR  82  -0.595   9.125   2.529
 1359    H    ALA  83           HN       ALA  83   4.708   8.741   3.514
 1360    HA   ALA  83           HA       ALA  83   4.490  10.181   6.018
 1361   1HB   ALA  83           HB3      ALA  83   6.440   8.566   4.680
 1362   2HB   ALA  83           HB2      ALA  83   7.201  10.088   5.141
 1363   3HB   ALA  83           HB1      ALA  83   6.422   9.086   6.365
 1364    H    CYS  84           HN       CYS  84   4.436  11.304   2.892
 1365    HA   CYS  84           HA       CYS  84   6.118  13.678   3.371
 1366   1HB   CYS  84           HB2      CYS  84   4.808  12.423   1.050
 1367   2HB   CYS  84           HB1      CYS  84   4.758  14.187   1.042
 1368    HG   CYS  84           HG       CYS  84   7.326  14.266   1.048
 1369    H    HIS  85           HN       HIS  85   5.125  15.881   3.022
 1370    HA   HIS  85           HA       HIS  85   2.921  16.289   4.797
 1371   1HB   HIS  85           HB2      HIS  85   4.565  18.052   4.362
 1372   2HB   HIS  85           HB1      HIS  85   4.066  18.129   2.672
 1373    HD1  HIS  85           HD1      HIS  85   2.070  18.134   5.937
 1374    HD2  HIS  85           HD2      HIS  85   2.446  20.349   2.423
 1375    HE1  HIS  85           HE1      HIS  85   0.355  19.997   6.074
 1376    H    GLU  86           HN       GLU  86   2.720  17.598   1.516
 1377    HA   GLU  86           HA       GLU  86  -0.107  16.798   1.404
 1378   1HB   GLU  86           HB2      GLU  86   0.007  18.029  -0.832
 1379   2HB   GLU  86           HB1      GLU  86   0.352  19.003   0.596
 1380   1HG   GLU  86           HG2      GLU  86   2.778  17.744  -0.345
 1381   2HG   GLU  86           HG1      GLU  86   2.013  18.642  -1.656
 1382    H    PHE  87           HN       PHE  87   2.957  15.839   0.034
 1383    HA   PHE  87           HA       PHE  87   3.460  14.296  -1.704
 1384   1HB   PHE  87           HB2      PHE  87   2.987  12.080  -0.961
 1385   2HB   PHE  87           HB1      PHE  87   3.136  13.055   0.500
 1386    HD1  PHE  87           HD2      PHE  87   0.994  13.978   1.567
 1387    HD2  PHE  87           HD1      PHE  87   0.996  10.900  -1.428
 1388    HE1  PHE  87           HE2      PHE  87  -1.298  13.320   2.244
 1389    HE2  PHE  87           HE1      PHE  87  -1.296  10.239  -0.750
 1390    HZ   PHE  87           HZ       PHE  87  -2.442  11.449   1.087
 1391    H    PHE  88           HN       PHE  88   1.383  15.979  -2.643
 1392    HA   PHE  88           HA       PHE  88  -0.141  14.006  -4.280
 1393   1HB   PHE  88           HB2      PHE  88  -1.175  16.398  -2.777
 1394   2HB   PHE  88           HB1      PHE  88  -1.983  15.862  -4.251
 1395    HD1  PHE  88           HD2      PHE  88  -1.944  13.033  -4.267
 1396    HD2  PHE  88           HD1      PHE  88  -2.290  15.646  -0.872
 1397    HE1  PHE  88           HE2      PHE  88  -3.068  11.227  -2.991
 1398    HE2  PHE  88           HE1      PHE  88  -3.415  13.838   0.402
 1399    HZ   PHE  88           HZ       PHE  88  -3.803  11.630  -0.658
 1400    H    GLU  89           HN       GLU  89   1.135  17.291  -3.971
 1401    HA   GLU  89           HA       GLU  89   0.685  17.928  -6.779
 1402   1HB   GLU  89           HB2      GLU  89   1.494  19.339  -4.437
 1403   2HB   GLU  89           HB1      GLU  89   2.759  19.548  -5.647
 1404   1HG   GLU  89           HG2      GLU  89   1.450  21.108  -6.617
 1405   2HG   GLU  89           HG1      GLU  89   0.361  19.798  -7.076
 1406    H    HIS  90           HN       HIS  90   2.032  17.484  -8.462
 1407    HA   HIS  90           HA       HIS  90   4.757  16.431  -7.812
 1408   1HB   HIS  90           HB2      HIS  90   4.465  15.061  -9.946
 1409   2HB   HIS  90           HB1      HIS  90   3.481  14.559  -8.573
 1410    HD1  HIS  90           HD1      HIS  90   0.979  15.828  -8.570
 1411    HD2  HIS  90           HD2      HIS  90   2.950  15.420 -12.221
 1412    HE1  HIS  90           HE1      HIS  90  -0.781  16.108 -10.371
 1413    H    GLU  91           HN       GLU  91   3.229  19.025  -9.053
 1414    HA   GLU  91           HA       GLU  91   5.156  19.381 -11.304
 1415   1HB   GLU  91           HB2      GLU  91   2.465  19.792 -11.310
 1416   2HB   GLU  91           HB1      GLU  91   3.029  21.402 -10.864
 1417   1HG   GLU  91           HG2      GLU  91   4.457  20.039 -13.096
 1418   2HG   GLU  91           HG1      GLU  91   2.825  20.623 -13.426
   
  No H/Q in entry =        1418
  Start of MODEL   19
    1   1H    MET   0           HT3      MET   0  10.150   6.694 -13.801
    2   2H    MET   0           HT2      MET   0  10.386   6.597 -15.482
    3   3H    MET   0           HT1      MET   0   9.348   7.775 -14.832
    4    HA   MET   0           HA       MET   0   7.748   6.185 -14.197
    5   1HB   MET   0           HB2      MET   0   7.214   5.140 -16.354
    6   2HB   MET   0           HB1      MET   0   7.788   6.788 -16.609
    7   1HG   MET   0           HG2      MET   0  10.077   5.106 -16.587
    8   2HG   MET   0           HG1      MET   0   8.885   4.341 -17.636
    9   1HE   MET   0           HE2      MET   0  10.494   4.398 -19.183
   10   2HE   MET   0           HE1      MET   0  10.291   5.508 -20.536
   11   3HE   MET   0           HE3      MET   0  11.628   5.728 -19.400
   12    H    SER   1           HN       SER   1   9.007   4.978 -12.480
   13    HA   SER   1           HA       SER   1  10.240   2.453 -13.381
   14   1HB   SER   1           HB2      SER   1  11.019   2.211 -11.171
   15   2HB   SER   1           HB1      SER   1  11.050   3.954 -11.419
   16    HG   SER   1           HG       SER   1   9.138   2.381 -10.046
   17    H    GLU   2           HN       GLU   2   9.509   0.567 -11.648
   18    HA   GLU   2           HA       GLU   2   6.741   0.018 -12.400
   19   1HB   GLU   2           HB2      GLU   2   8.801  -1.625 -12.134
   20   2HB   GLU   2           HB1      GLU   2   8.256  -1.686 -10.457
   21   1HG   GLU   2           HG2      GLU   2   6.181  -2.610 -11.028
   22   2HG   GLU   2           HG1      GLU   2   6.287  -2.054 -12.700
   23    H    LEU   3           HN       LEU   3   8.486   0.748  -9.396
   24    HA   LEU   3           HA       LEU   3   6.107   0.421  -7.739
   25   1HB   LEU   3           HB2      LEU   3   8.573   0.204  -7.012
   26   2HB   LEU   3           HB1      LEU   3   8.577   1.966  -6.967
   27    HG   LEU   3           HG       LEU   3   6.591   1.887  -5.452
   28   1HD1  LEU   3          HD12      LEU   3   6.860  -0.965  -6.102
   29   2HD1  LEU   3          HD11      LEU   3   6.681  -0.651  -4.376
   30   3HD1  LEU   3          HD13      LEU   3   5.459  -0.073  -5.508
   31   1HD2  LEU   3          HD21      LEU   3   9.298   0.872  -4.823
   32   2HD2  LEU   3          HD23      LEU   3   8.393   2.194  -4.087
   33   3HD2  LEU   3          HD22      LEU   3   8.071   0.530  -3.602
   34    H    GLU   4           HN       GLU   4   8.041   3.240  -8.756
   35    HA   GLU   4           HA       GLU   4   6.398   5.225  -7.609
   36   1HB   GLU   4           HB2      GLU   4   8.591   5.738  -8.575
   37   2HB   GLU   4           HB1      GLU   4   7.993   5.349 -10.189
   38   1HG   GLU   4           HG2      GLU   4   6.259   7.268  -8.861
   39   2HG   GLU   4           HG1      GLU   4   7.918   7.859  -8.948
   40    H    LYS   5           HN       LYS   5   6.010   3.472 -10.662
   41    HA   LYS   5           HA       LYS   5   3.781   5.164 -11.511
   42   1HB   LYS   5           HB2      LYS   5   5.480   3.591 -12.892
   43   2HB   LYS   5           HB1      LYS   5   4.146   2.457 -12.692
   44   1HG   LYS   5           HG2      LYS   5   3.504   3.534 -14.649
   45   2HG   LYS   5           HG1      LYS   5   2.686   4.530 -13.445
   46   1HD   LYS   5           HD2      LYS   5   4.173   6.290 -13.686
   47   2HD   LYS   5           HD1      LYS   5   5.493   5.239 -14.202
   48   1HE   LYS   5           HE2      LYS   5   4.378   4.880 -16.368
   49   2HE   LYS   5           HE1      LYS   5   3.039   5.906 -15.855
   50   1HZ   LYS   5           HZ1      LYS   5   4.744   7.691 -15.510
   51   2HZ   LYS   5           HZ3      LYS   5   5.856   6.696 -16.315
   52   3HZ   LYS   5           HZ2      LYS   5   4.473   7.250 -17.129
   53    H    ALA   6           HN       ALA   6   4.051   1.764 -10.389
   54    HA   ALA   6           HA       ALA   6   1.174   1.437 -10.257
   55   1HB   ALA   6           HB3      ALA   6   2.779  -0.461 -10.526
   56   2HB   ALA   6           HB2      ALA   6   3.322  -0.191  -8.871
   57   3HB   ALA   6           HB1      ALA   6   1.661  -0.691  -9.182
   58    H    MET   7           HN       MET   7   3.595   1.450  -7.624
   59    HA   MET   7           HA       MET   7   1.900   1.599  -5.443
   60   1HB   MET   7           HB2      MET   7   4.369   1.505  -5.276
   61   2HB   MET   7           HB1      MET   7   4.461   3.187  -5.801
   62   1HG   MET   7           HG2      MET   7   4.577   2.918  -3.308
   63   2HG   MET   7           HG1      MET   7   3.225   3.917  -3.839
   64   1HE   MET   7           HE3      MET   7   2.978   3.565  -1.485
   65   2HE   MET   7           HE2      MET   7   1.284   3.089  -1.395
   66   3HE   MET   7           HE1      MET   7   2.516   2.082  -0.638
   67    H    VAL   8           HN       VAL   8   3.054   4.359  -7.384
   68    HA   VAL   8           HA       VAL   8   1.496   6.291  -5.893
   69    HB   VAL   8           HB       VAL   8   2.633   6.528  -8.695
   70   1HG1  VAL   8          HG12      VAL   8   1.603   8.487  -6.640
   71   2HG1  VAL   8          HG11      VAL   8   2.710   8.985  -7.919
   72   3HG1  VAL   8          HG13      VAL   8   1.129   8.326  -8.331
   73   1HG2  VAL   8          HG23      VAL   8   4.329   5.880  -6.981
   74   2HG2  VAL   8          HG22      VAL   8   4.594   7.509  -7.601
   75   3HG2  VAL   8          HG21      VAL   8   3.853   7.276  -6.017
   76    H    ALA   9           HN       ALA   9   0.876   4.286  -8.722
   77    HA   ALA   9           HA       ALA   9  -1.399   5.668  -9.733
   78   1HB   ALA   9           HB3      ALA   9  -0.535   2.781  -9.795
   79   2HB   ALA   9           HB2      ALA   9  -2.075   3.279 -10.492
   80   3HB   ALA   9           HB1      ALA   9  -0.569   3.948 -11.116
   81    H    LEU  10           HN       LEU  10  -1.297   2.879  -7.482
   82    HA   LEU  10           HA       LEU  10  -4.045   2.748  -6.914
   83   1HB   LEU  10           HB2      LEU  10  -3.011   0.985  -5.897
   84   2HB   LEU  10           HB1      LEU  10  -1.538   1.892  -5.604
   85    HG   LEU  10           HG       LEU  10  -2.798   1.137  -3.532
   86   1HD1  LEU  10          HD12      LEU  10  -1.412   3.495  -4.102
   87   2HD1  LEU  10          HD11      LEU  10  -2.817   4.009  -3.166
   88   3HD1  LEU  10          HD13      LEU  10  -1.713   2.802  -2.511
   89   1HD2  LEU  10          HD23      LEU  10  -4.922   2.546  -4.887
   90   2HD2  LEU  10          HD22      LEU  10  -5.000   1.575  -3.416
   91   3HD2  LEU  10          HD21      LEU  10  -4.613   3.292  -3.319
   92    H    ILE  11           HN       ILE  11  -1.564   4.852  -5.471
   93    HA   ILE  11           HA       ILE  11  -3.301   6.041  -3.519
   94    HB   ILE  11           HB       ILE  11  -1.223   7.797  -4.720
   95   1HG1  ILE  11          HG12      ILE  11  -0.605   5.115  -3.455
   96   2HG1  ILE  11          HG11      ILE  11  -0.023   5.746  -4.995
   97   1HG2  ILE  11          HG21      ILE  11  -2.636   7.914  -2.468
   98   2HG2  ILE  11          HG23      ILE  11  -1.337   6.885  -1.869
   99   3HG2  ILE  11          HG22      ILE  11  -0.968   8.482  -2.520
  100   1HD1  ILE  11          HD13      ILE  11   0.698   7.643  -3.013
  101   2HD1  ILE  11          HD12      ILE  11   1.139   6.056  -2.384
  102   3HD1  ILE  11          HD11      ILE  11   1.770   6.594  -3.941
  103    H    ASP  12           HN       ASP  12  -2.671   6.720  -6.921
  104    HA   ASP  12           HA       ASP  12  -4.028   9.196  -7.149
  105   1HB   ASP  12           HB2      ASP  12  -2.714   7.703  -8.918
  106   2HB   ASP  12           HB1      ASP  12  -4.336   7.128  -9.294
  107    H    VAL  13           HN       VAL  13  -5.247   5.848  -7.309
  108    HA   VAL  13           HA       VAL  13  -7.934   6.319  -7.914
  109    HB   VAL  13           HB       VAL  13  -6.635   4.345  -6.025
  110   1HG1  VAL  13          HG13      VAL  13  -9.533   4.956  -6.420
  111   2HG1  VAL  13          HG12      VAL  13  -9.060   3.260  -6.319
  112   3HG1  VAL  13          HG11      VAL  13  -8.699   4.357  -4.987
  113   1HG2  VAL  13          HG21      VAL  13  -7.714   4.362  -8.817
  114   2HG2  VAL  13          HG23      VAL  13  -6.247   3.615  -8.190
  115   3HG2  VAL  13          HG22      VAL  13  -7.813   2.864  -7.894
  116    H    PHE  14           HN       PHE  14  -6.282   6.648  -4.776
  117    HA   PHE  14           HA       PHE  14  -8.442   7.265  -3.118
  118   1HB   PHE  14           HB2      PHE  14  -6.055   7.175  -2.375
  119   2HB   PHE  14           HB1      PHE  14  -5.790   8.738  -3.149
  120    HD1  PHE  14           HD2      PHE  14  -8.011   7.044  -0.653
  121    HD2  PHE  14           HD1      PHE  14  -6.210  10.715  -1.960
  122    HE1  PHE  14           HE2      PHE  14  -8.895   8.193   1.359
  123    HE2  PHE  14           HE1      PHE  14  -7.093  11.864   0.052
  124    HZ   PHE  14           HZ       PHE  14  -8.436  10.603   1.712
  125    H    HIS  15           HN       HIS  15  -6.627   9.527  -5.213
  126    HA   HIS  15           HA       HIS  15  -8.224  11.819  -4.650
  127   1HB   HIS  15           HB2      HIS  15  -6.092  12.026  -5.819
  128   2HB   HIS  15           HB1      HIS  15  -6.706  11.073  -7.170
  129    HD1  HIS  15           HD1      HIS  15  -7.641  12.415  -9.048
  130    HD2  HIS  15           HD2      HIS  15  -7.814  14.505  -5.444
  131    HE1  HIS  15           HE1      HIS  15  -8.568  14.707  -9.593
  132    H    GLN  16           HN       GLN  16  -8.644   9.173  -6.965
  133    HA   GLN  16           HA       GLN  16 -10.730  10.237  -8.538
  134   1HB   GLN  16           HB2      GLN  16  -9.493   7.927  -8.662
  135   2HB   GLN  16           HB1      GLN  16 -10.802   7.374  -7.618
  136   1HG   GLN  16           HG2      GLN  16 -12.363   7.531  -9.273
  137   2HG   GLN  16           HG1      GLN  16 -11.638   8.987  -9.958
  138   1HE2  GLN  16          HE22      GLN  16 -10.530   5.320 -11.369
  139   2HE2  GLN  16          HE21      GLN  16 -11.538   5.449 -10.009
  140    H    TYR  17           HN       TYR  17 -11.019   8.304  -5.537
  141    HA   TYR  17           HA       TYR  17 -13.875   9.008  -5.351
  142   1HB   TYR  17           HB2      TYR  17 -12.130   7.424  -3.442
  143   2HB   TYR  17           HB1      TYR  17 -13.889   7.525  -3.401
  144    HD1  TYR  17           HD2      TYR  17 -15.217   6.655  -5.382
  145    HD2  TYR  17           HD1      TYR  17 -11.019   5.900  -4.888
  146    HE1  TYR  17           HE2      TYR  17 -15.361   4.783  -7.003
  147    HE2  TYR  17           HE1      TYR  17 -11.164   4.027  -6.509
  148    HH   TYR  17           HH       TYR  17 -13.447   3.618  -8.641
  149    H    SER  18           HN       SER  18 -11.070  10.576  -4.615
  150    HA   SER  18           HA       SER  18 -12.393  12.047  -2.374
  151   1HB   SER  18           HB2      SER  18 -10.347  10.508  -1.796
  152   2HB   SER  18           HB1      SER  18  -9.401  11.793  -2.540
  153    HG   SER  18           HG       SER  18  -9.660  12.159  -0.316
  154    H    GLY  19           HN       GLY  19 -12.183  12.513  -5.344
  155   1HA   GLY  19           HA2      GLY  19 -10.930  15.207  -5.172
  156   2HA   GLY  19           HA1      GLY  19 -10.693  14.194  -6.595
  157    H    ARG  20           HN       ARG  20 -13.742  13.513  -5.577
  158    HA   ARG  20           HA       ARG  20 -15.135  14.529  -7.737
  159   1HB   ARG  20           HB2      ARG  20 -15.858  13.733  -4.989
  160   2HB   ARG  20           HB1      ARG  20 -17.006  14.833  -5.751
  161   1HG   ARG  20           HG2      ARG  20 -17.567  13.325  -7.407
  162   2HG   ARG  20           HG1      ARG  20 -15.990  12.536  -7.371
  163   1HD   ARG  20           HD2      ARG  20 -17.171  10.906  -6.273
  164   2HD   ARG  20           HD1      ARG  20 -16.834  11.934  -4.880
  165    HE   ARG  20           HE       ARG  20 -19.136  12.406  -4.776
  166   1HH1  ARG  20          HH21      ARG  20 -20.235  13.774  -6.746
  167   2HH1  ARG  20          HH22      ARG  20 -20.964  12.680  -7.873
  168   1HH2  ARG  20          HH11      ARG  20 -19.207   9.918  -6.733
  169   2HH2  ARG  20          HH12      ARG  20 -20.381  10.497  -7.865
  170    H    GLU  21           HN       GLU  21 -15.970  16.123  -4.718
  171    HA   GLU  21           HA       GLU  21 -15.396  18.748  -6.033
  172   1HB   GLU  21           HB2      GLU  21 -17.801  18.410  -5.953
  173   2HB   GLU  21           HB1      GLU  21 -17.720  17.971  -4.246
  174   1HG   GLU  21           HG2      GLU  21 -17.236  20.163  -3.571
  175   2HG   GLU  21           HG1      GLU  21 -16.671  20.632  -5.176
  176    H    GLY  22           HN       GLY  22 -16.533  18.018  -2.747
  177   1HA   GLY  22           HA2      GLY  22 -14.400  19.676  -1.634
  178   2HA   GLY  22           HA1      GLY  22 -15.659  18.854  -0.712
  179    H    ASP  23           HN       ASP  23 -14.283  17.870   0.792
  180    HA   ASP  23           HA       ASP  23 -12.429  16.581   1.533
  181   1HB   ASP  23           HB2      ASP  23 -13.681  14.452  -0.133
  182   2HB   ASP  23           HB1      ASP  23 -13.217  14.430   1.564
  183    H    LYS  24           HN       LYS  24 -10.860  17.765   0.030
  184    HA   LYS  24           HA       LYS  24 -10.086  16.326  -2.408
  185   1HB   LYS  24           HB2      LYS  24  -9.880  18.919  -1.742
  186   2HB   LYS  24           HB1      LYS  24  -8.295  18.374  -1.191
  187   1HG   LYS  24           HG2      LYS  24  -7.625  17.724  -3.334
  188   2HG   LYS  24           HG1      LYS  24  -9.284  17.562  -3.911
  189   1HD   LYS  24           HD2      LYS  24  -8.908  19.595  -4.862
  190   2HD   LYS  24           HD1      LYS  24  -9.222  20.210  -3.238
  191   1HE   LYS  24           HE2      LYS  24  -6.891  20.319  -2.725
  192   2HE   LYS  24           HE1      LYS  24  -6.463  19.378  -4.154
  193   1HZ   LYS  24           HZ2      LYS  24  -7.965  21.836  -4.589
  194   2HZ   LYS  24           HZ1      LYS  24  -6.346  22.007  -4.104
  195   3HZ   LYS  24           HZ3      LYS  24  -6.721  21.145  -5.517
  196    H    HIS  25           HN       HIS  25  -9.403  16.076   0.923
  197    HA   HIS  25           HA       HIS  25  -7.244  14.140   0.319
  198   1HB   HIS  25           HB2      HIS  25  -6.606  15.755   2.678
  199   2HB   HIS  25           HB1      HIS  25  -5.564  15.260   1.347
  200    HD1  HIS  25           HD1      HIS  25  -8.177  17.891   2.184
  201    HD2  HIS  25           HD2      HIS  25  -5.055  17.277  -0.510
  202    HE1  HIS  25           HE1      HIS  25  -7.885  20.064   0.918
  203    H    LYS  26           HN       LYS  26 -10.066  14.042   1.300
  204    HA   LYS  26           HA       LYS  26  -9.511  12.387   3.695
  205   1HB   LYS  26           HB2      LYS  26 -11.548  13.449   4.818
  206   2HB   LYS  26           HB1      LYS  26 -10.090  14.437   4.769
  207   1HG   LYS  26           HG2      LYS  26 -11.355  15.030   2.365
  208   2HG   LYS  26           HG1      LYS  26 -12.686  14.907   3.517
  209   1HD   LYS  26           HD2      LYS  26 -10.202  16.613   3.855
  210   2HD   LYS  26           HD1      LYS  26 -11.817  17.205   3.467
  211   1HE   LYS  26           HE2      LYS  26 -12.485  17.087   5.624
  212   2HE   LYS  26           HE1      LYS  26 -11.804  15.474   5.824
  213   1HZ   LYS  26           HZ1      LYS  26 -10.135  17.918   5.764
  214   2HZ   LYS  26           HZ3      LYS  26 -10.773  17.283   7.203
  215   3HZ   LYS  26           HZ2      LYS  26  -9.691  16.360   6.274
  216    H    LEU  27           HN       LEU  27 -10.611  10.514   3.530
  217    HA   LEU  27           HA       LEU  27 -12.920  10.418   1.635
  218   1HB   LEU  27           HB2      LEU  27 -10.581   8.756   1.964
  219   2HB   LEU  27           HB1      LEU  27 -12.033   7.794   2.225
  220    HG   LEU  27           HG       LEU  27 -11.355   9.477  -0.199
  221   1HD1  LEU  27          HD12      LEU  27 -11.812   6.524   0.281
  222   2HD1  LEU  27          HD11      LEU  27 -11.744   7.242  -1.328
  223   3HD1  LEU  27          HD13      LEU  27 -10.331   7.302  -0.275
  224   1HD2  LEU  27          HD22      LEU  27 -13.951   8.533   0.873
  225   2HD2  LEU  27          HD21      LEU  27 -13.609   9.853  -0.245
  226   3HD2  LEU  27          HD23      LEU  27 -13.672   8.193  -0.836
  227    H    LYS  28           HN       LYS  28 -13.821   7.830   2.593
  228    HA   LYS  28           HA       LYS  28 -14.525   8.381   5.430
  229   1HB   LYS  28           HB2      LYS  28 -16.431   8.106   3.117
  230   2HB   LYS  28           HB1      LYS  28 -16.932   7.683   4.754
  231   1HG   LYS  28           HG2      LYS  28 -16.600   9.891   5.546
  232   2HG   LYS  28           HG1      LYS  28 -15.636  10.337   4.138
  233   1HD   LYS  28           HD2      LYS  28 -17.673  11.309   3.588
  234   2HD   LYS  28           HD1      LYS  28 -17.843   9.730   2.820
  235   1HE   LYS  28           HE2      LYS  28 -18.769   9.095   5.258
  236   2HE   LYS  28           HE1      LYS  28 -19.181  10.809   5.257
  237   1HZ   LYS  28           HZ3      LYS  28 -19.811   9.374   2.820
  238   2HZ   LYS  28           HZ2      LYS  28 -20.713   8.911   4.184
  239   3HZ   LYS  28           HZ1      LYS  28 -20.720  10.529   3.668
  240    H    LYS  29           HN       LYS  29 -15.854   6.396   6.274
  241    HA   LYS  29           HA       LYS  29 -14.249   4.033   5.759
  242   1HB   LYS  29           HB2      LYS  29 -16.835   4.215   7.326
  243   2HB   LYS  29           HB1      LYS  29 -15.580   2.986   7.480
  244   1HG   LYS  29           HG2      LYS  29 -15.375   5.918   8.198
  245   2HG   LYS  29           HG1      LYS  29 -15.262   4.537   9.290
  246   1HD   LYS  29           HD2      LYS  29 -13.262   3.804   7.802
  247   2HD   LYS  29           HD1      LYS  29 -13.273   5.471   7.226
  248   1HE   LYS  29           HE2      LYS  29 -12.239   6.165   9.098
  249   2HE   LYS  29           HE1      LYS  29 -13.499   5.444  10.101
  250   1HZ   LYS  29           HZ1      LYS  29 -11.643   3.568   8.914
  251   2HZ   LYS  29           HZ3      LYS  29 -10.957   4.617  10.055
  252   3HZ   LYS  29           HZ2      LYS  29 -12.268   3.632  10.493
  253    H    SER  30           HN       SER  30 -17.432   5.169   4.763
  254    HA   SER  30           HA       SER  30 -18.280   2.611   3.680
  255   1HB   SER  30           HB2      SER  30 -19.909   4.365   4.295
  256   2HB   SER  30           HB1      SER  30 -19.243   5.420   3.052
  257    HG   SER  30           HG       SER  30 -20.738   4.459   1.896
  258    H    GLU  31           HN       GLU  31 -16.354   5.282   2.499
  259    HA   GLU  31           HA       GLU  31 -16.513   4.324  -0.287
  260   1HB   GLU  31           HB2      GLU  31 -16.276   6.799   0.451
  261   2HB   GLU  31           HB1      GLU  31 -14.585   6.401   0.756
  262   1HG   GLU  31           HG2      GLU  31 -14.101   6.470  -1.443
  263   2HG   GLU  31           HG1      GLU  31 -15.423   5.364  -1.816
  264    H    LEU  32           HN       LEU  32 -14.608   3.868   2.543
  265    HA   LEU  32           HA       LEU  32 -12.240   2.899   1.111
  266   1HB   LEU  32           HB2      LEU  32 -11.798   3.818   3.275
  267   2HB   LEU  32           HB1      LEU  32 -13.096   2.884   4.017
  268    HG   LEU  32           HG       LEU  32 -11.888   0.819   3.697
  269   1HD1  LEU  32          HD13      LEU  32 -10.550   2.373   1.667
  270   2HD1  LEU  32          HD12      LEU  32  -9.359   1.643   2.742
  271   3HD1  LEU  32          HD11      LEU  32 -10.535   0.628   1.909
  272   1HD2  LEU  32          HD23      LEU  32 -10.881   3.016   5.222
  273   2HD2  LEU  32          HD22      LEU  32 -10.721   1.293   5.564
  274   3HD2  LEU  32          HD21      LEU  32  -9.500   2.117   4.594
  275    H    LYS  33           HN       LYS  33 -15.076   1.585   2.735
  276    HA   LYS  33           HA       LYS  33 -14.383  -1.188   2.587
  277   1HB   LYS  33           HB2      LYS  33 -16.362   0.092   3.794
  278   2HB   LYS  33           HB1      LYS  33 -17.220  -0.251   2.297
  279   1HG   LYS  33           HG2      LYS  33 -16.166  -2.683   2.727
  280   2HG   LYS  33           HG1      LYS  33 -16.258  -2.129   4.400
  281   1HD   LYS  33           HD2      LYS  33 -18.575  -1.962   4.363
  282   2HD   LYS  33           HD1      LYS  33 -18.633  -1.737   2.614
  283   1HE   LYS  33           HE2      LYS  33 -17.458  -4.275   3.056
  284   2HE   LYS  33           HE1      LYS  33 -18.861  -4.182   4.120
  285   1HZ   LYS  33           HZ3      LYS  33 -19.962  -3.197   1.984
  286   2HZ   LYS  33           HZ2      LYS  33 -18.729  -4.058   1.194
  287   3HZ   LYS  33           HZ1      LYS  33 -19.833  -4.874   2.195
  288    H    GLU  34           HN       GLU  34 -15.937   1.048   0.369
  289    HA   GLU  34           HA       GLU  34 -16.523  -1.001  -1.628
  290   1HB   GLU  34           HB2      GLU  34 -17.512   0.737  -2.860
  291   2HB   GLU  34           HB1      GLU  34 -17.689   1.316  -1.205
  292   1HG   GLU  34           HG2      GLU  34 -15.826   2.797  -1.418
  293   2HG   GLU  34           HG1      GLU  34 -15.343   2.081  -2.954
  294    H    LEU  35           HN       LEU  35 -14.089   1.444  -1.056
  295    HA   LEU  35           HA       LEU  35 -12.625   1.442  -3.432
  296   1HB   LEU  35           HB2      LEU  35 -12.242   2.508  -0.972
  297   2HB   LEU  35           HB1      LEU  35 -11.050   1.207  -0.916
  298    HG   LEU  35           HG       LEU  35 -10.070   3.300  -1.804
  299   1HD1  LEU  35          HD12      LEU  35  -9.735   0.776  -2.760
  300   2HD1  LEU  35          HD11      LEU  35 -10.186   1.619  -4.241
  301   3HD1  LEU  35          HD13      LEU  35  -8.789   2.158  -3.309
  302   1HD2  LEU  35          HD23      LEU  35 -12.414   3.847  -2.904
  303   2HD2  LEU  35          HD22      LEU  35 -10.925   4.421  -3.655
  304   3HD2  LEU  35          HD21      LEU  35 -11.730   2.984  -4.282
  305    H    ILE  36           HN       ILE  36 -12.280  -0.832  -0.700
  306    HA   ILE  36           HA       ILE  36 -10.429  -2.516  -2.218
  307    HB   ILE  36           HB       ILE  36 -11.697  -3.574   0.244
  308   1HG1  ILE  36          HG12      ILE  36 -10.227  -0.951   0.123
  309   2HG1  ILE  36          HG11      ILE  36 -11.628  -1.393   1.091
  310   1HG2  ILE  36          HG21      ILE  36  -9.708  -4.520  -1.063
  311   2HG2  ILE  36          HG23      ILE  36  -8.782  -3.154  -0.443
  312   3HG2  ILE  36          HG22      ILE  36  -9.476  -4.329   0.675
  313   1HD1  ILE  36          HD11      ILE  36  -9.951  -3.102   2.202
  314   2HD1  ILE  36          HD13      ILE  36  -8.731  -1.988   1.585
  315   3HD1  ILE  36          HD12      ILE  36  -9.961  -1.414   2.712
  316    H    ASN  37           HN       ASN  37 -13.709  -2.993  -0.864
  317    HA   ASN  37           HA       ASN  37 -14.056  -5.561  -2.142
  318   1HB   ASN  37           HB2      ASN  37 -15.257  -4.808  -0.080
  319   2HB   ASN  37           HB1      ASN  37 -16.175  -3.685  -1.085
  320   1HD2  ASN  37          HD22      ASN  37 -18.317  -6.182  -2.384
  321   2HD2  ASN  37          HD21      ASN  37 -17.864  -4.547  -2.419
  322    H    ASN  38           HN       ASN  38 -13.873  -2.644  -3.635
  323    HA   ASN  38           HA       ASN  38 -15.913  -3.451  -5.669
  324   1HB   ASN  38           HB2      ASN  38 -16.293  -1.254  -4.388
  325   2HB   ASN  38           HB1      ASN  38 -14.918  -0.627  -5.295
  326   1HD2  ASN  38          HD21      ASN  38 -16.517   0.880  -6.345
  327   2HD2  ASN  38          HD22      ASN  38 -17.475   0.305  -7.623
  328    H    GLU  39           HN       GLU  39 -13.188  -1.136  -5.740
  329    HA   GLU  39           HA       GLU  39 -12.472  -1.827  -8.421
  330   1HB   GLU  39           HB2      GLU  39 -11.001  -0.408  -6.198
  331   2HB   GLU  39           HB1      GLU  39 -10.266  -0.672  -7.781
  332   1HG   GLU  39           HG2      GLU  39 -11.386   1.543  -7.632
  333   2HG   GLU  39           HG1      GLU  39 -12.108   0.514  -8.870
  334    H    LEU  40           HN       LEU  40 -11.174  -2.904  -5.278
  335    HA   LEU  40           HA       LEU  40  -9.166  -4.589  -6.534
  336   1HB   LEU  40           HB2      LEU  40  -9.257  -3.548  -4.107
  337   2HB   LEU  40           HB1      LEU  40 -10.099  -5.038  -3.713
  338    HG   LEU  40           HG       LEU  40  -7.561  -5.180  -5.298
  339   1HD1  LEU  40          HD13      LEU  40  -7.233  -3.686  -3.250
  340   2HD1  LEU  40          HD12      LEU  40  -7.623  -5.101  -2.271
  341   3HD1  LEU  40          HD11      LEU  40  -6.207  -5.120  -3.325
  342   1HD2  LEU  40          HD22      LEU  40  -9.213  -6.935  -3.516
  343   2HD2  LEU  40          HD21      LEU  40  -8.483  -7.300  -5.080
  344   3HD2  LEU  40          HD23      LEU  40  -7.481  -7.247  -3.630
  345    H    SER  41           HN       SER  41 -11.416  -5.986  -4.173
  346    HA   SER  41           HA       SER  41 -12.335  -8.177  -4.280
  347   1HB   SER  41           HB2      SER  41 -14.023  -6.379  -5.037
  348   2HB   SER  41           HB1      SER  41 -13.734  -6.982  -6.668
  349    HG   SER  41           HG       SER  41 -15.393  -7.958  -4.946
  350    H    HIS  42           HN       HIS  42 -10.730  -9.658  -4.968
  351    HA   HIS  42           HA       HIS  42 -11.143 -10.847  -7.554
  352   1HB   HIS  42           HB2      HIS  42  -9.639  -8.638  -7.842
  353   2HB   HIS  42           HB1      HIS  42  -8.367  -9.782  -7.413
  354    HD1  HIS  42           HD1      HIS  42 -10.341 -12.102  -8.848
  355    HD2  HIS  42           HD2      HIS  42  -8.481  -8.785 -10.553
  356    HE1  HIS  42           HE1      HIS  42 -10.157 -12.579 -11.329
  357    H    PHE  43           HN       PHE  43  -8.454 -10.359  -5.232
  358    HA   PHE  43           HA       PHE  43  -7.785 -13.210  -5.375
  359   1HB   PHE  43           HB2      PHE  43  -6.680 -11.318  -3.316
  360   2HB   PHE  43           HB1      PHE  43  -5.885 -12.670  -4.123
  361    HD1  PHE  43           HD2      PHE  43  -5.742 -12.450  -6.775
  362    HD2  PHE  43           HD1      PHE  43  -6.200  -9.158  -4.054
  363    HE1  PHE  43           HE2      PHE  43  -4.855 -10.903  -8.499
  364    HE2  PHE  43           HE1      PHE  43  -5.314  -7.612  -5.778
  365    HZ   PHE  43           HZ       PHE  43  -4.642  -8.484  -8.001
  366    H    LEU  44           HN       LEU  44 -10.157 -11.508  -3.793
  367    HA   LEU  44           HA       LEU  44 -10.027 -12.730  -1.170
  368   1HB   LEU  44           HB2      LEU  44 -11.808 -10.929  -2.617
  369   2HB   LEU  44           HB1      LEU  44 -12.702 -12.102  -1.648
  370    HG   LEU  44           HG       LEU  44 -10.483 -11.194  -0.097
  371   1HD1  LEU  44          HD13      LEU  44 -11.374  -9.202  -1.914
  372   2HD1  LEU  44          HD12      LEU  44 -12.018  -8.774  -0.329
  373   3HD1  LEU  44          HD11      LEU  44 -10.283  -9.000  -0.544
  374   1HD2  LEU  44          HD23      LEU  44 -13.186 -11.799   0.199
  375   2HD2  LEU  44          HD22      LEU  44 -12.107 -11.244   1.478
  376   3HD2  LEU  44          HD21      LEU  44 -13.097 -10.084   0.595
  377    H    GLU  45           HN       GLU  45  -9.931 -14.967  -1.264
  378    HA   GLU  45           HA       GLU  45 -12.284 -16.316  -2.519
  379   1HB   GLU  45           HB2      GLU  45  -9.793 -17.897  -2.301
  380   2HB   GLU  45           HB1      GLU  45 -10.976 -17.842  -3.605
  381   1HG   GLU  45           HG2      GLU  45 -10.056 -15.552  -4.201
  382   2HG   GLU  45           HG1      GLU  45  -8.750 -15.867  -3.059
  383    H    GLU  46           HN       GLU  46  -9.562 -17.094  -0.352
  384    HA   GLU  46           HA       GLU  46 -11.560 -18.295   1.524
  385   1HB   GLU  46           HB2      GLU  46  -9.734 -19.798   2.271
  386   2HB   GLU  46           HB1      GLU  46 -10.070 -19.995   0.551
  387   1HG   GLU  46           HG2      GLU  46  -8.210 -18.274   0.150
  388   2HG   GLU  46           HG1      GLU  46  -7.769 -18.525   1.838
  389    H    ILE  47           HN       ILE  47  -8.818 -16.168   1.128
  390    HA   ILE  47           HA       ILE  47  -7.946 -14.544   2.581
  391    HB   ILE  47           HB       ILE  47 -10.281 -15.250   4.378
  392   1HG1  ILE  47          HG12      ILE  47 -10.598 -12.878   2.727
  393   2HG1  ILE  47          HG11      ILE  47 -10.387 -14.318   1.731
  394   1HG2  ILE  47          HG23      ILE  47  -8.503 -12.819   4.068
  395   2HG2  ILE  47          HG22      ILE  47 -10.000 -12.813   4.998
  396   3HG2  ILE  47          HG21      ILE  47  -8.663 -13.852   5.488
  397   1HD1  ILE  47          HD11      ILE  47 -12.278 -14.350   4.074
  398   2HD1  ILE  47          HD13      ILE  47 -12.793 -13.698   2.518
  399   3HD1  ILE  47          HD12      ILE  47 -12.275 -15.378   2.641
  400    H    LYS  48           HN       LYS  48  -6.071 -15.173   3.540
  401    HA   LYS  48           HA       LYS  48  -6.073 -17.496   5.371
  402   1HB   LYS  48           HB2      LYS  48  -4.288 -16.929   3.530
  403   2HB   LYS  48           HB1      LYS  48  -3.647 -15.830   4.751
  404   1HG   LYS  48           HG2      LYS  48  -4.298 -18.502   5.794
  405   2HG   LYS  48           HG1      LYS  48  -3.029 -18.507   4.568
  406   1HD   LYS  48           HD2      LYS  48  -2.397 -16.317   6.170
  407   2HD   LYS  48           HD1      LYS  48  -2.937 -17.540   7.321
  408   1HE   LYS  48           HE2      LYS  48  -1.060 -18.751   7.027
  409   2HE   LYS  48           HE1      LYS  48  -1.241 -18.710   5.272
  410   1HZ   LYS  48           HZ3      LYS  48  -0.239 -16.389   6.806
  411   2HZ   LYS  48           HZ2      LYS  48   0.799 -17.605   6.231
  412   3HZ   LYS  48           HZ1      LYS  48  -0.115 -16.679   5.140
  413    H    GLU  49           HN       GLU  49  -5.331 -14.017   5.422
  414    HA   GLU  49           HA       GLU  49  -4.880 -14.103   8.336
  415   1HB   GLU  49           HB2      GLU  49  -4.522 -12.110   6.155
  416   2HB   GLU  49           HB1      GLU  49  -4.881 -11.467   7.759
  417   1HG   GLU  49           HG2      GLU  49  -2.698 -13.496   7.227
  418   2HG   GLU  49           HG1      GLU  49  -2.417 -11.756   7.283
  419    H    GLN  50           HN       GLN  50  -7.301 -14.995   8.267
  420    HA   GLN  50           HA       GLN  50  -9.523 -13.376   7.790
  421   1HB   GLN  50           HB2      GLN  50  -9.457 -15.792   8.661
  422   2HB   GLN  50           HB1      GLN  50  -9.292 -15.087  10.270
  423   1HG   GLN  50           HG2      GLN  50 -11.376 -13.783   9.883
  424   2HG   GLN  50           HG1      GLN  50 -11.558 -14.582   8.320
  425   1HE2  GLN  50          HE22      GLN  50 -12.790 -17.596   9.708
  426   2HE2  GLN  50          HE21      GLN  50 -12.284 -16.790   8.302
  427    H    GLU  51           HN       GLU  51  -7.089 -13.018  10.238
  428    HA   GLU  51           HA       GLU  51  -8.686 -11.277  11.954
  429   1HB   GLU  51           HB2      GLU  51  -6.607 -12.708  12.592
  430   2HB   GLU  51           HB1      GLU  51  -5.676 -11.363  11.934
  431   1HG   GLU  51           HG2      GLU  51  -7.025  -9.833  13.448
  432   2HG   GLU  51           HG1      GLU  51  -7.657 -11.286  14.222
  433    H    VAL  52           HN       VAL  52  -6.174 -10.814   9.466
  434    HA   VAL  52           HA       VAL  52  -5.951  -7.984   9.742
  435    HB   VAL  52           HB       VAL  52  -5.555  -9.775   7.328
  436   1HG1  VAL  52          HG12      VAL  52  -5.121  -6.824   7.749
  437   2HG1  VAL  52          HG11      VAL  52  -4.120  -7.725   6.611
  438   3HG1  VAL  52          HG13      VAL  52  -5.865  -7.644   6.377
  439   1HG2  VAL  52          HG23      VAL  52  -4.085  -9.463   9.689
  440   2HG2  VAL  52          HG22      VAL  52  -3.508 -10.186   8.187
  441   3HG2  VAL  52          HG21      VAL  52  -3.232  -8.474   8.504
  442    H    VAL  53           HN       VAL  53  -7.872  -9.872   7.376
  443    HA   VAL  53           HA       VAL  53  -9.251  -7.569   6.355
  444    HB   VAL  53           HB       VAL  53 -10.003 -10.506   6.335
  445   1HG1  VAL  53          HG13      VAL  53 -11.449  -8.111   5.497
  446   2HG1  VAL  53          HG12      VAL  53 -11.193  -9.234   4.162
  447   3HG1  VAL  53          HG11      VAL  53 -12.018  -9.774   5.624
  448   1HG2  VAL  53          HG22      VAL  53  -8.593  -8.673   4.378
  449   2HG2  VAL  53          HG21      VAL  53  -7.964 -10.144   5.117
  450   3HG2  VAL  53          HG23      VAL  53  -9.249 -10.243   3.914
  451    H    ASP  54           HN       ASP  54  -9.793  -9.648   9.118
  452    HA   ASP  54           HA       ASP  54 -12.539  -8.779   9.542
  453   1HB   ASP  54           HB2      ASP  54 -10.515 -10.316  11.151
  454   2HB   ASP  54           HB1      ASP  54 -11.974  -9.710  11.934
  455    H    LYS  55           HN       LYS  55  -9.384  -7.548  10.297
  456    HA   LYS  55           HA       LYS  55 -10.303  -5.798  12.447
  457   1HB   LYS  55           HB2      LYS  55  -7.841  -6.726  11.692
  458   2HB   LYS  55           HB1      LYS  55  -7.807  -5.090  11.034
  459   1HG   LYS  55           HG2      LYS  55  -7.564  -4.199  13.088
  460   2HG   LYS  55           HG1      LYS  55  -8.958  -5.093  13.695
  461   1HD   LYS  55           HD2      LYS  55  -7.655  -6.656  14.678
  462   2HD   LYS  55           HD1      LYS  55  -6.634  -6.811  13.248
  463   1HE   LYS  55           HE2      LYS  55  -5.029  -5.716  14.386
  464   2HE   LYS  55           HE1      LYS  55  -6.039  -4.274  14.281
  465   1HZ   LYS  55           HZ2      LYS  55  -6.189  -6.322  16.427
  466   2HZ   LYS  55           HZ1      LYS  55  -5.445  -4.802  16.571
  467   3HZ   LYS  55           HZ3      LYS  55  -7.120  -4.904  16.333
  468    H    VAL  56           HN       VAL  56  -9.234  -5.253   9.060
  469    HA   VAL  56           HA       VAL  56 -10.001  -2.471   9.113
  470    HB   VAL  56           HB       VAL  56  -9.814  -2.707   6.592
  471   1HG1  VAL  56          HG12      VAL  56  -7.603  -3.537   8.467
  472   2HG1  VAL  56          HG11      VAL  56  -7.314  -3.312   6.741
  473   3HG1  VAL  56          HG13      VAL  56  -7.872  -1.960   7.726
  474   1HG2  VAL  56          HG23      VAL  56  -9.853  -5.511   7.367
  475   2HG2  VAL  56          HG22      VAL  56 -10.022  -4.795   5.767
  476   3HG2  VAL  56          HG21      VAL  56  -8.418  -5.124   6.420
  477    H    MET  57           HN       MET  57 -11.562  -5.445   8.025
  478    HA   MET  57           HA       MET  57 -13.897  -4.167   6.921
  479   1HB   MET  57           HB2      MET  57 -13.031  -6.599   6.592
  480   2HB   MET  57           HB1      MET  57 -13.877  -6.942   8.103
  481   1HG   MET  57           HG2      MET  57 -15.350  -7.400   6.201
  482   2HG   MET  57           HG1      MET  57 -15.962  -6.023   7.117
  483   1HE   MET  57           HE1      MET  57 -13.525  -7.091   4.441
  484   2HE   MET  57           HE3      MET  57 -13.419  -5.742   3.304
  485   3HE   MET  57           HE2      MET  57 -12.692  -5.611   4.904
  486    H    GLU  58           HN       GLU  58 -12.914  -5.097  10.160
  487    HA   GLU  58           HA       GLU  58 -15.582  -4.958  11.302
  488   1HB   GLU  58           HB2      GLU  58 -12.795  -5.167  12.340
  489   2HB   GLU  58           HB1      GLU  58 -14.010  -4.513  13.440
  490   1HG   GLU  58           HG2      GLU  58 -14.994  -6.848  11.998
  491   2HG   GLU  58           HG1      GLU  58 -13.547  -7.213  12.935
  492    H    THR  59           HN       THR  59 -12.790  -2.703  11.290
  493    HA   THR  59           HA       THR  59 -14.228  -0.573  12.587
  494    HB   THR  59           HB       THR  59 -11.929  -0.282  10.630
  495    HG1  THR  59           HG1      THR  59 -11.533  -0.410  13.379
  496   1HG2  THR  59          HG23      THR  59 -13.162   1.775  11.404
  497   2HG2  THR  59          HG22      THR  59 -12.690   1.368  13.053
  498   3HG2  THR  59          HG21      THR  59 -11.458   1.746  11.849
  499    H    LEU  60           HN       LEU  60 -14.121  -1.801   9.360
  500    HA   LEU  60           HA       LEU  60 -15.127   0.522   7.983
  501   1HB   LEU  60           HB2      LEU  60 -14.739  -2.370   7.408
  502   2HB   LEU  60           HB1      LEU  60 -15.915  -1.522   6.410
  503    HG   LEU  60           HG       LEU  60 -13.052  -0.649   6.871
  504   1HD1  LEU  60          HD11      LEU  60 -14.421  -2.250   4.752
  505   2HD1  LEU  60          HD13      LEU  60 -13.174  -1.114   4.241
  506   3HD1  LEU  60          HD12      LEU  60 -12.783  -2.398   5.384
  507   1HD2  LEU  60          HD21      LEU  60 -15.373   0.503   5.323
  508   2HD2  LEU  60          HD23      LEU  60 -14.310   1.314   6.471
  509   3HD2  LEU  60          HD22      LEU  60 -13.709   0.870   4.873
  510    H    ASP  61           HN       ASP  61 -16.714  -2.487   9.071
  511    HA   ASP  61           HA       ASP  61 -19.370  -1.481   8.469
  512   1HB   ASP  61           HB2      ASP  61 -18.284  -3.976   8.911
  513   2HB   ASP  61           HB1      ASP  61 -19.187  -3.690  10.401
  514    H    GLU  62           HN       GLU  62 -17.214  -1.086  11.111
  515    HA   GLU  62           HA       GLU  62 -19.283  -0.719  13.139
  516   1HB   GLU  62           HB2      GLU  62 -16.890  -1.414  13.620
  517   2HB   GLU  62           HB1      GLU  62 -16.418   0.245  13.252
  518   1HG   GLU  62           HG2      GLU  62 -17.772   1.110  15.045
  519   2HG   GLU  62           HG1      GLU  62 -18.518  -0.464  15.316
  520    H    ASP  63           HN       ASP  63 -17.417   1.360  10.977
  521    HA   ASP  63           HA       ASP  63 -19.283   3.572  11.672
  522   1HB   ASP  63           HB2      ASP  63 -16.264   3.677  11.696
  523   2HB   ASP  63           HB1      ASP  63 -17.246   5.128  11.498
  524    H    GLY  64           HN       GLY  64 -19.558   2.014   9.414
  525   1HA   GLY  64           HA2      GLY  64 -18.160   2.661   7.088
  526   2HA   GLY  64           HA1      GLY  64 -19.896   2.345   7.106
  527    H    ASP  65           HN       ASP  65 -20.296   4.682   8.970
  528    HA   ASP  65           HA       ASP  65 -20.239   6.770   6.847
  529   1HB   ASP  65           HB2      ASP  65 -22.442   6.263   7.829
  530   2HB   ASP  65           HB1      ASP  65 -21.818   6.631   9.437
  531    H    GLY  66           HN       GLY  66 -17.786   6.285   8.104
  532   1HA   GLY  66           HA2      GLY  66 -17.529   8.608   9.952
  533   2HA   GLY  66           HA1      GLY  66 -16.463   7.207   9.996
  534    H    GLU  67           HN       GLU  67 -14.820   9.051   9.786
  535    HA   GLU  67           HA       GLU  67 -14.404   9.664   6.884
  536   1HB   GLU  67           HB2      GLU  67 -13.171  11.706   7.684
  537   2HB   GLU  67           HB1      GLU  67 -14.896  11.730   8.056
  538   1HG   GLU  67           HG2      GLU  67 -14.459  10.991  10.339
  539   2HG   GLU  67           HG1      GLU  67 -12.739  10.825   9.985
  540    H    CYS  68           HN       CYS  68 -12.436   9.046   6.055
  541    HA   CYS  68           HA       CYS  68 -10.382   8.095   8.019
  542   1HB   CYS  68           HB2      CYS  68 -11.742   6.609   6.026
  543   2HB   CYS  68           HB1      CYS  68 -10.095   6.839   5.442
  544    HG   CYS  68           HG       CYS  68  -9.183   5.544   7.422
  545    H    ASP  69           HN       ASP  69  -8.137   8.206   7.151
  546    HA   ASP  69           HA       ASP  69  -7.824  10.662   5.508
  547   1HB   ASP  69           HB2      ASP  69  -5.674   9.117   6.979
  548   2HB   ASP  69           HB1      ASP  69  -5.582  10.771   6.374
  549    H    PHE  70           HN       PHE  70  -6.004  10.600   3.862
  550    HA   PHE  70           HA       PHE  70  -6.420   8.444   2.020
  551   1HB   PHE  70           HB2      PHE  70  -4.758   9.504   0.657
  552   2HB   PHE  70           HB1      PHE  70  -5.601  10.809   1.490
  553    HD1  PHE  70           HD2      PHE  70  -4.547  12.022   3.347
  554    HD2  PHE  70           HD1      PHE  70  -2.466   8.918   1.229
  555    HE1  PHE  70           HE2      PHE  70  -2.407  12.778   4.342
  556    HE2  PHE  70           HE1      PHE  70  -0.325   9.675   2.224
  557    HZ   PHE  70           HZ       PHE  70  -0.296  11.605   3.780
  558    H    GLN  71           HN       GLN  71  -3.700   9.194   4.217
  559    HA   GLN  71           HA       GLN  71  -2.170   6.868   3.506
  560   1HB   GLN  71           HB2      GLN  71  -0.776   7.410   5.345
  561   2HB   GLN  71           HB1      GLN  71  -1.394   8.967   4.797
  562   1HG   GLN  71           HG2      GLN  71  -2.093   9.304   6.917
  563   2HG   GLN  71           HG1      GLN  71  -3.318   8.073   6.614
  564   1HE2  GLN  71          HE22      GLN  71  -0.734   5.575   7.911
  565   2HE2  GLN  71          HE21      GLN  71  -1.290   5.891   6.338
  566    H    GLU  72           HN       GLU  72  -4.894   7.389   5.615
  567    HA   GLU  72           HA       GLU  72  -4.585   4.963   7.166
  568   1HB   GLU  72           HB2      GLU  72  -6.721   6.998   6.719
  569   2HB   GLU  72           HB1      GLU  72  -7.240   5.417   7.298
  570   1HG   GLU  72           HG2      GLU  72  -4.980   6.027   8.837
  571   2HG   GLU  72           HG1      GLU  72  -5.880   7.540   8.741
  572    H    PHE  73           HN       PHE  73  -7.090   5.729   4.734
  573    HA   PHE  73           HA       PHE  73  -7.901   3.114   4.177
  574   1HB   PHE  73           HB2      PHE  73  -9.228   4.298   2.776
  575   2HB   PHE  73           HB1      PHE  73  -8.214   5.712   3.000
  576    HD1  PHE  73           HD1      PHE  73  -6.426   6.253   1.407
  577    HD2  PHE  73           HD2      PHE  73  -8.959   2.835   0.835
  578    HE1  PHE  73           HE1      PHE  73  -5.641   6.064  -0.938
  579    HE2  PHE  73           HE2      PHE  73  -8.177   2.648  -1.511
  580    HZ   PHE  73           HZ       PHE  73  -6.518   4.262  -2.398
  581    H    MET  74           HN       MET  74  -4.991   4.793   3.226
  582    HA   MET  74           HA       MET  74  -4.160   3.049   1.116
  583   1HB   MET  74           HB2      MET  74  -2.825   5.011   2.936
  584   2HB   MET  74           HB1      MET  74  -1.811   3.915   2.004
  585   1HG   MET  74           HG2      MET  74  -3.941   5.744   0.860
  586   2HG   MET  74           HG1      MET  74  -2.202   6.019   0.772
  587   1HE   MET  74           HE1      MET  74  -0.778   4.079   0.441
  588   2HE   MET  74           HE3      MET  74  -1.343   2.499  -0.115
  589   3HE   MET  74           HE2      MET  74  -0.645   3.641  -1.260
  590    H    ALA  75           HN       ALA  75  -3.074   3.138   4.534
  591    HA   ALA  75           HA       ALA  75  -1.634   0.680   4.401
  592   1HB   ALA  75           HB2      ALA  75  -2.956   2.052   6.764
  593   2HB   ALA  75           HB1      ALA  75  -1.835   0.698   6.898
  594   3HB   ALA  75           HB3      ALA  75  -1.281   2.238   6.244
  595    H    PHE  76           HN       PHE  76  -5.015   1.386   4.660
  596    HA   PHE  76           HA       PHE  76  -5.808  -1.206   5.721
  597   1HB   PHE  76           HB2      PHE  76  -7.121   1.260   4.807
  598   2HB   PHE  76           HB1      PHE  76  -8.011  -0.200   4.383
  599    HD1  PHE  76           HD2      PHE  76  -5.838   0.578   7.334
  600    HD2  PHE  76           HD1      PHE  76  -9.771  -0.405   5.921
  601    HE1  PHE  76           HE2      PHE  76  -6.632   0.384   9.677
  602    HE2  PHE  76           HE1      PHE  76 -10.565  -0.598   8.263
  603    HZ   PHE  76           HZ       PHE  76  -8.995  -0.204  10.141
  604    H    VAL  77           HN       VAL  77  -5.307   0.216   2.550
  605    HA   VAL  77           HA       VAL  77  -6.527  -1.904   1.014
  606    HB   VAL  77           HB       VAL  77  -4.427   0.173   0.337
  607   1HG1  VAL  77          HG11      VAL  77  -4.460  -1.993  -1.089
  608   2HG1  VAL  77          HG13      VAL  77  -6.018  -1.409  -1.675
  609   3HG1  VAL  77          HG12      VAL  77  -4.562  -0.449  -1.933
  610   1HG2  VAL  77          HG22      VAL  77  -7.257   0.257   0.677
  611   2HG2  VAL  77          HG21      VAL  77  -6.195   1.550   0.123
  612   3HG2  VAL  77          HG23      VAL  77  -6.922   0.447  -1.044
  613    H    SER  78           HN       SER  78  -3.422  -1.464   2.548
  614    HA   SER  78           HA       SER  78  -2.093  -3.579   1.039
  615   1HB   SER  78           HB2      SER  78  -0.339  -3.318   2.841
  616   2HB   SER  78           HB1      SER  78  -0.714  -1.839   1.963
  617    HG   SER  78           HG       SER  78  -0.662  -1.711   4.337
  618    H    MET  79           HN       MET  79  -3.163  -3.324   4.455
  619    HA   MET  79           HA       MET  79  -2.609  -5.937   5.268
  620   1HB   MET  79           HB2      MET  79  -5.266  -4.935   6.136
  621   2HB   MET  79           HB1      MET  79  -3.924  -5.539   7.100
  622   1HG   MET  79           HG2      MET  79  -2.726  -3.342   6.427
  623   2HG   MET  79           HG1      MET  79  -4.336  -2.779   5.977
  624   1HE   MET  79           HE2      MET  79  -2.534  -1.518   7.597
  625   2HE   MET  79           HE1      MET  79  -3.649  -0.815   8.767
  626   3HE   MET  79           HE3      MET  79  -2.345  -1.880   9.311
  627    H    VAL  80           HN       VAL  80  -5.597  -4.787   3.701
  628    HA   VAL  80           HA       VAL  80  -6.796  -7.392   3.560
  629    HB   VAL  80           HB       VAL  80  -8.366  -6.308   2.000
  630   1HG1  VAL  80          HG13      VAL  80  -7.528  -4.695   4.422
  631   2HG1  VAL  80          HG12      VAL  80  -9.024  -4.406   3.535
  632   3HG1  VAL  80          HG11      VAL  80  -8.768  -5.946   4.353
  633   1HG2  VAL  80          HG22      VAL  80  -6.255  -4.152   2.055
  634   2HG2  VAL  80          HG21      VAL  80  -6.981  -4.932   0.650
  635   3HG2  VAL  80          HG23      VAL  80  -7.925  -3.797   1.615
  636    H    THR  81           HN       THR  81  -5.065  -5.431   1.112
  637    HA   THR  81           HA       THR  81  -5.243  -7.444  -0.940
  638    HB   THR  81           HB       THR  81  -3.134  -5.285  -0.683
  639    HG1  THR  81           HG1      THR  81  -5.616  -4.860  -0.646
  640   1HG2  THR  81          HG23      THR  81  -4.299  -6.832  -3.010
  641   2HG2  THR  81          HG22      THR  81  -3.266  -5.415  -3.196
  642   3HG2  THR  81          HG21      THR  81  -2.634  -6.873  -2.432
  643    H    THR  82           HN       THR  82  -3.516  -7.435   1.940
  644    HA   THR  82           HA       THR  82  -1.496  -9.320   0.788
  645    HB   THR  82           HB       THR  82  -0.020  -8.685   2.655
  646    HG1  THR  82           HG1      THR  82  -1.836  -8.124   4.046
  647   1HG2  THR  82          HG23      THR  82  -0.856  -6.987   0.506
  648   2HG2  THR  82          HG22      THR  82  -0.470  -5.979   1.900
  649   3HG2  THR  82          HG21      THR  82   0.734  -7.097   1.259
  650    H    ALA  83           HN       ALA  83  -4.211  -9.033   2.781
  651    HA   ALA  83           HA       ALA  83  -3.547 -11.000   4.793
  652   1HB   ALA  83           HB3      ALA  83  -6.086  -9.737   3.802
  653   2HB   ALA  83           HB2      ALA  83  -6.171 -11.141   4.866
  654   3HB   ALA  83           HB1      ALA  83  -5.365  -9.671   5.411
  655    H    CYS  84           HN       CYS  84  -5.726 -11.228   1.955
  656    HA   CYS  84           HA       CYS  84  -6.266 -13.941   1.990
  657   1HB   CYS  84           HB2      CYS  84  -6.441 -11.869   0.080
  658   2HB   CYS  84           HB1      CYS  84  -5.587 -13.191  -0.716
  659    HG   CYS  84           HG       CYS  84  -8.526 -13.202   0.011
  660    H    HIS  85           HN       HIS  85  -5.244 -15.801   1.000
  661    HA   HIS  85           HA       HIS  85  -2.393 -15.908   1.434
  662   1HB   HIS  85           HB2      HIS  85  -4.459 -17.770   1.152
  663   2HB   HIS  85           HB1      HIS  85  -3.418 -18.051  -0.245
  664    HD1  HIS  85           HD1      HIS  85  -3.188 -20.317   1.535
  665    HD2  HIS  85           HD2      HIS  85  -1.046 -16.836   2.346
  666    HE1  HIS  85           HE1      HIS  85  -1.303 -20.981   3.089
  667    H    GLU  86           HN       GLU  86  -0.732 -16.129  -0.149
  668    HA   GLU  86           HA       GLU  86   0.317 -15.720  -2.212
  669   1HB   GLU  86           HB2      GLU  86  -2.422 -16.001  -3.464
  670   2HB   GLU  86           HB1      GLU  86  -0.853 -16.297  -4.215
  671   1HG   GLU  86           HG2      GLU  86  -1.451 -17.868  -1.766
  672   2HG   GLU  86           HG1      GLU  86  -2.385 -18.281  -3.205
  673    H    PHE  87           HN       PHE  87  -0.120 -14.167  -4.292
  674    HA   PHE  87           HA       PHE  87  -1.726 -11.815  -3.578
  675   1HB   PHE  87           HB2      PHE  87   0.649 -10.540  -4.134
  676   2HB   PHE  87           HB1      PHE  87  -0.023 -10.765  -2.524
  677    HD1  PHE  87           HD1      PHE  87   2.105 -12.529  -5.061
  678    HD2  PHE  87           HD2      PHE  87   1.204 -11.915  -0.905
  679    HE1  PHE  87           HE1      PHE  87   4.048 -13.932  -4.434
  680    HE2  PHE  87           HE2      PHE  87   3.149 -13.317  -0.277
  681    HZ   PHE  87           HZ       PHE  87   4.572 -14.325  -2.039
  682    H    PHE  88           HN       PHE  88   0.601 -13.320  -5.823
  683    HA   PHE  88           HA       PHE  88  -0.912 -11.979  -8.021
  684   1HB   PHE  88           HB2      PHE  88   1.758 -12.550  -8.907
  685   2HB   PHE  88           HB1      PHE  88   0.927 -11.001  -8.860
  686    HD1  PHE  88           HD1      PHE  88   0.764  -9.900  -6.448
  687    HD2  PHE  88           HD2      PHE  88   3.674 -12.837  -7.613
  688    HE1  PHE  88           HE1      PHE  88   2.260  -9.145  -4.622
  689    HE2  PHE  88           HE2      PHE  88   5.164 -12.081  -5.780
  690    HZ   PHE  88           HZ       PHE  88   4.457 -10.235  -4.287
  691    H    GLU  89           HN       GLU  89  -1.609 -14.506  -7.168
  692    HA   GLU  89           HA       GLU  89  -0.207 -16.429  -8.925
  693   1HB   GLU  89           HB2      GLU  89  -1.164 -16.847  -6.490
  694   2HB   GLU  89           HB1      GLU  89  -2.663 -17.139  -7.373
  695   1HG   GLU  89           HG2      GLU  89  -0.948 -18.572  -8.901
  696   2HG   GLU  89           HG1      GLU  89  -0.155 -18.727  -7.334
  697    H    HIS  90           HN       HIS  90  -3.591 -15.462  -8.360
  698    HA   HIS  90           HA       HIS  90  -5.446 -15.661  -9.807
  699   1HB   HIS  90           HB2      HIS  90  -4.820 -14.507 -12.100
  700   2HB   HIS  90           HB1      HIS  90  -4.878 -13.559 -10.615
  701    HD1  HIS  90           HD1      HIS  90  -2.632 -14.565 -13.328
  702    HD2  HIS  90           HD2      HIS  90  -2.190 -13.164  -9.426
  703    HE1  HIS  90           HE1      HIS  90  -0.238 -13.770 -13.118
  704    H    GLU  91           HN       GLU  91  -5.426 -18.002  -9.977
  705    HA   GLU  91           HA       GLU  91  -3.969 -19.186 -12.255
  706   1HB   GLU  91           HB2      GLU  91  -4.828 -20.172  -9.797
  707   2HB   GLU  91           HB1      GLU  91  -5.948 -20.897 -10.950
  708   1HG   GLU  91           HG2      GLU  91  -3.117 -20.900 -11.802
  709   2HG   GLU  91           HG1      GLU  91  -3.474 -21.911 -10.401
  710   1H    MET   0           HT3      MET   0 -10.669  -4.972 -14.006
  711   2H    MET   0           HT2      MET   0 -10.984  -4.671 -15.650
  712   3H    MET   0           HT1      MET   0  -9.917  -5.913 -15.200
  713    HA   MET   0           HA       MET   0  -8.288  -4.403 -14.452
  714   1HB   MET   0           HB2      MET   0  -7.858  -3.097 -16.487
  715   2HB   MET   0           HB1      MET   0  -8.442  -4.706 -16.915
  716   1HG   MET   0           HG2      MET   0 -10.729  -3.054 -16.576
  717   2HG   MET   0           HG1      MET   0  -9.588  -2.159 -17.580
  718   1HE   MET   0           HE2      MET   0 -11.269  -2.036 -19.044
  719   2HE   MET   0           HE1      MET   0 -11.129  -2.971 -20.531
  720   3HE   MET   0           HE3      MET   0 -12.412  -3.336 -19.367
  721    H    SER   1           HN       SER   1  -9.465  -3.423 -12.541
  722    HA   SER   1           HA       SER   1 -10.741  -0.815 -13.065
  723   1HB   SER   1           HB2      SER   1 -11.415  -0.850 -10.808
  724   2HB   SER   1           HB1      SER   1 -11.457  -2.549 -11.265
  725    HG   SER   1           HG       SER   1  -9.483  -1.145  -9.803
  726    H    GLU   2           HN       GLU   2  -9.930   0.849 -11.151
  727    HA   GLU   2           HA       GLU   2  -7.201   1.505 -11.962
  728   1HB   GLU   2           HB2      GLU   2  -9.248   3.088 -11.397
  729   2HB   GLU   2           HB1      GLU   2  -8.624   2.948  -9.753
  730   1HG   GLU   2           HG2      GLU   2  -6.578   3.947 -10.307
  731   2HG   GLU   2           HG1      GLU   2  -6.762   3.600 -12.027
  732    H    LEU   3           HN       LEU   3  -8.801   0.400  -8.989
  733    HA   LEU   3           HA       LEU   3  -6.346   0.537  -7.422
  734   1HB   LEU   3           HB2      LEU   3  -8.776   0.647  -6.555
  735   2HB   LEU   3           HB1      LEU   3  -8.777  -1.106  -6.728
  736    HG   LEU   3           HG       LEU   3  -6.721  -1.201  -5.311
  737   1HD1  LEU   3          HD12      LEU   3  -7.021   1.707  -5.593
  738   2HD1  LEU   3          HD11      LEU   3  -6.761   1.186  -3.928
  739   3HD1  LEU   3          HD13      LEU   3  -5.593   0.759  -5.179
  740   1HD2  LEU   3          HD21      LEU   3  -9.394  -0.288  -4.432
  741   2HD2  LEU   3          HD23      LEU   3  -8.456  -1.685  -3.908
  742   3HD2  LEU   3          HD22      LEU   3  -8.112  -0.091  -3.238
  743    H    GLU   4           HN       GLU   4  -8.325  -2.149  -8.683
  744    HA   GLU   4           HA       GLU   4  -6.629  -4.248  -7.868
  745   1HB   GLU   4           HB2      GLU   4  -8.864  -4.653  -8.783
  746   2HB   GLU   4           HB1      GLU   4  -8.344  -4.066 -10.363
  747   1HG   GLU   4           HG2      GLU   4  -6.549  -6.121  -9.367
  748   2HG   GLU   4           HG1      GLU   4  -8.209  -6.708  -9.445
  749    H    LYS   5           HN       LYS   5  -6.387  -2.133 -10.698
  750    HA   LYS   5           HA       LYS   5  -4.200  -3.692 -11.855
  751   1HB   LYS   5           HB2      LYS   5  -5.964  -1.975 -12.948
  752   2HB   LYS   5           HB1      LYS   5  -4.621  -0.865 -12.675
  753   1HG   LYS   5           HG2      LYS   5  -4.072  -1.688 -14.778
  754   2HG   LYS   5           HG1      LYS   5  -3.198  -2.820 -13.746
  755   1HD   LYS   5           HD2      LYS   5  -4.694  -4.546 -14.130
  756   2HD   LYS   5           HD1      LYS   5  -6.037  -3.449 -14.449
  757   1HE   LYS   5           HE2      LYS   5  -5.027  -2.819 -16.605
  758   2HE   LYS   5           HE1      LYS   5  -3.664  -3.892 -16.287
  759   1HZ   LYS   5           HZ1      LYS   5  -5.349  -5.717 -16.083
  760   2HZ   LYS   5           HZ3      LYS   5  -6.499  -4.638 -16.705
  761   3HZ   LYS   5           HZ2      LYS   5  -5.156  -5.080 -17.646
  762    H    ALA   6           HN       ALA   6  -4.418  -0.458 -10.312
  763    HA   ALA   6           HA       ALA   6  -1.538  -0.131 -10.278
  764   1HB   ALA   6           HB3      ALA   6  -3.155   1.775 -10.236
  765   2HB   ALA   6           HB2      ALA   6  -3.619   1.301  -8.601
  766   3HB   ALA   6           HB1      ALA   6  -1.974   1.845  -8.929
  767    H    MET   7           HN       MET   7  -3.831  -0.482  -7.554
  768    HA   MET   7           HA       MET   7  -2.035  -0.886  -5.492
  769   1HB   MET   7           HB2      MET   7  -4.494  -0.829  -5.196
  770   2HB   MET   7           HB1      MET   7  -4.609  -2.435  -5.919
  771   1HG   MET   7           HG2      MET   7  -4.607  -2.475  -3.409
  772   2HG   MET   7           HG1      MET   7  -3.281  -3.392  -4.122
  773   1HE   MET   7           HE3      MET   7  -2.922  -3.329  -1.757
  774   2HE   MET   7           HE2      MET   7  -1.227  -2.857  -1.691
  775   3HE   MET   7           HE1      MET   7  -2.423  -1.959  -0.759
  776    H    VAL   8           HN       VAL   8  -3.278  -3.395  -7.700
  777    HA   VAL   8           HA       VAL   8  -1.650  -5.485  -6.533
  778    HB   VAL   8           HB       VAL   8  -2.919  -5.384  -9.286
  779   1HG1  VAL   8          HG12      VAL   8  -1.791  -7.574  -7.538
  780   2HG1  VAL   8          HG11      VAL   8  -2.959  -7.919  -8.813
  781   3HG1  VAL   8          HG13      VAL   8  -1.398  -7.204  -9.217
  782   1HG2  VAL   8          HG23      VAL   8  -4.532  -4.961  -7.425
  783   2HG2  VAL   8          HG22      VAL   8  -4.825  -6.504  -8.227
  784   3HG2  VAL   8          HG21      VAL   8  -4.010  -6.463  -6.663
  785    H    ALA   9           HN       ALA   9  -1.166  -3.145  -9.121
  786    HA   ALA   9           HA       ALA   9   1.059  -4.377 -10.402
  787   1HB   ALA   9           HB3      ALA   9   0.191  -1.511 -10.068
  788   2HB   ALA   9           HB2      ALA   9   1.697  -1.910 -10.895
  789   3HB   ALA   9           HB1      ALA   9   0.163  -2.507 -11.522
  790    H    LEU  10           HN       LEU  10   1.061  -1.886  -7.823
  791    HA   LEU  10           HA       LEU  10   3.834  -1.808  -7.377
  792   1HB   LEU  10           HB2      LEU  10   2.849  -0.190  -6.102
  793   2HB   LEU  10           HB1      LEU  10   1.391  -1.136  -5.852
  794    HG   LEU  10           HG       LEU  10   2.747  -0.631  -3.766
  795   1HD1  LEU  10          HD12      LEU  10   1.338  -2.912  -4.553
  796   2HD1  LEU  10          HD11      LEU  10   2.785  -3.526  -3.756
  797   3HD1  LEU  10          HD13      LEU  10   1.714  -2.416  -2.906
  798   1HD2  LEU  10          HD23      LEU  10   4.805  -1.851  -5.383
  799   2HD2  LEU  10          HD22      LEU  10   4.953  -1.068  -3.809
  800   3HD2  LEU  10          HD21      LEU  10   4.571  -2.786  -3.906
  801    H    ILE  11           HN       ILE  11   1.425  -4.089  -6.085
  802    HA   ILE  11           HA       ILE  11   3.253  -5.497  -4.378
  803    HB   ILE  11           HB       ILE  11   1.122  -7.106  -5.686
  804   1HG1  ILE  11          HG12      ILE  11   0.563  -4.604  -4.072
  805   2HG1  ILE  11          HG11      ILE  11  -0.091  -5.045  -5.649
  806   1HG2  ILE  11          HG21      ILE  11   2.641  -7.489  -3.535
  807   2HG2  ILE  11          HG23      ILE  11   1.370  -6.549  -2.753
  808   3HG2  ILE  11          HG22      ILE  11   0.972  -8.057  -3.576
  809   1HD1  ILE  11          HD13      ILE  11  -0.715  -7.175  -3.882
  810   2HD1  ILE  11          HD12      ILE  11  -1.127  -5.679  -3.042
  811   3HD1  ILE  11          HD11      ILE  11  -1.832  -6.027  -4.622
  812    H    ASP  12           HN       ASP  12   2.464  -5.759  -7.804
  813    HA   ASP  12           HA       ASP  12   3.811  -8.179  -8.400
  814   1HB   ASP  12           HB2      ASP  12   2.413  -6.489  -9.906
  815   2HB   ASP  12           HB1      ASP  12   4.015  -5.863 -10.286
  816    H    VAL  13           HN       VAL  13   5.018  -4.829  -8.206
  817    HA   VAL  13           HA       VAL  13   7.673  -5.205  -8.992
  818    HB   VAL  13           HB       VAL  13   6.465  -3.486  -6.815
  819   1HG1  VAL  13          HG13      VAL  13   9.340  -4.025  -7.421
  820   2HG1  VAL  13          HG12      VAL  13   8.872  -2.357  -7.090
  821   3HG1  VAL  13          HG11      VAL  13   8.575  -3.611  -5.886
  822   1HG2  VAL  13          HG21      VAL  13   7.410  -3.153  -9.637
  823   2HG2  VAL  13          HG23      VAL  13   5.973  -2.497  -8.854
  824   3HG2  VAL  13          HG22      VAL  13   7.552  -1.779  -8.543
  825    H    PHE  14           HN       PHE  14   6.172  -5.926  -5.842
  826    HA   PHE  14           HA       PHE  14   8.408  -6.729  -4.378
  827   1HB   PHE  14           HB2      PHE  14   6.059  -6.745  -3.516
  828   2HB   PHE  14           HB1      PHE  14   5.759  -8.203  -4.462
  829    HD1  PHE  14           HD2      PHE  14   8.095  -6.813  -1.887
  830    HD2  PHE  14           HD1      PHE  14   6.235 -10.309  -3.547
  831    HE1  PHE  14           HE2      PHE  14   9.074  -8.195  -0.075
  832    HE2  PHE  14           HE1      PHE  14   7.213 -11.689  -1.736
  833    HZ   PHE  14           HZ       PHE  14   8.634 -10.633   0.001
  834    H    HIS  15           HN       HIS  15   6.498  -8.728  -6.646
  835    HA   HIS  15           HA       HIS  15   8.121 -11.061  -6.445
  836   1HB   HIS  15           HB2      HIS  15   5.936 -11.137  -7.528
  837   2HB   HIS  15           HB1      HIS  15   6.485 -10.022  -8.780
  838    HD1  HIS  15           HD1      HIS  15   7.330 -11.118 -10.850
  839    HD2  HIS  15           HD2      HIS  15   7.675 -13.632  -7.542
  840    HE1  HIS  15           HE1      HIS  15   8.231 -13.320 -11.717
  841    H    GLN  16           HN       GLN  16   8.428  -8.149  -8.436
  842    HA   GLN  16           HA       GLN  16  10.438  -8.998 -10.227
  843   1HB   GLN  16           HB2      GLN  16   9.195  -6.700 -10.005
  844   2HB   GLN  16           HB1      GLN  16  10.553  -6.270  -8.966
  845   1HG   GLN  16           HG2      GLN  16  12.034  -6.213 -10.701
  846   2HG   GLN  16           HG1      GLN  16  11.278  -7.579 -11.524
  847   1HE2  GLN  16          HE22      GLN  16  10.102  -3.774 -12.418
  848   2HE2  GLN  16          HE21      GLN  16  11.174  -4.062 -11.135
  849    H    TYR  17           HN       TYR  17  10.869  -7.446  -7.028
  850    HA   TYR  17           HA       TYR  17  13.730  -8.149  -7.067
  851   1HB   TYR  17           HB2      TYR  17  12.076  -6.823  -4.895
  852   2HB   TYR  17           HB1      TYR  17  13.836  -6.917  -4.952
  853    HD1  TYR  17           HD2      TYR  17  15.068  -5.802  -6.874
  854    HD2  TYR  17           HD1      TYR  17  10.898  -5.140  -6.089
  855    HE1  TYR  17           HE2      TYR  17  15.135  -3.744  -8.257
  856    HE2  TYR  17           HE1      TYR  17  10.965  -3.082  -7.472
  857    HH   TYR  17           HH       TYR  17  13.144  -2.398  -9.646
  858    H    SER  18           HN       SER  18  10.964  -9.813  -6.394
  859    HA   SER  18           HA       SER  18  12.392 -11.540  -4.418
  860   1HB   SER  18           HB2      SER  18  10.377 -10.096  -3.558
  861   2HB   SER  18           HB1      SER  18   9.396 -11.286  -4.407
  862    HG   SER  18           HG       SER  18   9.761 -11.921  -2.260
  863    H    GLY  19           HN       GLY  19  12.042 -11.639  -7.408
  864   1HA   GLY  19           HA2      GLY  19  10.801 -14.342  -7.509
  865   2HA   GLY  19           HA1      GLY  19  10.497 -13.164  -8.783
  866    H    ARG  20           HN       ARG  20  13.589 -12.593  -7.837
  867    HA   ARG  20           HA       ARG  20  14.879 -13.328 -10.171
  868   1HB   ARG  20           HB2      ARG  20  15.731 -12.870  -7.382
  869   2HB   ARG  20           HB1      ARG  20  16.841 -13.861  -8.328
  870   1HG   ARG  20           HG2      ARG  20  17.324 -12.157  -9.812
  871   2HG   ARG  20           HG1      ARG  20  15.749 -11.390  -9.604
  872   1HD   ARG  20           HD2      ARG  20  16.979  -9.899  -8.372
  873   2HD   ARG  20           HD1      ARG  20  16.710 -11.092  -7.101
  874    HE   ARG  20           HE       ARG  20  19.014 -11.558  -7.165
  875   1HH1  ARG  20          HH21      ARG  20  20.019 -12.668  -9.339
  876   2HH1  ARG  20          HH22      ARG  20  20.693 -11.439 -10.357
  877   1HH2  ARG  20          HH11      ARG  20  18.992  -8.848  -8.803
  878   2HH2  ARG  20          HH12      ARG  20  20.111  -9.277 -10.054
  879    H    GLU  21           HN       GLU  21  15.857 -15.274  -7.412
  880    HA   GLU  21           HA       GLU  21  15.223 -17.722  -9.011
  881   1HB   GLU  21           HB2      GLU  21  17.629 -17.381  -9.005
  882   2HB   GLU  21           HB1      GLU  21  17.629 -17.155  -7.256
  883   1HG   GLU  21           HG2      GLU  21  17.178 -19.417  -6.833
  884   2HG   GLU  21           HG1      GLU  21  16.538 -19.689  -8.454
  885    H    GLY  22           HN       GLY  22  16.514 -17.393  -5.719
  886   1HA   GLY  22           HA2      GLY  22  14.437 -19.189  -4.717
  887   2HA   GLY  22           HA1      GLY  22  15.738 -18.478  -3.762
  888    H    ASP  23           HN       ASP  23  14.434 -17.696  -2.083
  889    HA   ASP  23           HA       ASP  23  12.616 -16.517  -1.103
  890   1HB   ASP  23           HB2      ASP  23  13.787 -14.193  -2.553
  891   2HB   ASP  23           HB1      ASP  23  13.404 -14.381  -0.846
  892    H    LYS  24           HN       LYS  24  10.977 -17.519  -2.662
  893    HA   LYS  24           HA       LYS  24  10.089 -15.797  -4.866
  894   1HB   LYS  24           HB2      LYS  24   9.917 -18.453  -4.513
  895   2HB   LYS  24           HB1      LYS  24   8.360 -17.990  -3.825
  896   1HG   LYS  24           HG2      LYS  24   7.588 -17.087  -5.837
  897   2HG   LYS  24           HG1      LYS  24   9.218 -16.845  -6.468
  898   1HD   LYS  24           HD2      LYS  24   8.797 -18.749  -7.643
  899   2HD   LYS  24           HD1      LYS  24   9.189 -19.554  -6.124
  900   1HE   LYS  24           HE2      LYS  24   6.885 -19.742  -5.517
  901   2HE   LYS  24           HE1      LYS  24   6.389 -18.635  -6.798
  902   1HZ   LYS  24           HZ2      LYS  24   7.870 -21.012  -7.602
  903   2HZ   LYS  24           HZ1      LYS  24   6.276 -21.251  -7.065
  904   3HZ   LYS  24           HZ3      LYS  24   6.583 -20.220  -8.377
  905    H    HIS  25           HN       HIS  25   9.565 -15.961  -1.500
  906    HA   HIS  25           HA       HIS  25   7.379 -13.980  -1.758
  907   1HB   HIS  25           HB2      HIS  25   6.853 -15.875   0.413
  908   2HB   HIS  25           HB1      HIS  25   5.750 -15.229  -0.796
  909    HD1  HIS  25           HD1      HIS  25   8.401 -17.925  -0.415
  910    HD2  HIS  25           HD2      HIS  25   5.155 -17.006  -2.860
  911    HE1  HIS  25           HE1      HIS  25   8.051 -19.928  -1.922
  912    H    LYS  26           HN       LYS  26  10.244 -13.984  -0.909
  913    HA   LYS  26           HA       LYS  26   9.802 -12.640   1.695
  914   1HB   LYS  26           HB2      LYS  26  11.891 -13.818   2.581
  915   2HB   LYS  26           HB1      LYS  26  10.432 -14.802   2.481
  916   1HG   LYS  26           HG2      LYS  26  11.583 -15.088  -0.036
  917   2HG   LYS  26           HG1      LYS  26  12.966 -15.098   1.056
  918   1HD   LYS  26           HD2      LYS  26  10.503 -16.848   1.302
  919   2HD   LYS  26           HD1      LYS  26  12.098 -17.378   0.768
  920   1HE   LYS  26           HE2      LYS  26  12.867 -17.522   2.888
  921   2HE   LYS  26           HE1      LYS  26  12.194 -15.949   3.317
  922   1HZ   LYS  26           HZ1      LYS  26  10.527 -18.378   3.037
  923   2HZ   LYS  26           HZ3      LYS  26  11.231 -17.920   4.511
  924   3HZ   LYS  26           HZ2      LYS  26  10.105 -16.897   3.756
  925    H    LEU  27           HN       LEU  27  10.892 -10.753   1.709
  926    HA   LEU  27           HA       LEU  27  13.108 -10.411  -0.268
  927   1HB   LEU  27           HB2      LEU  27  10.786  -8.817   0.374
  928   2HB   LEU  27           HB1      LEU  27  12.248  -7.885   0.681
  929    HG   LEU  27           HG       LEU  27  11.457  -9.262  -1.896
  930   1HD1  LEU  27          HD12      LEU  27  11.936  -6.387  -1.080
  931   2HD1  LEU  27          HD11      LEU  27  11.791  -6.903  -2.760
  932   3HD1  LEU  27          HD13      LEU  27  10.430  -7.101  -1.655
  933   1HD2  LEU  27          HD22      LEU  27  14.101  -8.440  -0.842
  934   2HD2  LEU  27          HD21      LEU  27  13.707  -9.615  -2.095
  935   3HD2  LEU  27          HD23      LEU  27  13.741  -7.895  -2.480
  936    H    LYS  28           HN       LYS  28  14.052  -7.955   0.956
  937    HA   LYS  28           HA       LYS  28  14.890  -8.844   3.667
  938   1HB   LYS  28           HB2      LYS  28  16.684  -8.275   1.315
  939   2HB   LYS  28           HB1      LYS  28  17.261  -8.053   2.967
  940   1HG   LYS  28           HG2      LYS  28  16.969 -10.343   3.497
  941   2HG   LYS  28           HG1      LYS  28  15.939 -10.621   2.093
  942   1HD   LYS  28           HD2      LYS  28  17.949 -11.504   1.329
  943   2HD   LYS  28           HD1      LYS  28  18.081  -9.841   0.754
  944   1HE   LYS  28           HE2      LYS  28  19.122  -9.504   3.205
  945   2HE   LYS  28           HE1      LYS  28  19.533 -11.203   2.973
  946   1HZ   LYS  28           HZ3      LYS  28  20.048  -9.477   0.703
  947   2HZ   LYS  28           HZ2      LYS  28  21.013  -9.178   2.069
  948   3HZ   LYS  28           HZ1      LYS  28  20.995 -10.721   1.358
  949    H    LYS  29           HN       LYS  29  16.257  -6.969   4.684
  950    HA   LYS  29           HA       LYS  29  14.627  -4.571   4.539
  951   1HB   LYS  29           HB2      LYS  29  17.285  -4.926   5.947
  952   2HB   LYS  29           HB1      LYS  29  16.038  -3.734   6.311
  953   1HG   LYS  29           HG2      LYS  29  15.869  -6.734   6.672
  954   2HG   LYS  29           HG1      LYS  29  15.806  -5.498   7.929
  955   1HD   LYS  29           HD2      LYS  29  13.739  -4.600   6.640
  956   2HD   LYS  29           HD1      LYS  29  13.723  -6.184   5.865
  957   1HE   LYS  29           HE2      LYS  29  12.780  -7.110   7.685
  958   2HE   LYS  29           HE1      LYS  29  14.084  -6.508   8.706
  959   1HZ   LYS  29           HZ1      LYS  29  12.175  -4.513   7.850
  960   2HZ   LYS  29           HZ3      LYS  29  11.543  -5.699   8.885
  961   3HZ   LYS  29           HZ2      LYS  29  12.874  -4.766   9.377
  962    H    SER  30           HN       SER  30  17.761  -5.555   3.260
  963    HA   SER  30           HA       SER  30  18.555  -2.879   2.459
  964   1HB   SER  30           HB2      SER  30  20.211  -4.684   2.776
  965   2HB   SER  30           HB1      SER  30  19.489  -5.583   1.445
  966    HG   SER  30           HG       SER  30  20.927  -4.479   0.346
  967    H    GLU  31           HN       GLU  31  16.576  -5.397   1.054
  968    HA   GLU  31           HA       GLU  31  16.603  -4.104  -1.598
  969   1HB   GLU  31           HB2      GLU  31  16.402  -6.653  -1.160
  970   2HB   GLU  31           HB1      GLU  31  14.727  -6.306  -0.726
  971   1HG   GLU  31           HG2      GLU  31  14.140  -6.108  -2.892
  972   2HG   GLU  31           HG1      GLU  31  15.442  -4.956  -3.189
  973    H    LEU  32           HN       LEU  32  14.834  -4.010   1.355
  974    HA   LEU  32           HA       LEU  32  12.400  -2.889   0.167
  975   1HB   LEU  32           HB2      LEU  32  12.062  -4.069   2.221
  976   2HB   LEU  32           HB1      LEU  32  13.394  -3.224   3.009
  977    HG   LEU  32           HG       LEU  32  12.170  -1.144   3.004
  978   1HD1  LEU  32          HD13      LEU  32  10.738  -2.446   0.864
  979   2HD1  LEU  32          HD12      LEU  32   9.599  -1.861   2.076
  980   3HD1  LEU  32          HD11      LEU  32  10.733  -0.744   1.318
  981   1HD2  LEU  32          HD23      LEU  32  11.238  -3.517   4.294
  982   2HD2  LEU  32          HD22      LEU  32  11.094  -1.851   4.852
  983   3HD2  LEU  32          HD21      LEU  32   9.828  -2.557   3.848
  984    H    LYS  33           HN       LYS  33  15.310  -1.767   1.802
  985    HA   LYS  33           HA       LYS  33  14.608   1.000   2.030
  986   1HB   LYS  33           HB2      LYS  33  16.644  -0.405   2.974
  987   2HB   LYS  33           HB1      LYS  33  17.428   0.124   1.490
  988   1HG   LYS  33           HG2      LYS  33  16.394   2.479   2.267
  989   2HG   LYS  33           HG1      LYS  33  16.567   1.724   3.852
  990   1HD   LYS  33           HD2      LYS  33  18.879   1.577   3.684
  991   2HD   LYS  33           HD1      LYS  33  18.854   1.570   1.920
  992   1HE   LYS  33           HE2      LYS  33  17.700   4.026   2.726
  993   2HE   LYS  33           HE1      LYS  33  19.152   3.812   3.702
  994   1HZ   LYS  33           HZ3      LYS  33  20.151   3.104   1.411
  995   2HZ   LYS  33           HZ2      LYS  33  18.882   4.048   0.793
  996   3HZ   LYS  33           HZ1      LYS  33  20.031   4.742   1.832
  997    H    GLU  34           HN       GLU  34  16.056  -0.937  -0.519
  998    HA   GLU  34           HA       GLU  34  16.546   1.345  -2.274
  999   1HB   GLU  34           HB2      GLU  34  17.477  -0.223  -3.757
 1000   2HB   GLU  34           HB1      GLU  34  17.732  -0.998  -2.196
 1001   1HG   GLU  34           HG2      GLU  34  15.862  -2.455  -2.499
 1002   2HG   GLU  34           HG1      GLU  34  15.307  -1.558  -3.911
 1003    H    LEU  35           HN       LEU  35  14.143  -1.167  -1.889
 1004    HA   LEU  35           HA       LEU  35  12.569  -0.884  -4.176
 1005   1HB   LEU  35           HB2      LEU  35  12.303  -2.245  -1.849
 1006   2HB   LEU  35           HB1      LEU  35  11.115  -0.970  -1.578
 1007    HG   LEU  35           HG       LEU  35  10.096  -2.944  -2.668
 1008   1HD1  LEU  35          HD12      LEU  35   9.713  -0.323  -3.288
 1009   2HD1  LEU  35          HD11      LEU  35  10.094  -0.976  -4.882
 1010   3HD1  LEU  35          HD13      LEU  35   8.743  -1.634  -3.958
 1011   1HD2  LEU  35          HD23      LEU  35  12.384  -3.337  -3.938
 1012   2HD2  LEU  35          HD22      LEU  35  10.862  -3.824  -4.681
 1013   3HD2  LEU  35          HD21      LEU  35  11.635  -2.316  -5.165
 1014    H    ILE  36           HN       ILE  36  12.352   1.036  -1.172
 1015    HA   ILE  36           HA       ILE  36  10.431   2.882  -2.381
 1016    HB   ILE  36           HB       ILE  36  11.813   3.638   0.129
 1017   1HG1  ILE  36          HG12      ILE  36  10.340   1.040  -0.243
 1018   2HG1  ILE  36          HG11      ILE  36  11.786   1.369   0.704
 1019   1HG2  ILE  36          HG21      ILE  36   9.763   4.724  -0.956
 1020   2HG2  ILE  36          HG23      ILE  36   8.869   3.286  -0.464
 1021   3HG2  ILE  36          HG22      ILE  36   9.614   4.321   0.754
 1022   1HD1  ILE  36          HD11      ILE  36  10.163   2.918   2.095
 1023   2HD1  ILE  36          HD13      ILE  36   8.915   1.881   1.406
 1024   3HD1  ILE  36          HD12      ILE  36  10.197   1.181   2.393
 1025    H    ASN  37           HN       ASN  37  13.771   3.211  -1.138
 1026    HA   ASN  37           HA       ASN  37  14.055   5.917  -2.106
 1027   1HB   ASN  37           HB2      ASN  37  15.352   4.925  -0.212
 1028   2HB   ASN  37           HB1      ASN  37  16.223   3.940  -1.389
 1029   1HD2  ASN  37          HD22      ASN  37  18.300   6.591  -2.474
 1030   2HD2  ASN  37          HD21      ASN  37  17.845   4.970  -2.688
 1031    H    ASN  38           HN       ASN  38  13.803   3.204  -3.935
 1032    HA   ASN  38           HA       ASN  38  15.744   4.267  -5.950
 1033   1HB   ASN  38           HB2      ASN  38  16.185   1.933  -4.968
 1034   2HB   ASN  38           HB1      ASN  38  14.769   1.412  -5.878
 1035   1HD2  ASN  38          HD22      ASN  38  17.213   0.789  -8.423
 1036   2HD2  ASN  38          HD21      ASN  38  16.318   0.057  -7.180
 1037    H    GLU  39           HN       GLU  39  13.020   1.961  -6.175
 1038    HA   GLU  39           HA       GLU  39  12.177   2.971  -8.713
 1039   1HB   GLU  39           HB2      GLU  39  10.814   1.280  -6.613
 1040   2HB   GLU  39           HB1      GLU  39  10.006   1.732  -8.114
 1041   1HG   GLU  39           HG2      GLU  39  11.132  -0.476  -8.292
 1042   2HG   GLU  39           HG1      GLU  39  11.794   0.700  -9.427
 1043    H    LEU  40           HN       LEU  40  11.029   3.646  -5.403
 1044    HA   LEU  40           HA       LEU  40   8.963   5.459  -6.344
 1045   1HB   LEU  40           HB2      LEU  40   9.169   4.130  -4.071
 1046   2HB   LEU  40           HB1      LEU  40  10.029   5.565  -3.538
 1047    HG   LEU  40           HG       LEU  40   7.419   5.884  -4.969
 1048   1HD1  LEU  40          HD13      LEU  40   7.189   4.149  -3.106
 1049   2HD1  LEU  40          HD12      LEU  40   7.623   5.435  -1.982
 1050   3HD1  LEU  40          HD11      LEU  40   6.160   5.573  -2.955
 1051   1HD2  LEU  40          HD22      LEU  40   9.152   7.418  -3.067
 1052   2HD2  LEU  40          HD21      LEU  40   8.348   7.967  -4.538
 1053   3HD2  LEU  40          HD23      LEU  40   7.416   7.731  -3.058
 1054    H    SER  41           HN       SER  41  11.322   6.571  -3.940
 1055    HA   SER  41           HA       SER  41  12.233   8.764  -3.822
 1056   1HB   SER  41           HB2      SER  41  13.884   7.084  -4.875
 1057   2HB   SER  41           HB1      SER  41  13.518   7.880  -6.403
 1058    HG   SER  41           HG       SER  41  15.256   8.648  -4.655
 1059    H    HIS  42           HN       HIS  42  10.596  10.308  -4.245
 1060    HA   HIS  42           HA       HIS  42  10.886  11.808  -6.683
 1061   1HB   HIS  42           HB2      HIS  42   9.371   9.641  -7.166
 1062   2HB   HIS  42           HB1      HIS  42   8.120  10.717  -6.540
 1063    HD1  HIS  42           HD1      HIS  42  10.023  13.206  -7.773
 1064    HD2  HIS  42           HD2      HIS  42   8.086  10.112  -9.781
 1065    HE1  HIS  42           HE1      HIS  42   9.721  13.983 -10.165
 1066    H    PHE  43           HN       PHE  43   8.311  11.022  -4.311
 1067    HA   PHE  43           HA       PHE  43   7.634  13.864  -4.070
 1068   1HB   PHE  43           HB2      PHE  43   6.628  11.727  -2.210
 1069   2HB   PHE  43           HB1      PHE  43   5.795  13.162  -2.805
 1070    HD1  PHE  43           HD2      PHE  43   5.527  13.269  -5.454
 1071    HD2  PHE  43           HD1      PHE  43   6.116   9.672  -3.182
 1072    HE1  PHE  43           HE2      PHE  43   4.561  11.939  -7.311
 1073    HE2  PHE  43           HE1      PHE  43   5.150   8.342  -5.039
 1074    HZ   PHE  43           HZ       PHE  43   4.372   9.476  -7.103
 1075    H    LEU  44           HN       LEU  44  10.079  11.997  -2.825
 1076    HA   LEU  44           HA       LEU  44  10.073  12.887  -0.069
 1077   1HB   LEU  44           HB2      LEU  44  11.784  11.289  -1.810
 1078   2HB   LEU  44           HB1      LEU  44  12.723  12.339  -0.748
 1079    HG   LEU  44           HG       LEU  44  10.580  11.234   0.784
 1080   1HD1  LEU  44          HD13      LEU  44  11.384   9.486  -1.304
 1081   2HD1  LEU  44          HD12      LEU  44  12.104   8.871   0.183
 1082   3HD1  LEU  44          HD11      LEU  44  10.360   9.110   0.081
 1083   1HD2  LEU  44          HD23      LEU  44  13.294  11.816   1.023
 1084   2HD2  LEU  44          HD22      LEU  44  12.277  11.102   2.274
 1085   3HD2  LEU  44          HD21      LEU  44  13.224  10.065   1.208
 1086    H    GLU  45           HN       GLU  45   9.972  15.118   0.116
 1087    HA   GLU  45           HA       GLU  45  12.261  16.625  -1.075
 1088   1HB   GLU  45           HB2      GLU  45   9.782  18.152  -0.544
 1089   2HB   GLU  45           HB1      GLU  45  10.903  18.265  -1.901
 1090   1HG   GLU  45           HG2      GLU  45   9.956  16.060  -2.729
 1091   2HG   GLU  45           HG1      GLU  45   8.706  16.224  -1.495
 1092    H    GLU  46           HN       GLU  46   9.644  17.115   1.299
 1093    HA   GLU  46           HA       GLU  46  11.729  18.091   3.211
 1094   1HB   GLU  46           HB2      GLU  46   9.939  19.478   4.223
 1095   2HB   GLU  46           HB1      GLU  46  10.194  19.887   2.526
 1096   1HG   GLU  46           HG2      GLU  46   8.317  18.216   2.007
 1097   2HG   GLU  46           HG1      GLU  46   7.956  18.255   3.733
 1098    H    ILE  47           HN       ILE  47   8.972  16.010   2.689
 1099    HA   ILE  47           HA       ILE  47   8.170  14.215   3.971
 1100    HB   ILE  47           HB       ILE  47  10.588  14.710   5.728
 1101   1HG1  ILE  47          HG12      ILE  47  10.828  12.560   3.785
 1102   2HG1  ILE  47          HG11      ILE  47  10.569  14.110   2.984
 1103   1HG2  ILE  47          HG23      ILE  47   8.798  12.324   5.206
 1104   2HG2  ILE  47          HG22      ILE  47  10.339  12.214   6.057
 1105   3HG2  ILE  47          HG21      ILE  47   9.026  13.177   6.734
 1106   1HD1  ILE  47          HD11      ILE  47  12.570  13.866   5.220
 1107   2HD1  ILE  47          HD13      ILE  47  13.009  13.413   3.573
 1108   3HD1  ILE  47          HD12      ILE  47  12.498  15.063   3.927
 1109    H    LYS  48           HN       LYS  48   6.343  14.710   5.090
 1110    HA   LYS  48           HA       LYS  48   6.430  16.790   7.189
 1111   1HB   LYS  48           HB2      LYS  48   4.560  16.441   5.379
 1112   2HB   LYS  48           HB1      LYS  48   3.979  15.198   6.487
 1113   1HG   LYS  48           HG2      LYS  48   4.677  17.726   7.818
 1114   2HG   LYS  48           HG1      LYS  48   3.351  17.873   6.664
 1115   1HD   LYS  48           HD2      LYS  48   2.798  15.499   8.013
 1116   2HD   LYS  48           HD1      LYS  48   3.391  16.575   9.279
 1117   1HE   LYS  48           HE2      LYS  48   1.502  17.801   9.226
 1118   2HE   LYS  48           HE1      LYS  48   1.599  17.977   7.473
 1119   1HZ   LYS  48           HZ3      LYS  48   0.672  15.479   8.757
 1120   2HZ   LYS  48           HZ2      LYS  48  -0.393  16.749   8.385
 1121   3HZ   LYS  48           HZ1      LYS  48   0.470  15.970   7.145
 1122    H    GLU  49           HN       GLU  49   5.695  13.326   6.848
 1123    HA   GLU  49           HA       GLU  49   5.383  13.051   9.771
 1124   1HB   GLU  49           HB2      GLU  49   4.922  11.338   7.381
 1125   2HB   GLU  49           HB1      GLU  49   5.357  10.506   8.874
 1126   1HG   GLU  49           HG2      GLU  49   3.150  12.572   8.700
 1127   2HG   GLU  49           HG1      GLU  49   2.873  10.836   8.557
 1128    H    GLN  50           HN       GLN  50   7.796  13.960   9.695
 1129    HA   GLN  50           HA       GLN  50   9.995  12.427   8.915
 1130   1HB   GLN  50           HB2      GLN  50   9.967  14.718  10.080
 1131   2HB   GLN  50           HB1      GLN  50   9.879  13.819  11.596
 1132   1HG   GLN  50           HG2      GLN  50  11.943  12.586  10.951
 1133   2HG   GLN  50           HG1      GLN  50  12.051  13.572   9.493
 1134   1HE2  GLN  50          HE22      GLN  50  13.346  16.401  11.179
 1135   2HE2  GLN  50          HE21      GLN  50  12.774  15.771   9.710
 1136    H    GLU  51           HN       GLU  51   7.678  11.757  11.417
 1137    HA   GLU  51           HA       GLU  51   9.357   9.828  12.827
 1138   1HB   GLU  51           HB2      GLU  51   7.308  11.157  13.735
 1139   2HB   GLU  51           HB1      GLU  51   6.348   9.896  12.962
 1140   1HG   GLU  51           HG2      GLU  51   7.768   8.202  14.210
 1141   2HG   GLU  51           HG1      GLU  51   8.436   9.552  15.126
 1142    H    VAL  52           HN       VAL  52   6.730   9.657  10.424
 1143    HA   VAL  52           HA       VAL  52   6.522   6.814  10.360
 1144    HB   VAL  52           HB       VAL  52   6.011   8.885   8.206
 1145   1HG1  VAL  52          HG12      VAL  52   5.599   5.902   8.284
 1146   2HG1  VAL  52          HG11      VAL  52   4.544   6.929   7.314
 1147   3HG1  VAL  52          HG13      VAL  52   6.277   6.888   6.988
 1148   1HG2  VAL  52          HG23      VAL  52   4.654   8.276  10.580
 1149   2HG2  VAL  52          HG22      VAL  52   4.006   9.175   9.206
 1150   3HG2  VAL  52          HG21      VAL  52   3.746   7.434   9.325
 1151    H    VAL  53           HN       VAL  53   8.327   8.989   8.156
 1152    HA   VAL  53           HA       VAL  53   9.657   6.838   6.795
 1153    HB   VAL  53           HB       VAL  53  10.406   9.760   7.099
 1154   1HG1  VAL  53          HG13      VAL  53  11.811   7.496   5.904
 1155   2HG1  VAL  53          HG12      VAL  53  11.492   8.772   4.730
 1156   3HG1  VAL  53          HG11      VAL  53  12.385   9.134   6.208
 1157   1HG2  VAL  53          HG22      VAL  53   8.906   8.172   5.001
 1158   2HG2  VAL  53          HG21      VAL  53   8.312   9.537   5.946
 1159   3HG2  VAL  53          HG23      VAL  53   9.537   9.790   4.703
 1160    H    ASP  54           HN       ASP  54  10.328   8.566   9.762
 1161    HA   ASP  54           HA       ASP  54  13.092   7.670   9.944
 1162   1HB   ASP  54           HB2      ASP  54  11.146   8.985  11.824
 1163   2HB   ASP  54           HB1      ASP  54  12.640   8.297  12.456
 1164    H    LYS  55           HN       LYS  55   9.977   6.335  10.693
 1165    HA   LYS  55           HA       LYS  55  10.997   4.340  12.565
 1166   1HB   LYS  55           HB2      LYS  55   8.503   5.337  12.049
 1167   2HB   LYS  55           HB1      LYS  55   8.439   3.795  11.197
 1168   1HG   LYS  55           HG2      LYS  55   8.293   2.658  13.136
 1169   2HG   LYS  55           HG1      LYS  55   9.714   3.479  13.780
 1170   1HD   LYS  55           HD2      LYS  55   8.459   4.901  15.009
 1171   2HD   LYS  55           HD1      LYS  55   7.370   5.225  13.660
 1172   1HE   LYS  55           HE2      LYS  55   5.822   3.987  14.730
 1173   2HE   LYS  55           HE1      LYS  55   6.827   2.577  14.401
 1174   1HZ   LYS  55           HZ2      LYS  55   7.077   4.346  16.773
 1175   2HZ   LYS  55           HZ1      LYS  55   6.341   2.816  16.765
 1176   3HZ   LYS  55           HZ3      LYS  55   8.004   2.957  16.461
 1177    H    VAL  56           HN       VAL  56   9.769   4.208   9.192
 1178    HA   VAL  56           HA       VAL  56  10.541   1.446   8.867
 1179    HB   VAL  56           HB       VAL  56  10.234   1.988   6.406
 1180   1HG1  VAL  56          HG12      VAL  56   8.113   2.568   8.472
 1181   2HG1  VAL  56          HG11      VAL  56   7.743   2.553   6.747
 1182   3HG1  VAL  56          HG13      VAL  56   8.348   1.095   7.532
 1183   1HG2  VAL  56          HG23      VAL  56  10.308   4.674   7.516
 1184   2HG2  VAL  56          HG22      VAL  56  10.401   4.162   5.833
 1185   3HG2  VAL  56          HG21      VAL  56   8.830   4.398   6.599
 1186    H    MET  57           HN       MET  57  12.046   4.540   8.078
 1187    HA   MET  57           HA       MET  57  14.327   3.422   6.715
 1188   1HB   MET  57           HB2      MET  57  13.444   5.871   6.729
 1189   2HB   MET  57           HB1      MET  57  14.361   6.031   8.229
 1190   1HG   MET  57           HG2      MET  57  15.743   6.728   6.328
 1191   2HG   MET  57           HG1      MET  57  16.398   5.254   7.038
 1192   1HE   MET  57           HE1      MET  57  13.836   6.627   4.634
 1193   2HE   MET  57           HE3      MET  57  13.676   5.425   3.345
 1194   3HE   MET  57           HE2      MET  57  13.026   5.094   4.949
 1195    H    GLU  58           HN       GLU  58  13.498   3.942  10.087
 1196    HA   GLU  58           HA       GLU  58  16.217   3.682  11.074
 1197   1HB   GLU  58           HB2      GLU  58  13.483   3.744  12.263
 1198   2HB   GLU  58           HB1      GLU  58  14.748   2.968  13.215
 1199   1HG   GLU  58           HG2      GLU  58  15.662   5.468  12.025
 1200   2HG   GLU  58           HG1      GLU  58  14.260   5.706  13.066
 1201    H    THR  59           HN       THR  59  13.429   1.426  10.918
 1202    HA   THR  59           HA       THR  59  14.929  -0.836  11.876
 1203    HB   THR  59           HB       THR  59  12.539  -0.901  10.009
 1204    HG1  THR  59           HG1      THR  59  12.273  -1.112  12.768
 1205   1HG2  THR  59          HG23      THR  59  13.809  -3.030  10.464
 1206   2HG2  THR  59          HG22      THR  59  13.414  -2.830  12.172
 1207   3HG2  THR  59          HG21      THR  59  12.126  -3.066  10.991
 1208    H    LEU  60           HN       LEU  60  14.667   0.777   8.831
 1209    HA   LEU  60           HA       LEU  60  15.608  -1.354   7.134
 1210   1HB   LEU  60           HB2      LEU  60  15.192   1.585   6.936
 1211   2HB   LEU  60           HB1      LEU  60  16.320   0.873   5.787
 1212    HG   LEU  60           HG       LEU  60  13.482  -0.068   6.273
 1213   1HD1  LEU  60          HD11      LEU  60  14.749   1.790   4.304
 1214   2HD1  LEU  60          HD13      LEU  60  13.480   0.716   3.718
 1215   3HD1  LEU  60          HD12      LEU  60  13.142   1.848   5.028
 1216   1HD2  LEU  60          HD21      LEU  60  15.728  -1.007   4.487
 1217   2HD2  LEU  60          HD23      LEU  60  14.720  -1.960   5.576
 1218   3HD2  LEU  60          HD22      LEU  60  14.045  -1.327   4.075
 1219    H    ASP  61           HN       ASP  61  17.244   1.509   8.504
 1220    HA   ASP  61           HA       ASP  61  19.868   0.602   7.657
 1221   1HB   ASP  61           HB2      ASP  61  18.803   3.017   8.454
 1222   2HB   ASP  61           HB1      ASP  61  19.776   2.556   9.851
 1223    H    GLU  62           HN       GLU  62  17.841  -0.128  10.330
 1224    HA   GLU  62           HA       GLU  62  20.003  -0.727  12.197
 1225   1HB   GLU  62           HB2      GLU  62  17.635  -0.112  12.873
 1226   2HB   GLU  62           HB1      GLU  62  17.148  -1.716  12.328
 1227   1HG   GLU  62           HG2      GLU  62  18.586  -2.786  13.935
 1228   2HG   GLU  62           HG1      GLU  62  19.343  -1.252  14.360
 1229    H    ASP  63           HN       ASP  63  18.039  -2.537   9.889
 1230    HA   ASP  63           HA       ASP  63  19.936  -4.806  10.216
 1231   1HB   ASP  63           HB2      ASP  63  16.922  -4.933  10.371
 1232   2HB   ASP  63           HB1      ASP  63  17.894  -6.342   9.949
 1233    H    GLY  64           HN       GLY  64  20.102  -2.982   8.155
 1234   1HA   GLY  64           HA2      GLY  64  18.598  -3.348   5.838
 1235   2HA   GLY  64           HA1      GLY  64  20.331  -3.024   5.811
 1236    H    ASP  65           HN       ASP  65  20.820  -5.570   7.352
 1237    HA   ASP  65           HA       ASP  65  20.664  -7.383   4.995
 1238   1HB   ASP  65           HB2      ASP  65  22.911  -6.986   5.925
 1239   2HB   ASP  65           HB1      ASP  65  22.363  -7.551   7.503
 1240    H    GLY  66           HN       GLY  66  18.274  -7.070   6.418
 1241   1HA   GLY  66           HA2      GLY  66  18.106  -9.605   7.977
 1242   2HA   GLY  66           HA1      GLY  66  17.042  -8.226   8.244
 1243    H    GLU  67           HN       GLU  67  15.392 -10.041   7.888
 1244    HA   GLU  67           HA       GLU  67  14.839 -10.296   4.956
 1245   1HB   GLU  67           HB2      GLU  67  13.647 -12.429   5.558
 1246   2HB   GLU  67           HB1      GLU  67  15.387 -12.487   5.841
 1247   1HG   GLU  67           HG2      GLU  67  15.058 -12.037   8.216
 1248   2HG   GLU  67           HG1      GLU  67  13.324 -11.840   7.968
 1249    H    CYS  68           HN       CYS  68  12.834  -9.594   4.305
 1250    HA   CYS  68           HA       CYS  68  10.875  -8.904   6.466
 1251   1HB   CYS  68           HB2      CYS  68  12.138  -7.177   4.608
 1252   2HB   CYS  68           HB1      CYS  68  10.464  -7.344   4.079
 1253    HG   CYS  68           HG       CYS  68   9.648  -6.308   6.246
 1254    H    ASP  69           HN       ASP  69   8.591  -8.922   5.700
 1255    HA   ASP  69           HA       ASP  69   8.201 -11.161   3.785
 1256   1HB   ASP  69           HB2      ASP  69   6.122  -9.822   5.536
 1257   2HB   ASP  69           HB1      ASP  69   6.004 -11.389   4.738
 1258    H    PHE  70           HN       PHE  70   6.305 -10.909   2.249
 1259    HA   PHE  70           HA       PHE  70   6.633  -8.542   0.667
 1260   1HB   PHE  70           HB2      PHE  70   4.909  -9.437  -0.735
 1261   2HB   PHE  70           HB1      PHE  70   5.791 -10.829  -0.109
 1262    HD1  PHE  70           HD2      PHE  70   4.828 -12.265   1.633
 1263    HD2  PHE  70           HD1      PHE  70   2.646  -8.940   0.014
 1264    HE1  PHE  70           HE2      PHE  70   2.738 -13.153   2.630
 1265    HE2  PHE  70           HE1      PHE  70   0.555  -9.826   1.011
 1266    HZ   PHE  70           HZ       PHE  70   0.601 -11.933   2.318
 1267    H    GLN  71           HN       GLN  71   4.021  -9.572   2.884
 1268    HA   GLN  71           HA       GLN  71   2.457  -7.187   2.538
 1269   1HB   GLN  71           HB2      GLN  71   1.152  -7.959   4.361
 1270   2HB   GLN  71           HB1      GLN  71   1.745  -9.432   3.597
 1271   1HG   GLN  71           HG2      GLN  71   2.543 -10.022   5.623
 1272   2HG   GLN  71           HG1      GLN  71   3.752  -8.755   5.416
 1273   1HE2  GLN  71          HE22      GLN  71   1.231  -6.453   7.132
 1274   2HE2  GLN  71          HE21      GLN  71   1.712  -6.569   5.507
 1275    H    GLU  72           HN       GLU  72   5.279  -7.944   4.433
 1276    HA   GLU  72           HA       GLU  72   5.041  -5.728   6.283
 1277   1HB   GLU  72           HB2      GLU  72   7.156  -7.680   5.487
 1278   2HB   GLU  72           HB1      GLU  72   7.701  -6.178   6.231
 1279   1HG   GLU  72           HG2      GLU  72   5.517  -6.987   7.790
 1280   2HG   GLU  72           HG1      GLU  72   6.412  -8.471   7.467
 1281    H    PHE  73           HN       PHE  73   7.429  -6.175   3.658
 1282    HA   PHE  73           HA       PHE  73   8.211  -3.506   3.389
 1283   1HB   PHE  73           HB2      PHE  73   9.472  -4.501   1.790
 1284   2HB   PHE  73           HB1      PHE  73   8.469  -5.938   1.888
 1285    HD1  PHE  73           HD1      PHE  73   6.608  -6.291   0.329
 1286    HD2  PHE  73           HD2      PHE  73   9.110  -2.813   0.058
 1287    HE1  PHE  73           HE1      PHE  73   5.714  -5.822  -1.936
 1288    HE2  PHE  73           HE2      PHE  73   8.217  -2.344  -2.206
 1289    HZ   PHE  73           HZ       PHE  73   6.518  -3.849  -3.204
 1290    H    MET  74           HN       MET  74   5.261  -5.075   2.379
 1291    HA   MET  74           HA       MET  74   4.330  -3.090   0.542
 1292   1HB   MET  74           HB2      MET  74   3.083  -5.268   2.169
 1293   2HB   MET  74           HB1      MET  74   2.025  -4.073   1.428
 1294   1HG   MET  74           HG2      MET  74   4.100  -5.735  -0.032
 1295   2HG   MET  74           HG1      MET  74   2.359  -6.008  -0.070
 1296   1HE   MET  74           HE1      MET  74   0.921  -4.052  -0.092
 1297   2HE   MET  74           HE3      MET  74   1.457  -2.411  -0.476
 1298   3HE   MET  74           HE2      MET  74   0.707  -3.410  -1.717
 1299    H    ALA  75           HN       ALA  75   3.407  -3.605   3.971
 1300    HA   ALA  75           HA       ALA  75   1.961  -1.158   4.210
 1301   1HB   ALA  75           HB2      ALA  75   3.394  -2.802   6.320
 1302   2HB   ALA  75           HB1      ALA  75   2.280  -1.481   6.673
 1303   3HB   ALA  75           HB3      ALA  75   1.696  -2.933   5.863
 1304    H    PHE  76           HN       PHE  76   5.351  -1.869   4.218
 1305    HA   PHE  76           HA       PHE  76   6.192   0.579   5.549
 1306   1HB   PHE  76           HB2      PHE  76   7.460  -1.748   4.278
 1307   2HB   PHE  76           HB1      PHE  76   8.330  -0.242   3.994
 1308    HD1  PHE  76           HD2      PHE  76   6.299  -1.389   6.928
 1309    HD2  PHE  76           HD1      PHE  76  10.161  -0.215   5.459
 1310    HE1  PHE  76           HE2      PHE  76   7.203  -1.479   9.237
 1311    HE2  PHE  76           HE1      PHE  76  11.064  -0.306   7.767
 1312    HZ   PHE  76           HZ       PHE  76   9.585  -0.937   9.656
 1313    H    VAL  77           HN       VAL  77   5.542  -0.447   2.257
 1314    HA   VAL  77           HA       VAL  77   6.687   1.853   0.936
 1315    HB   VAL  77           HB       VAL  77   4.558  -0.139   0.110
 1316   1HG1  VAL  77          HG11      VAL  77   4.523   2.186  -1.039
 1317   2HG1  VAL  77          HG13      VAL  77   6.051   1.689  -1.766
 1318   3HG1  VAL  77          HG12      VAL  77   4.586   0.757  -2.071
 1319   1HG2  VAL  77          HG22      VAL  77   7.401  -0.246   0.301
 1320   2HG2  VAL  77          HG21      VAL  77   6.313  -1.468  -0.356
 1321   3HG2  VAL  77          HG23      VAL  77   6.984  -0.226  -1.413
 1322    H    SER  78           HN       SER  78   3.658   1.208   2.551
 1323    HA   SER  78           HA       SER  78   2.257   3.484   1.378
 1324   1HB   SER  78           HB2      SER  78   0.591   2.993   3.217
 1325   2HB   SER  78           HB1      SER  78   0.925   1.635   2.147
 1326    HG   SER  78           HG       SER  78   0.986   1.217   4.488
 1327    H    MET  79           HN       MET  79   3.489   2.819   4.681
 1328    HA   MET  79           HA       MET  79   2.972   5.310   5.835
 1329   1HB   MET  79           HB2      MET  79   5.667   4.224   6.445
 1330   2HB   MET  79           HB1      MET  79   4.372   4.698   7.538
 1331   1HG   MET  79           HG2      MET  79   3.145   2.592   6.659
 1332   2HG   MET  79           HG1      MET  79   4.733   2.099   6.068
 1333   1HE   MET  79           HE2      MET  79   3.010   0.637   7.605
 1334   2HE   MET  79           HE1      MET  79   4.179  -0.196   8.626
 1335   3HE   MET  79           HE3      MET  79   2.903   0.786   9.357
 1336    H    VAL  80           HN       VAL  80   5.883   4.378   3.997
 1337    HA   VAL  80           HA       VAL  80   7.073   6.989   4.120
 1338    HB   VAL  80           HB       VAL  80   8.567   6.115   2.364
 1339   1HG1  VAL  80          HG13      VAL  80   7.846   4.212   4.607
 1340   2HG1  VAL  80          HG12      VAL  80   9.299   4.042   3.622
 1341   3HG1  VAL  80          HG11      VAL  80   9.081   5.470   4.634
 1342   1HG2  VAL  80          HG22      VAL  80   6.463   3.955   2.257
 1343   2HG2  VAL  80          HG21      VAL  80   7.120   4.905   0.923
 1344   3HG2  VAL  80          HG23      VAL  80   8.110   3.666   1.695
 1345    H    THR  81           HN       THR  81   5.229   5.332   1.535
 1346    HA   THR  81           HA       THR  81   5.308   7.583  -0.259
 1347    HB   THR  81           HB       THR  81   3.215   5.394  -0.170
 1348    HG1  THR  81           HG1      THR  81   5.696   4.984  -0.304
 1349   1HG2  THR  81          HG23      THR  81   4.267   7.222  -2.342
 1350   2HG2  THR  81          HG22      THR  81   3.228   5.834  -2.652
 1351   3HG2  THR  81          HG21      THR  81   2.632   7.182  -1.684
 1352    H    THR  82           HN       THR  82   3.719   7.211   2.677
 1353    HA   THR  82           HA       THR  82   1.647   9.208   1.863
 1354    HB   THR  82           HB       THR  82   0.261   8.340   3.706
 1355    HG1  THR  82           HG1      THR  82   2.141   7.624   4.929
 1356   1HG2  THR  82          HG23      THR  82   0.996   6.924   1.327
 1357   2HG2  THR  82          HG22      THR  82   0.676   5.750   2.604
 1358   3HG2  THR  82          HG21      THR  82  -0.558   6.929   2.164
 1359    H    ALA  83           HN       ALA  83   4.452   8.696   3.673
 1360    HA   ALA  83           HA       ALA  83   3.884  10.397   5.940
 1361   1HB   ALA  83           HB3      ALA  83   6.373   9.283   4.682
 1362   2HB   ALA  83           HB2      ALA  83   6.508  10.546   5.905
 1363   3HB   ALA  83           HB1      ALA  83   5.730   9.015   6.303
 1364    H    CYS  84           HN       CYS  84   5.925  10.986   3.051
 1365    HA   CYS  84           HA       CYS  84   6.466  13.679   3.394
 1366   1HB   CYS  84           HB2      CYS  84   6.550  11.857   1.236
 1367   2HB   CYS  84           HB1      CYS  84   5.658  13.260   0.650
 1368    HG   CYS  84           HG       CYS  84   8.628  13.201   1.232
 1369    H    HIS  85           HN       HIS  85   5.396  15.639   2.689
 1370    HA   HIS  85           HA       HIS  85   2.569  15.672   3.269
 1371   1HB   HIS  85           HB2      HIS  85   4.618  17.569   3.118
 1372   2HB   HIS  85           HB1      HIS  85   3.513  18.013   1.818
 1373    HD1  HIS  85           HD1      HIS  85   3.365  20.041   3.872
 1374    HD2  HIS  85           HD2      HIS  85   1.267  16.474   4.351
 1375    HE1  HIS  85           HE1      HIS  85   1.556  20.499   5.584
 1376    H    GLU  86           HN       GLU  86   0.836  16.075   1.806
 1377    HA   GLU  86           HA       GLU  86  -0.311  15.915  -0.238
 1378   1HB   GLU  86           HB2      GLU  86   2.366  16.366  -1.578
 1379   2HB   GLU  86           HB1      GLU  86   0.763  16.740  -2.210
 1380   1HG   GLU  86           HG2      GLU  86   1.475  18.004   0.382
 1381   2HG   GLU  86           HG1      GLU  86   2.339  18.595  -1.039
 1382    H    PHE  87           HN       PHE  87   0.028  14.632  -2.513
 1383    HA   PHE  87           HA       PHE  87   1.668  12.221  -2.170
 1384   1HB   PHE  87           HB2      PHE  87  -0.731  11.009  -2.764
 1385   2HB   PHE  87           HB1      PHE  87   0.017  11.039  -1.172
 1386    HD1  PHE  87           HD1      PHE  87  -2.230  13.087  -3.369
 1387    HD2  PHE  87           HD2      PHE  87  -1.133  11.974   0.633
 1388    HE1  PHE  87           HE1      PHE  87  -4.141  14.389  -2.481
 1389    HE2  PHE  87           HE2      PHE  87  -3.045  13.276   1.521
 1390    HZ   PHE  87           HZ       PHE  87  -4.551  14.484  -0.036
 1391    H    PHE  88           HN       PHE  88  -0.764  13.975  -4.099
 1392    HA   PHE  88           HA       PHE  88   0.643  12.923  -6.515
 1393   1HB   PHE  88           HB2      PHE  88  -2.065  13.581  -7.195
 1394   2HB   PHE  88           HB1      PHE  88  -1.232  12.044  -7.378
 1395    HD1  PHE  88           HD1      PHE  88  -0.954  10.656  -5.130
 1396    HD2  PHE  88           HD2      PHE  88  -3.918  13.695  -5.785
 1397    HE1  PHE  88           HE1      PHE  88  -2.362   9.674  -3.342
 1398    HE2  PHE  88           HE2      PHE  88  -5.320  12.710  -3.990
 1399    HZ   PHE  88           HZ       PHE  88  -4.540  10.700  -2.771
 1400    H    GLU  89           HN       GLU  89   1.381  15.330  -5.392
 1401    HA   GLU  89           HA       GLU  89  -0.105  17.445  -6.831
 1402   1HB   GLU  89           HB2      GLU  89   0.966  17.569  -4.413
 1403   2HB   GLU  89           HB1      GLU  89   2.420  17.977  -5.324
 1404   1HG   GLU  89           HG2      GLU  89   0.635  19.574  -6.581
 1405   2HG   GLU  89           HG1      GLU  89  -0.083  19.531  -4.969
 1406    H    HIS  90           HN       HIS  90   3.302  16.439  -6.552
 1407    HA   HIS  90           HA       HIS  90   5.086  16.824  -8.051
 1408   1HB   HIS  90           HB2      HIS  90   4.353  15.957 -10.437
 1409   2HB   HIS  90           HB1      HIS  90   4.482  14.834  -9.083
 1410    HD1  HIS  90           HD1      HIS  90   2.108  16.150 -11.542
 1411    HD2  HIS  90           HD2      HIS  90   1.852  14.280  -7.823
 1412    HE1  HIS  90           HE1      HIS  90  -0.272  15.321 -11.317
 1413    H    GLU  91           HN       GLU  91   5.055  19.169  -7.932
 1414    HA   GLU  91           HA       GLU  91   3.493  20.612  -9.975
 1415   1HB   GLU  91           HB2      GLU  91   4.466  21.296  -7.458
 1416   2HB   GLU  91           HB1      GLU  91   5.531  22.165  -8.566
 1417   1HG   GLU  91           HG2      GLU  91   2.663  22.253  -9.274
 1418   2HG   GLU  91           HG1      GLU  91   3.085  23.087  -7.778
   
  No H/Q in entry =        1418
  Start of MODEL   20
    1   1H    MET   0           HT2      MET   0   9.849   5.421 -15.770
    2   2H    MET   0           HT1      MET   0   8.707   6.672 -15.890
    3   3H    MET   0           HT3      MET   0   9.317   6.226 -14.372
    4    HA   MET   0           HA       MET   0   7.241   5.226 -14.400
    5   1HB   MET   0           HB2      MET   0   6.676   3.788 -16.509
    6   2HB   MET   0           HB1      MET   0   6.482   5.538 -16.600
    7   1HG   MET   0           HG2      MET   0   8.761   5.713 -17.587
    8   2HG   MET   0           HG1      MET   0   8.883   3.955 -17.562
    9   1HE   MET   0           HE2      MET   0   8.480   2.621 -19.414
   10   2HE   MET   0           HE1      MET   0   6.895   2.415 -18.672
   11   3HE   MET   0           HE3      MET   0   7.034   2.657 -20.419
   12    H    SER   1           HN       SER   1   8.297   3.944 -12.810
   13    HA   SER   1           HA       SER   1   9.692   1.507 -13.810
   14   1HB   SER   1           HB2      SER   1  10.600   1.299 -11.556
   15   2HB   SER   1           HB1      SER   1  10.887   2.933 -12.147
   16    HG   SER   1           HG       SER   1  10.002   3.297 -10.220
   17    H    GLU   2           HN       GLU   2   9.292  -0.310 -11.878
   18    HA   GLU   2           HA       GLU   2   6.535  -1.107 -12.276
   19   1HB   GLU   2           HB2      GLU   2   8.931  -2.378 -11.547
   20   2HB   GLU   2           HB1      GLU   2   7.882  -2.543 -10.139
   21   1HG   GLU   2           HG2      GLU   2   7.320  -4.413 -11.456
   22   2HG   GLU   2           HG1      GLU   2   6.056  -3.244 -11.843
   23    H    LEU   3           HN       LEU   3   8.403  -0.057  -9.419
   24    HA   LEU   3           HA       LEU   3   6.116  -0.130  -7.645
   25   1HB   LEU   3           HB2      LEU   3   8.622  -0.158  -7.030
   26   2HB   LEU   3           HB1      LEU   3   8.568   1.586  -7.260
   27    HG   LEU   3           HG       LEU   3   6.642   1.669  -5.640
   28   1HD1  LEU   3          HD11      LEU   3   7.314  -1.260  -5.522
   29   2HD1  LEU   3          HD13      LEU   3   6.651  -0.452  -4.102
   30   3HD1  LEU   3          HD12      LEU   3   5.731  -0.487  -5.605
   31   1HD2  LEU   3          HD21      LEU   3   9.438   0.885  -4.991
   32   2HD2  LEU   3          HD23      LEU   3   8.534   2.325  -4.520
   33   3HD2  LEU   3          HD22      LEU   3   8.278   0.803  -3.665
   34    H    GLU   4           HN       GLU   4   7.842   2.506  -9.301
   35    HA   GLU   4           HA       GLU   4   6.301   4.656  -8.349
   36   1HB   GLU   4           HB2      GLU   4   8.360   4.864  -9.754
   37   2HB   GLU   4           HB1      GLU   4   7.417   4.361 -11.155
   38   1HG   GLU   4           HG2      GLU   4   5.826   6.299 -10.556
   39   2HG   GLU   4           HG1      GLU   4   7.127   6.877  -9.515
   40    H    LYS   5           HN       LYS   5   5.683   2.687 -11.281
   41    HA   LYS   5           HA       LYS   5   3.278   4.088 -11.959
   42   1HB   LYS   5           HB2      LYS   5   4.441   1.421 -12.685
   43   2HB   LYS   5           HB1      LYS   5   2.776   1.786 -13.139
   44   1HG   LYS   5           HG2      LYS   5   3.488   3.783 -14.334
   45   2HG   LYS   5           HG1      LYS   5   5.150   3.558 -13.787
   46   1HD   LYS   5           HD2      LYS   5   5.221   2.621 -15.926
   47   2HD   LYS   5           HD1      LYS   5   4.919   1.205 -14.918
   48   1HE   LYS   5           HE2      LYS   5   3.329   1.031 -16.668
   49   2HE   LYS   5           HE1      LYS   5   2.416   1.685 -15.309
   50   1HZ   LYS   5           HZ1      LYS   5   3.724   3.521 -17.198
   51   2HZ   LYS   5           HZ3      LYS   5   2.253   2.796 -17.630
   52   3HZ   LYS   5           HZ2      LYS   5   2.343   3.765 -16.238
   53    H    ALA   6           HN       ALA   6   3.822   1.215  -9.922
   54    HA   ALA   6           HA       ALA   6   0.951   0.827  -9.515
   55   1HB   ALA   6           HB1      ALA   6   2.960  -0.898  -9.350
   56   2HB   ALA   6           HB3      ALA   6   2.999  -0.352  -7.674
   57   3HB   ALA   6           HB2      ALA   6   1.532  -1.078  -8.332
   58    H    MET   7           HN       MET   7   3.482   1.345  -7.060
   59    HA   MET   7           HA       MET   7   1.910   2.187  -4.959
   60   1HB   MET   7           HB2      MET   7   4.375   1.898  -4.852
   61   2HB   MET   7           HB1      MET   7   4.575   3.411  -5.744
   62   1HG   MET   7           HG2      MET   7   4.796   3.982  -3.433
   63   2HG   MET   7           HG1      MET   7   3.183   4.511  -3.910
   64   1HE   MET   7           HE3      MET   7   1.390   4.209  -2.959
   65   2HE   MET   7           HE2      MET   7   0.867   2.577  -3.363
   66   3HE   MET   7           HE1      MET   7   0.887   3.094  -1.679
   67    H    VAL   8           HN       VAL   8   3.212   4.292  -7.536
   68    HA   VAL   8           HA       VAL   8   1.921   6.657  -6.495
   69    HB   VAL   8           HB       VAL   8   2.767   6.207  -9.368
   70   1HG1  VAL   8          HG12      VAL   8   1.485   8.258  -8.874
   71   2HG1  VAL   8          HG11      VAL   8   2.628   8.661  -7.595
   72   3HG1  VAL   8          HG13      VAL   8   3.160   8.639  -9.275
   73   1HG2  VAL   8          HG22      VAL   8   4.472   5.657  -7.413
   74   2HG2  VAL   8          HG21      VAL   8   4.993   6.626  -8.792
   75   3HG2  VAL   8          HG23      VAL   8   4.556   7.412  -7.276
   76    H    ALA   9           HN       ALA   9   0.955   4.147  -8.774
   77    HA   ALA   9           HA       ALA   9  -1.336   5.483  -9.856
   78   1HB   ALA   9           HB2      ALA   9  -0.637   2.569  -9.470
   79   2HB   ALA   9           HB1      ALA   9  -2.165   3.069 -10.194
   80   3HB   ALA   9           HB3      ALA   9  -0.640   3.500 -10.968
   81    H    LEU  10           HN       LEU  10  -0.789   3.740  -6.846
   82    HA   LEU  10           HA       LEU  10  -3.544   3.445  -6.097
   83   1HB   LEU  10           HB2      LEU  10  -1.006   2.880  -4.947
   84   2HB   LEU  10           HB1      LEU  10  -1.883   3.881  -3.789
   85    HG   LEU  10           HG       LEU  10  -3.140   1.482  -5.134
   86   1HD1  LEU  10          HD11      LEU  10  -1.042   1.479  -3.214
   87   2HD1  LEU  10          HD13      LEU  10  -2.523   1.035  -2.365
   88   3HD1  LEU  10          HD12      LEU  10  -1.999   0.107  -3.769
   89   1HD2  LEU  10          HD21      LEU  10  -4.601   3.248  -4.100
   90   2HD2  LEU  10          HD23      LEU  10  -4.756   1.670  -3.326
   91   3HD2  LEU  10          HD22      LEU  10  -3.802   2.939  -2.557
   92    H    ILE  11           HN       ILE  11  -1.116   5.951  -5.321
   93    HA   ILE  11           HA       ILE  11  -2.762   7.616  -3.750
   94    HB   ILE  11           HB       ILE  11  -0.462   8.191  -5.622
   95   1HG1  ILE  11          HG12      ILE  11   0.208   9.049  -3.119
   96   2HG1  ILE  11          HG11      ILE  11  -0.903   7.735  -2.732
   97   1HG2  ILE  11          HG21      ILE  11  -2.243  10.133  -4.166
   98   2HG2  ILE  11          HG23      ILE  11  -0.537  10.506  -4.415
   99   3HG2  ILE  11          HG22      ILE  11  -1.593  10.242  -5.802
  100   1HD1  ILE  11          HD12      ILE  11   0.527   6.500  -4.633
  101   2HD1  ILE  11          HD11      ILE  11   1.755   7.637  -4.078
  102   3HD1  ILE  11          HD13      ILE  11   1.026   6.502  -2.941
  103    H    ASP  12           HN       ASP  12  -2.633   7.151  -7.230
  104    HA   ASP  12           HA       ASP  12  -4.142   9.423  -8.046
  105   1HB   ASP  12           HB2      ASP  12  -2.925   7.648  -9.486
  106   2HB   ASP  12           HB1      ASP  12  -4.406   6.707  -9.336
  107    H    VAL  13           HN       VAL  13  -5.238   6.110  -7.273
  108    HA   VAL  13           HA       VAL  13  -7.998   6.445  -7.586
  109    HB   VAL  13           HB       VAL  13  -6.457   4.880  -5.498
  110   1HG1  VAL  13          HG13      VAL  13  -9.419   4.820  -6.151
  111   2HG1  VAL  13          HG12      VAL  13  -8.588   3.664  -5.110
  112   3HG1  VAL  13          HG11      VAL  13  -8.702   5.356  -4.632
  113   1HG2  VAL  13          HG22      VAL  13  -6.819   4.504  -8.234
  114   2HG2  VAL  13          HG21      VAL  13  -6.335   3.264  -7.077
  115   3HG2  VAL  13          HG23      VAL  13  -8.036   3.456  -7.505
  116    H    PHE  14           HN       PHE  14  -5.924   7.554  -4.958
  117    HA   PHE  14           HA       PHE  14  -7.927   8.276  -3.083
  118   1HB   PHE  14           HB2      PHE  14  -5.315   8.327  -2.900
  119   2HB   PHE  14           HB1      PHE  14  -5.481   9.975  -3.504
  120    HD1  PHE  14           HD2      PHE  14  -6.894  11.625  -2.247
  121    HD2  PHE  14           HD1      PHE  14  -5.933   7.751  -0.663
  122    HE1  PHE  14           HE2      PHE  14  -7.538  12.391   0.021
  123    HE2  PHE  14           HE1      PHE  14  -6.579   8.516   1.606
  124    HZ   PHE  14           HZ       PHE  14  -7.381  10.837   1.949
  125    H    HIS  15           HN       HIS  15  -6.472  10.216  -5.713
  126    HA   HIS  15           HA       HIS  15  -8.281  12.452  -5.191
  127   1HB   HIS  15           HB2      HIS  15  -5.903  12.566  -6.194
  128   2HB   HIS  15           HB1      HIS  15  -6.657  12.055  -7.703
  129    HD1  HIS  15           HD1      HIS  15  -7.788  13.834  -9.068
  130    HD2  HIS  15           HD2      HIS  15  -7.075  15.086  -5.158
  131    HE1  HIS  15           HE1      HIS  15  -8.426  16.281  -8.976
  132    H    GLN  16           HN       GLN  16  -8.744   9.481  -6.595
  133    HA   GLN  16           HA       GLN  16 -10.479  10.399  -8.794
  134   1HB   GLN  16           HB2      GLN  16  -9.224   7.897  -7.976
  135   2HB   GLN  16           HB1      GLN  16 -10.922   7.669  -8.400
  136   1HG   GLN  16           HG2      GLN  16  -9.108   9.297 -10.172
  137   2HG   GLN  16           HG1      GLN  16  -9.147   7.540 -10.302
  138   1HE2  GLN  16          HE22      GLN  16 -11.843   9.344 -12.415
  139   2HE2  GLN  16          HE21      GLN  16 -10.235   9.804 -12.127
  140    H    TYR  17           HN       TYR  17 -10.759   9.527  -5.451
  141    HA   TYR  17           HA       TYR  17 -13.739   9.489  -5.747
  142   1HB   TYR  17           HB2      TYR  17 -11.953   8.142  -3.699
  143   2HB   TYR  17           HB1      TYR  17 -13.710   8.226  -3.560
  144    HD1  TYR  17           HD1      TYR  17 -10.893   6.859  -5.529
  145    HD2  TYR  17           HD2      TYR  17 -15.155   6.913  -4.989
  146    HE1  TYR  17           HE1      TYR  17 -11.108   4.896  -7.026
  147    HE2  TYR  17           HE2      TYR  17 -15.370   4.951  -6.485
  148    HH   TYR  17           HH       TYR  17 -13.187   3.995  -8.584
  149    H    SER  18           HN       SER  18 -10.991  10.779  -3.961
  150    HA   SER  18           HA       SER  18 -12.552  12.196  -1.988
  151   1HB   SER  18           HB2      SER  18  -9.907  11.645  -2.236
  152   2HB   SER  18           HB1      SER  18  -9.922  13.312  -2.802
  153    HG   SER  18           HG       SER  18 -10.314  13.943  -0.837
  154    H    GLY  19           HN       GLY  19 -11.179  13.092  -5.147
  155   1HA   GLY  19           HA2      GLY  19 -11.688  15.843  -5.152
  156   2HA   GLY  19           HA1      GLY  19 -11.796  14.837  -6.596
  157    H    ARG  20           HN       ARG  20 -13.972  13.187  -5.783
  158    HA   ARG  20           HA       ARG  20 -16.194  14.711  -6.620
  159   1HB   ARG  20           HB2      ARG  20 -16.007  12.158  -5.011
  160   2HB   ARG  20           HB1      ARG  20 -17.554  12.842  -5.509
  161   1HG   ARG  20           HG2      ARG  20 -17.002  12.642  -7.829
  162   2HG   ARG  20           HG1      ARG  20 -15.314  12.279  -7.463
  163   1HD   ARG  20           HD2      ARG  20 -16.873  10.294  -8.056
  164   2HD   ARG  20           HD1      ARG  20 -15.828  10.128  -6.644
  165    HE   ARG  20           HE       ARG  20 -17.764  10.410  -5.226
  166   1HH1  ARG  20          HH21      ARG  20 -19.371  12.332  -6.793
  167   2HH1  ARG  20          HH22      ARG  20 -20.653  11.349  -7.414
  168   1HH2  ARG  20          HH11      ARG  20 -19.006   8.359  -6.810
  169   2HH2  ARG  20          HH12      ARG  20 -20.446   9.100  -7.424
  170    H    GLU  21           HN       GLU  21 -16.340  16.668  -5.445
  171    HA   GLU  21           HA       GLU  21 -16.765  18.053  -3.578
  172   1HB   GLU  21           HB2      GLU  21 -18.885  17.556  -2.550
  173   2HB   GLU  21           HB1      GLU  21 -18.990  17.028  -4.228
  174   1HG   GLU  21           HG2      GLU  21 -18.644  14.732  -3.614
  175   2HG   GLU  21           HG1      GLU  21 -18.217  15.175  -1.959
  176    H    GLY  22           HN       GLY  22 -17.756  17.229  -0.995
  177   1HA   GLY  22           HA2      GLY  22 -17.047  16.032   0.969
  178   2HA   GLY  22           HA1      GLY  22 -15.643  15.446   0.074
  179    H    ASP  23           HN       ASP  23 -14.294  16.172   1.876
  180    HA   ASP  23           HA       ASP  23 -14.130  19.115   2.230
  181   1HB   ASP  23           HB2      ASP  23 -14.124  17.872   4.299
  182   2HB   ASP  23           HB1      ASP  23 -12.850  16.804   3.712
  183    H    LYS  24           HN       LYS  24 -11.368  16.930   2.483
  184    HA   LYS  24           HA       LYS  24 -10.224  17.391  -0.078
  185   1HB   LYS  24           HB2      LYS  24 -10.315  19.780   0.884
  186   2HB   LYS  24           HB1      LYS  24  -9.036  19.253   1.978
  187   1HG   LYS  24           HG2      LYS  24  -7.472  19.312   0.345
  188   2HG   LYS  24           HG1      LYS  24  -8.530  18.494  -0.805
  189   1HD   LYS  24           HD2      LYS  24  -9.799  20.787  -0.865
  190   2HD   LYS  24           HD1      LYS  24  -8.286  21.431  -0.227
  191   1HE   LYS  24           HE2      LYS  24  -7.388  19.810  -2.252
  192   2HE   LYS  24           HE1      LYS  24  -8.902  20.421  -2.922
  193   1HZ   LYS  24           HZ1      LYS  24  -8.156  22.675  -2.346
  194   2HZ   LYS  24           HZ3      LYS  24  -6.667  22.042  -1.834
  195   3HZ   LYS  24           HZ2      LYS  24  -7.127  21.916  -3.465
  196    H    HIS  25           HN       HIS  25  -8.453  16.079  -0.271
  197    HA   HIS  25           HA       HIS  25  -6.937  14.402   0.373
  198   1HB   HIS  25           HB2      HIS  25  -6.390  16.658   2.302
  199   2HB   HIS  25           HB1      HIS  25  -5.383  15.212   2.233
  200    HD1  HIS  25           HD1      HIS  25  -6.024  15.182  -1.060
  201    HD2  HIS  25           HD2      HIS  25  -4.072  18.080   1.210
  202    HE1  HIS  25           HE1      HIS  25  -4.574  16.496  -2.669
  203    H    LYS  26           HN       LYS  26  -9.529  13.924   1.397
  204    HA   LYS  26           HA       LYS  26  -8.799  12.361   3.795
  205   1HB   LYS  26           HB2      LYS  26 -10.498  13.247   5.211
  206   2HB   LYS  26           HB1      LYS  26  -9.667  14.649   4.539
  207   1HG   LYS  26           HG2      LYS  26 -11.805  15.314   4.061
  208   2HG   LYS  26           HG1      LYS  26 -11.558  14.301   2.640
  209   1HD   LYS  26           HD2      LYS  26 -12.629  12.415   3.739
  210   2HD   LYS  26           HD1      LYS  26 -12.761  13.322   5.246
  211   1HE   LYS  26           HE2      LYS  26 -14.818  13.917   4.500
  212   2HE   LYS  26           HE1      LYS  26 -13.957  15.017   3.424
  213   1HZ   LYS  26           HZ2      LYS  26 -13.779  12.811   2.010
  214   2HZ   LYS  26           HZ1      LYS  26 -15.217  12.454   2.842
  215   3HZ   LYS  26           HZ3      LYS  26 -15.116  13.853   1.889
  216    H    LEU  27           HN       LEU  27  -9.789  10.393   3.710
  217    HA   LEU  27           HA       LEU  27 -11.874  10.011   1.624
  218   1HB   LEU  27           HB2      LEU  27  -9.664   8.434   2.608
  219   2HB   LEU  27           HB1      LEU  27 -11.168   7.530   2.788
  220    HG   LEU  27           HG       LEU  27 -10.074   7.197   0.556
  221   1HD1  LEU  27          HD12      LEU  27 -12.576   7.041   0.957
  222   2HD1  LEU  27          HD11      LEU  27 -12.703   8.688   0.342
  223   3HD1  LEU  27          HD13      LEU  27 -12.114   7.400  -0.707
  224   1HD2  LEU  27          HD22      LEU  27  -9.632   9.921   0.701
  225   2HD2  LEU  27          HD21      LEU  27  -9.466   8.947  -0.758
  226   3HD2  LEU  27          HD23      LEU  27 -10.970   9.813  -0.442
  227    H    LYS  28           HN       LYS  28 -13.031   7.657   2.737
  228    HA   LYS  28           HA       LYS  28 -14.086   8.452   5.381
  229   1HB   LYS  28           HB2      LYS  28 -15.543   8.780   2.855
  230   2HB   LYS  28           HB1      LYS  28 -16.423   7.819   4.045
  231   1HG   LYS  28           HG2      LYS  28 -15.487   9.820   5.628
  232   2HG   LYS  28           HG1      LYS  28 -15.691  10.686   4.105
  233   1HD   LYS  28           HD2      LYS  28 -17.855   8.916   5.258
  234   2HD   LYS  28           HD1      LYS  28 -17.735  10.632   5.643
  235   1HE   LYS  28           HE2      LYS  28 -17.544  10.796   2.965
  236   2HE   LYS  28           HE1      LYS  28 -18.497   9.317   3.085
  237   1HZ   LYS  28           HZ1      LYS  28 -19.213  11.743   4.608
  238   2HZ   LYS  28           HZ3      LYS  28 -19.745  11.512   3.015
  239   3HZ   LYS  28           HZ2      LYS  28 -20.189  10.407   4.227
  240    H    LYS  29           HN       LYS  29 -16.023   6.674   5.802
  241    HA   LYS  29           HA       LYS  29 -14.617   4.088   5.503
  242   1HB   LYS  29           HB2      LYS  29 -17.183   4.600   7.016
  243   2HB   LYS  29           HB1      LYS  29 -16.031   3.287   7.251
  244   1HG   LYS  29           HG2      LYS  29 -15.507   6.225   7.780
  245   2HG   LYS  29           HG1      LYS  29 -15.748   4.979   9.005
  246   1HD   LYS  29           HD2      LYS  29 -13.771   3.762   7.829
  247   2HD   LYS  29           HD1      LYS  29 -13.427   5.340   7.120
  248   1HE   LYS  29           HE2      LYS  29 -12.900   6.298   9.167
  249   2HE   LYS  29           HE1      LYS  29 -13.898   5.160  10.074
  250   1HZ   LYS  29           HZ3      LYS  29 -12.136   3.494   9.031
  251   2HZ   LYS  29           HZ2      LYS  29 -11.162   4.883   9.116
  252   3HZ   LYS  29           HZ1      LYS  29 -11.891   4.265  10.521
  253    H    SER  30           HN       SER  30 -17.358   5.792   4.226
  254    HA   SER  30           HA       SER  30 -18.709   3.383   3.255
  255   1HB   SER  30           HB2      SER  30 -20.067   5.346   3.717
  256   2HB   SER  30           HB1      SER  30 -19.094   6.325   2.621
  257    HG   SER  30           HG       SER  30 -21.172   5.353   1.836
  258    H    GLU  31           HN       GLU  31 -16.691   5.961   1.832
  259    HA   GLU  31           HA       GLU  31 -16.710   4.690  -0.798
  260   1HB   GLU  31           HB2      GLU  31 -16.379   7.185  -0.374
  261   2HB   GLU  31           HB1      GLU  31 -14.767   6.783   0.219
  262   1HG   GLU  31           HG2      GLU  31 -14.108   6.961  -1.940
  263   2HG   GLU  31           HG1      GLU  31 -14.898   5.402  -2.172
  264    H    LEU  32           HN       LEU  32 -14.866   4.503   2.130
  265    HA   LEU  32           HA       LEU  32 -12.525   3.247   0.931
  266   1HB   LEU  32           HB2      LEU  32 -12.180   4.334   3.041
  267   2HB   LEU  32           HB1      LEU  32 -13.542   3.486   3.776
  268    HG   LEU  32           HG       LEU  32 -12.378   1.384   3.694
  269   1HD1  LEU  32          HD12      LEU  32 -10.820   2.792   1.655
  270   2HD1  LEU  32          HD11      LEU  32  -9.803   1.905   2.791
  271   3HD1  LEU  32          HD13      LEU  32 -11.058   1.060   1.886
  272   1HD2  LEU  32          HD21      LEU  32 -11.627   3.407   5.307
  273   2HD2  LEU  32          HD23      LEU  32 -10.870   1.816   5.376
  274   3HD2  LEU  32          HD22      LEU  32 -10.094   3.124   4.483
  275    H    LYS  33           HN       LYS  33 -15.483   2.189   2.571
  276    HA   LYS  33           HA       LYS  33 -14.933  -0.600   2.668
  277   1HB   LYS  33           HB2      LYS  33 -16.943   0.814   3.615
  278   2HB   LYS  33           HB1      LYS  33 -17.691   0.441   2.065
  279   1HG   LYS  33           HG2      LYS  33 -16.459  -1.923   3.220
  280   2HG   LYS  33           HG1      LYS  33 -17.631  -1.214   4.332
  281   1HD   LYS  33           HD2      LYS  33 -19.334  -1.204   2.555
  282   2HD   LYS  33           HD1      LYS  33 -18.166  -1.887   1.425
  283   1HE   LYS  33           HE2      LYS  33 -18.057  -3.943   2.614
  284   2HE   LYS  33           HE1      LYS  33 -18.849  -3.255   4.031
  285   1HZ   LYS  33           HZ3      LYS  33 -20.265  -3.250   1.458
  286   2HZ   LYS  33           HZ2      LYS  33 -20.188  -4.692   2.352
  287   3HZ   LYS  33           HZ1      LYS  33 -20.893  -3.306   3.033
  288    H    GLU  34           HN       GLU  34 -16.476   1.396   0.158
  289    HA   GLU  34           HA       GLU  34 -16.862  -0.798  -1.680
  290   1HB   GLU  34           HB2      GLU  34 -17.768   0.807  -3.092
  291   2HB   GLU  34           HB1      GLU  34 -17.895   1.656  -1.555
  292   1HG   GLU  34           HG2      GLU  34 -16.882   3.294  -2.820
  293   2HG   GLU  34           HG1      GLU  34 -15.455   2.481  -2.189
  294    H    LEU  35           HN       LEU  35 -14.323   1.489  -1.013
  295    HA   LEU  35           HA       LEU  35 -12.694   1.177  -3.307
  296   1HB   LEU  35           HB2      LEU  35 -12.507   2.504  -0.880
  297   2HB   LEU  35           HB1      LEU  35 -11.198   1.322  -0.787
  298    HG   LEU  35           HG       LEU  35 -10.489   3.481  -1.833
  299   1HD1  LEU  35          HD12      LEU  35  -9.524   1.170  -2.402
  300   2HD1  LEU  35          HD11      LEU  35 -10.479   1.261  -3.882
  301   3HD1  LEU  35          HD13      LEU  35  -9.224   2.459  -3.569
  302   1HD2  LEU  35          HD23      LEU  35 -12.935   3.055  -3.284
  303   2HD2  LEU  35          HD22      LEU  35 -11.868   4.458  -3.323
  304   3HD2  LEU  35          HD21      LEU  35 -11.595   3.114  -4.429
  305    H    ILE  36           HN       ILE  36 -12.858  -0.764  -0.324
  306    HA   ILE  36           HA       ILE  36 -10.745  -2.578  -1.149
  307    HB   ILE  36           HB       ILE  36 -12.833  -3.435   0.814
  308   1HG1  ILE  36          HG12      ILE  36 -11.040  -1.027   1.104
  309   2HG1  ILE  36          HG11      ILE  36 -12.740  -1.198   1.533
  310   1HG2  ILE  36          HG23      ILE  36 -10.584  -4.598   0.169
  311   2HG2  ILE  36          HG22      ILE  36  -9.847  -3.369   1.195
  312   3HG2  ILE  36          HG21      ILE  36 -11.026  -4.491   1.872
  313   1HD1  ILE  36          HD11      ILE  36 -12.130  -2.744   3.361
  314   2HD1  ILE  36          HD13      ILE  36 -10.427  -2.567   2.938
  315   3HD1  ILE  36          HD12      ILE  36 -11.330  -1.185   3.555
  316    H    ASN  37           HN       ASN  37 -14.277  -2.965  -0.842
  317    HA   ASN  37           HA       ASN  37 -14.318  -5.495  -2.217
  318   1HB   ASN  37           HB2      ASN  37 -16.099  -4.705  -0.637
  319   2HB   ASN  37           HB1      ASN  37 -16.600  -3.535  -1.859
  320   1HD2  ASN  37          HD22      ASN  37 -18.800  -6.364  -2.548
  321   2HD2  ASN  37          HD21      ASN  37 -18.664  -5.068  -1.462
  322    H    ASN  38           HN       ASN  38 -13.645  -2.471  -3.421
  323    HA   ASN  38           HA       ASN  38 -15.122  -2.780  -5.952
  324   1HB   ASN  38           HB2      ASN  38 -14.897  -0.521  -5.206
  325   2HB   ASN  38           HB1      ASN  38 -13.169  -0.717  -4.913
  326   1HD2  ASN  38          HD21      ASN  38 -12.161   0.588  -6.468
  327   2HD2  ASN  38          HD22      ASN  38 -12.507   0.549  -8.129
  328    H    GLU  39           HN       GLU  39 -11.806  -3.051  -4.734
  329    HA   GLU  39           HA       GLU  39 -11.103  -4.424  -7.290
  330   1HB   GLU  39           HB2      GLU  39  -9.935  -2.418  -7.568
  331   2HB   GLU  39           HB1      GLU  39  -9.670  -2.218  -5.839
  332   1HG   GLU  39           HG2      GLU  39  -7.606  -2.852  -7.164
  333   2HG   GLU  39           HG1      GLU  39  -7.976  -3.928  -5.817
  334    H    LEU  40           HN       LEU  40 -10.461  -4.031  -3.828
  335    HA   LEU  40           HA       LEU  40  -8.620  -6.244  -3.653
  336   1HB   LEU  40           HB2      LEU  40 -10.221  -4.666  -1.647
  337   2HB   LEU  40           HB1      LEU  40  -9.276  -6.059  -1.154
  338    HG   LEU  40           HG       LEU  40  -7.384  -4.839  -1.169
  339   1HD1  LEU  40          HD12      LEU  40  -8.192  -3.919  -3.940
  340   2HD1  LEU  40          HD11      LEU  40  -6.645  -3.548  -3.185
  341   3HD1  LEU  40          HD13      LEU  40  -7.069  -5.220  -3.545
  342   1HD2  LEU  40          HD23      LEU  40  -9.093  -3.092  -0.466
  343   2HD2  LEU  40          HD22      LEU  40  -7.566  -2.462  -1.081
  344   3HD2  LEU  40          HD21      LEU  40  -8.997  -2.466  -2.111
  345    H    SER  41           HN       SER  41 -11.879  -6.221  -4.335
  346    HA   SER  41           HA       SER  41 -12.650  -8.555  -2.745
  347   1HB   SER  41           HB2      SER  41 -14.309  -6.841  -3.486
  348   2HB   SER  41           HB1      SER  41 -14.021  -7.320  -5.156
  349    HG   SER  41           HG       SER  41 -15.655  -8.602  -4.620
  350    H    HIS  42           HN       HIS  42 -10.911  -8.029  -5.629
  351    HA   HIS  42           HA       HIS  42 -11.666 -10.310  -7.166
  352   1HB   HIS  42           HB2      HIS  42  -9.828  -8.244  -7.433
  353   2HB   HIS  42           HB1      HIS  42  -8.812  -9.679  -7.292
  354    HD1  HIS  42           HD1      HIS  42 -12.184  -9.185  -9.016
  355    HD2  HIS  42           HD2      HIS  42  -8.310 -10.453  -9.894
  356    HE1  HIS  42           HE1      HIS  42 -12.211  -9.951 -11.429
  357    H    PHE  43           HN       PHE  43  -9.708  -9.982  -4.297
  358    HA   PHE  43           HA       PHE  43  -8.956 -12.868  -4.530
  359   1HB   PHE  43           HB2      PHE  43  -7.640 -11.084  -2.527
  360   2HB   PHE  43           HB1      PHE  43  -6.965 -12.430  -3.442
  361    HD1  PHE  43           HD1      PHE  43  -6.738 -12.093  -6.022
  362    HD2  PHE  43           HD2      PHE  43  -7.224  -8.881  -3.216
  363    HE1  PHE  43           HE1      PHE  43  -5.820 -10.499  -7.689
  364    HE2  PHE  43           HE2      PHE  43  -6.306  -7.288  -4.882
  365    HZ   PHE  43           HZ       PHE  43  -5.605  -8.097  -7.118
  366    H    LEU  44           HN       LEU  44 -11.463 -12.698  -3.729
  367    HA   LEU  44           HA       LEU  44 -11.324 -12.949  -0.750
  368   1HB   LEU  44           HB2      LEU  44 -12.912 -11.154  -2.275
  369   2HB   LEU  44           HB1      LEU  44 -14.003 -12.382  -1.634
  370    HG   LEU  44           HG       LEU  44 -11.997 -11.453   0.307
  371   1HD1  LEU  44          HD13      LEU  44 -14.047  -9.559  -0.870
  372   2HD1  LEU  44          HD12      LEU  44 -13.318  -9.321   0.717
  373   3HD1  LEU  44          HD11      LEU  44 -12.307  -9.307  -0.727
  374   1HD2  LEU  44          HD23      LEU  44 -14.930 -12.077   0.171
  375   2HD2  LEU  44          HD22      LEU  44 -13.693 -12.751   1.234
  376   3HD2  LEU  44          HD21      LEU  44 -14.323 -11.131   1.530
  377    H    GLU  45           HN       GLU  45 -10.788 -15.231  -1.795
  378    HA   GLU  45           HA       GLU  45 -13.384 -16.701  -1.998
  379   1HB   GLU  45           HB2      GLU  45 -10.782 -17.445  -3.366
  380   2HB   GLU  45           HB1      GLU  45 -12.333 -18.266  -3.536
  381   1HG   GLU  45           HG2      GLU  45 -13.041 -15.705  -4.157
  382   2HG   GLU  45           HG1      GLU  45 -11.388 -15.753  -4.773
  383    H    GLU  46           HN       GLU  46 -10.040 -16.706  -0.872
  384    HA   GLU  46           HA       GLU  46 -10.775 -18.932   0.990
  385   1HB   GLU  46           HB2      GLU  46  -8.073 -18.332  -0.256
  386   2HB   GLU  46           HB1      GLU  46  -8.381 -19.592   0.939
  387   1HG   GLU  46           HG2      GLU  46 -10.226 -19.687  -1.339
  388   2HG   GLU  46           HG1      GLU  46  -8.540 -19.924  -1.799
  389    H    ILE  47           HN       ILE  47  -8.840 -15.986   0.530
  390    HA   ILE  47           HA       ILE  47  -8.112 -14.397   2.093
  391    HB   ILE  47           HB       ILE  47 -10.081 -15.685   3.998
  392   1HG1  ILE  47          HG12      ILE  47 -10.620 -13.580   1.876
  393   2HG1  ILE  47          HG11      ILE  47 -11.138 -15.262   1.776
  394   1HG2  ILE  47          HG22      ILE  47  -8.945 -12.895   3.666
  395   2HG2  ILE  47          HG21      ILE  47 -10.278 -13.290   4.754
  396   3HG2  ILE  47          HG23      ILE  47  -8.683 -13.997   5.019
  397   1HD1  ILE  47          HD12      ILE  47 -11.854 -13.784   4.260
  398   2HD1  ILE  47          HD11      ILE  47 -12.719 -13.338   2.788
  399   3HD1  ILE  47          HD13      ILE  47 -12.771 -15.001   3.373
  400    H    LYS  48           HN       LYS  48  -6.157 -14.578   3.067
  401    HA   LYS  48           HA       LYS  48  -5.520 -17.089   4.521
  402   1HB   LYS  48           HB2      LYS  48  -4.065 -15.491   2.741
  403   2HB   LYS  48           HB1      LYS  48  -3.349 -15.157   4.317
  404   1HG   LYS  48           HG2      LYS  48  -3.779 -17.938   4.268
  405   2HG   LYS  48           HG1      LYS  48  -3.114 -17.534   2.685
  406   1HD   LYS  48           HD2      LYS  48  -1.227 -16.386   3.724
  407   2HD   LYS  48           HD1      LYS  48  -1.910 -16.665   5.328
  408   1HE   LYS  48           HE2      LYS  48  -1.755 -19.115   4.945
  409   2HE   LYS  48           HE1      LYS  48  -1.000 -18.802   3.382
  410   1HZ   LYS  48           HZ2      LYS  48   0.104 -17.652   5.865
  411   2HZ   LYS  48           HZ1      LYS  48   0.508 -19.228   5.379
  412   3HZ   LYS  48           HZ3      LYS  48   0.881 -17.912   4.376
  413    H    GLU  49           HN       GLU  49  -5.021 -13.568   4.983
  414    HA   GLU  49           HA       GLU  49  -4.705 -14.010   7.883
  415   1HB   GLU  49           HB2      GLU  49  -4.101 -11.870   5.966
  416   2HB   GLU  49           HB1      GLU  49  -4.781 -11.274   7.480
  417   1HG   GLU  49           HG2      GLU  49  -2.476 -13.234   7.337
  418   2HG   GLU  49           HG1      GLU  49  -2.268 -11.491   7.501
  419    H    GLN  50           HN       GLN  50  -6.935 -14.807   8.189
  420    HA   GLN  50           HA       GLN  50  -9.263 -13.302   7.572
  421   1HB   GLN  50           HB2      GLN  50  -8.933 -15.728   8.584
  422   2HB   GLN  50           HB1      GLN  50  -9.118 -14.879  10.118
  423   1HG   GLN  50           HG2      GLN  50 -11.070 -14.432   7.864
  424   2HG   GLN  50           HG1      GLN  50 -11.259 -15.796   8.969
  425   1HE2  GLN  50          HE22      GLN  50 -13.058 -12.745  10.315
  426   2HE2  GLN  50          HE21      GLN  50 -13.108 -13.528   8.811
  427    H    GLU  51           HN       GLU  51  -6.832 -12.828  10.011
  428    HA   GLU  51           HA       GLU  51  -8.508 -11.134  11.704
  429   1HB   GLU  51           HB2      GLU  51  -6.360 -12.488  12.351
  430   2HB   GLU  51           HB1      GLU  51  -5.500 -11.081  11.724
  431   1HG   GLU  51           HG2      GLU  51  -6.610  -9.617  13.287
  432   2HG   GLU  51           HG1      GLU  51  -7.696 -10.907  13.805
  433    H    VAL  52           HN       VAL  52  -6.088 -10.652   9.155
  434    HA   VAL  52           HA       VAL  52  -5.902  -7.807   9.405
  435    HB   VAL  52           HB       VAL  52  -5.530  -9.581   6.974
  436   1HG1  VAL  52          HG11      VAL  52  -5.706  -6.774   7.134
  437   2HG1  VAL  52          HG13      VAL  52  -3.984  -7.137   7.021
  438   3HG1  VAL  52          HG12      VAL  52  -5.092  -7.723   5.781
  439   1HG2  VAL  52          HG21      VAL  52  -4.078  -9.962   9.050
  440   2HG2  VAL  52          HG23      VAL  52  -3.211  -9.607   7.555
  441   3HG2  VAL  52          HG22      VAL  52  -3.429  -8.347   8.767
  442    H    VAL  53           HN       VAL  53  -7.748  -9.749   7.024
  443    HA   VAL  53           HA       VAL  53  -9.229  -7.502   6.033
  444    HB   VAL  53           HB       VAL  53  -9.901 -10.461   5.993
  445   1HG1  VAL  53          HG11      VAL  53 -11.411  -8.125   5.199
  446   2HG1  VAL  53          HG13      VAL  53 -11.016  -9.099   3.784
  447   3HG1  VAL  53          HG12      VAL  53 -11.885  -9.822   5.138
  448   1HG2  VAL  53          HG21      VAL  53  -7.746  -9.701   4.889
  449   2HG2  VAL  53          HG23      VAL  53  -8.905 -10.459   3.798
  450   3HG2  VAL  53          HG22      VAL  53  -8.729  -8.705   3.817
  451    H    ASP  54           HN       ASP  54  -9.708  -9.674   8.748
  452    HA   ASP  54           HA       ASP  54 -12.472  -8.902   9.205
  453   1HB   ASP  54           HB2      ASP  54 -11.602 -11.028  10.079
  454   2HB   ASP  54           HB1      ASP  54 -10.432 -10.158  11.072
  455    H    LYS  55           HN       LYS  55  -9.361  -7.562   9.960
  456    HA   LYS  55           HA       LYS  55 -10.342  -5.864  12.128
  457   1HB   LYS  55           HB2      LYS  55  -7.797  -6.601  11.056
  458   2HB   LYS  55           HB1      LYS  55  -7.921  -4.843  10.997
  459   1HG   LYS  55           HG2      LYS  55  -7.598  -4.725  13.219
  460   2HG   LYS  55           HG1      LYS  55  -9.002  -5.756  13.494
  461   1HD   LYS  55           HD2      LYS  55  -7.544  -7.297  14.274
  462   2HD   LYS  55           HD1      LYS  55  -7.066  -7.533  12.593
  463   1HE   LYS  55           HE2      LYS  55  -5.183  -6.167  12.794
  464   2HE   LYS  55           HE1      LYS  55  -5.842  -5.295  14.177
  465   1HZ   LYS  55           HZ2      LYS  55  -4.971  -8.135  14.193
  466   2HZ   LYS  55           HZ1      LYS  55  -4.084  -6.832  14.828
  467   3HZ   LYS  55           HZ3      LYS  55  -5.568  -7.268  15.526
  468    H    VAL  56           HN       VAL  56  -9.233  -5.248   8.765
  469    HA   VAL  56           HA       VAL  56 -10.017  -2.495   8.780
  470    HB   VAL  56           HB       VAL  56  -9.842  -2.689   6.308
  471   1HG1  VAL  56          HG11      VAL  56  -7.817  -3.289   8.259
  472   2HG1  VAL  56          HG13      VAL  56  -7.481  -4.186   6.779
  473   3HG1  VAL  56          HG12      VAL  56  -7.646  -2.431   6.727
  474   1HG2  VAL  56          HG22      VAL  56  -9.746  -5.618   7.013
  475   2HG2  VAL  56          HG21      VAL  56 -10.750  -4.811   5.807
  476   3HG2  VAL  56          HG23      VAL  56  -9.021  -5.017   5.522
  477    H    MET  57           HN       MET  57 -11.650  -5.415   7.538
  478    HA   MET  57           HA       MET  57 -14.028  -4.081   6.660
  479   1HB   MET  57           HB2      MET  57 -13.500  -6.399   6.013
  480   2HB   MET  57           HB1      MET  57 -13.644  -6.907   7.698
  481   1HG   MET  57           HG2      MET  57 -15.724  -7.415   6.519
  482   2HG   MET  57           HG1      MET  57 -16.013  -6.135   7.696
  483   1HE   MET  57           HE1      MET  57 -16.088  -7.324   4.166
  484   2HE   MET  57           HE3      MET  57 -15.921  -5.896   3.135
  485   3HE   MET  57           HE2      MET  57 -14.542  -6.486   4.060
  486    H    GLU  58           HN       GLU  58 -12.837  -4.968   9.794
  487    HA   GLU  58           HA       GLU  58 -15.401  -4.947  11.152
  488   1HB   GLU  58           HB2      GLU  58 -12.575  -5.203  11.885
  489   2HB   GLU  58           HB1      GLU  58 -13.499  -4.270  13.061
  490   1HG   GLU  58           HG2      GLU  58 -15.246  -6.149  12.942
  491   2HG   GLU  58           HG1      GLU  58 -14.007  -7.092  12.115
  492    H    THR  59           HN       THR  59 -12.723  -2.533  11.073
  493    HA   THR  59           HA       THR  59 -14.227  -0.496  12.409
  494    HB   THR  59           HB       THR  59 -12.291   0.380  10.334
  495    HG1  THR  59           HG1      THR  59 -11.597  -1.312  12.499
  496   1HG2  THR  59          HG23      THR  59 -12.882   0.900  13.236
  497   2HG2  THR  59          HG22      THR  59 -11.352   1.428  12.532
  498   3HG2  THR  59          HG21      THR  59 -12.876   2.034  11.884
  499    H    LEU  60           HN       LEU  60 -14.102  -1.609   9.115
  500    HA   LEU  60           HA       LEU  60 -15.378   0.602   7.824
  501   1HB   LEU  60           HB2      LEU  60 -14.874  -2.272   7.239
  502   2HB   LEU  60           HB1      LEU  60 -16.169  -1.504   6.324
  503    HG   LEU  60           HG       LEU  60 -13.369  -0.375   6.583
  504   1HD1  LEU  60          HD13      LEU  60 -14.668  -2.107   4.476
  505   2HD1  LEU  60          HD12      LEU  60 -13.291  -1.070   4.105
  506   3HD1  LEU  60          HD11      LEU  60 -13.128  -2.358   5.299
  507   1HD2  LEU  60          HD23      LEU  60 -15.866   0.398   5.078
  508   2HD2  LEU  60          HD22      LEU  60 -14.819   1.410   6.071
  509   3HD2  LEU  60          HD21      LEU  60 -14.278   0.876   4.481
  510    H    ASP  61           HN       ASP  61 -16.727  -2.482   9.016
  511    HA   ASP  61           HA       ASP  61 -19.473  -1.540   8.688
  512   1HB   ASP  61           HB2      ASP  61 -18.181  -4.039   9.015
  513   2HB   ASP  61           HB1      ASP  61 -19.239  -3.843  10.413
  514    H    GLU  62           HN       GLU  62 -17.083  -0.982  10.970
  515    HA   GLU  62           HA       GLU  62 -18.673  -1.085  13.388
  516   1HB   GLU  62           HB2      GLU  62 -16.096  -1.054  13.168
  517   2HB   GLU  62           HB1      GLU  62 -16.268   0.690  12.969
  518   1HG   GLU  62           HG2      GLU  62 -17.489   0.805  15.120
  519   2HG   GLU  62           HG1      GLU  62 -17.278  -0.933  15.325
  520    H    ASP  63           HN       ASP  63 -18.148   1.289  10.861
  521    HA   ASP  63           HA       ASP  63 -20.243   2.969  12.109
  522   1HB   ASP  63           HB2      ASP  63 -17.562   4.056  11.201
  523   2HB   ASP  63           HB1      ASP  63 -18.922   5.018  11.781
  524    H    GLY  64           HN       GLY  64 -17.979   2.983   9.346
  525   1HA   GLY  64           HA2      GLY  64 -18.498   2.937   7.034
  526   2HA   GLY  64           HA1      GLY  64 -20.206   2.809   7.456
  527    H    ASP  65           HN       ASP  65 -19.278   5.293   9.301
  528    HA   ASP  65           HA       ASP  65 -19.567   7.324   7.129
  529   1HB   ASP  65           HB2      ASP  65 -21.689   6.787   8.546
  530   2HB   ASP  65           HB1      ASP  65 -20.859   7.666   9.829
  531    H    GLY  66           HN       GLY  66 -17.276   6.276   8.854
  532   1HA   GLY  66           HA2      GLY  66 -16.629   8.634  10.497
  533   2HA   GLY  66           HA1      GLY  66 -15.666   7.162  10.383
  534    H    GLU  67           HN       GLU  67 -14.126   9.273  10.202
  535    HA   GLU  67           HA       GLU  67 -13.829   9.931   7.305
  536   1HB   GLU  67           HB2      GLU  67 -12.891  11.305   9.828
  537   2HB   GLU  67           HB1      GLU  67 -12.226  11.711   8.246
  538   1HG   GLU  67           HG2      GLU  67 -14.522  12.186   7.423
  539   2HG   GLU  67           HG1      GLU  67 -15.152  11.846   9.035
  540    H    CYS  68           HN       CYS  68 -11.920   9.391   6.242
  541    HA   CYS  68           HA       CYS  68  -9.945   7.809   7.841
  542   1HB   CYS  68           HB2      CYS  68 -11.171   7.397   5.160
  543   2HB   CYS  68           HB1      CYS  68  -9.465   6.984   5.320
  544    HG   CYS  68           HG       CYS  68 -11.443   5.102   6.127
  545    H    ASP  69           HN       ASP  69  -7.685   8.008   7.131
  546    HA   ASP  69           HA       ASP  69  -7.144  10.730   6.047
  547   1HB   ASP  69           HB2      ASP  69  -5.362   8.798   7.567
  548   2HB   ASP  69           HB1      ASP  69  -4.866  10.393   7.002
  549    H    PHE  70           HN       PHE  70  -4.502  10.276   5.177
  550    HA   PHE  70           HA       PHE  70  -5.068   8.859   2.653
  551   1HB   PHE  70           HB2      PHE  70  -2.575   9.668   2.232
  552   2HB   PHE  70           HB1      PHE  70  -3.919  10.800   2.115
  553    HD1  PHE  70           HD2      PHE  70  -4.348  12.442   3.884
  554    HD2  PHE  70           HD1      PHE  70  -1.029   9.725   4.116
  555    HE1  PHE  70           HE2      PHE  70  -3.347  13.815   5.688
  556    HE2  PHE  70           HE1      PHE  70  -0.027  11.100   5.920
  557    HZ   PHE  70           HZ       PHE  70  -1.187  13.144   6.706
  558    H    GLN  71           HN       GLN  71  -2.660   8.680   5.297
  559    HA   GLN  71           HA       GLN  71  -1.436   6.271   4.254
  560   1HB   GLN  71           HB2      GLN  71  -1.422   7.175   7.145
  561   2HB   GLN  71           HB1      GLN  71  -0.213   6.195   6.316
  562   1HG   GLN  71           HG2      GLN  71  -0.010   8.278   4.730
  563   2HG   GLN  71           HG1      GLN  71  -0.734   9.142   6.087
  564   1HE2  GLN  71          HE22      GLN  71   2.958   7.407   6.677
  565   2HE2  GLN  71          HE21      GLN  71   1.883   6.697   5.573
  566    H    GLU  72           HN       GLU  72  -4.341   6.920   5.949
  567    HA   GLU  72           HA       GLU  72  -4.546   4.285   7.204
  568   1HB   GLU  72           HB2      GLU  72  -6.284   6.709   6.962
  569   2HB   GLU  72           HB1      GLU  72  -7.065   5.171   7.320
  570   1HG   GLU  72           HG2      GLU  72  -4.694   5.447   8.938
  571   2HG   GLU  72           HG1      GLU  72  -5.715   6.871   9.134
  572    H    PHE  73           HN       PHE  73  -6.419   5.925   4.621
  573    HA   PHE  73           HA       PHE  73  -7.676   3.519   3.698
  574   1HB   PHE  73           HB2      PHE  73  -8.748   5.469   2.961
  575   2HB   PHE  73           HB1      PHE  73  -7.232   6.273   2.566
  576    HD1  PHE  73           HD2      PHE  73  -8.651   2.933   1.589
  577    HD2  PHE  73           HD1      PHE  73  -7.190   6.757   0.290
  578    HE1  PHE  73           HE2      PHE  73  -8.875   2.219  -0.776
  579    HE2  PHE  73           HE1      PHE  73  -7.411   6.044  -2.073
  580    HZ   PHE  73           HZ       PHE  73  -8.252   3.776  -2.607
  581    H    MET  74           HN       MET  74  -4.494   4.799   3.311
  582    HA   MET  74           HA       MET  74  -3.896   3.319   0.861
  583   1HB   MET  74           HB2      MET  74  -2.445   5.120   2.721
  584   2HB   MET  74           HB1      MET  74  -1.454   3.904   1.920
  585   1HG   MET  74           HG2      MET  74  -3.274   5.916   0.561
  586   2HG   MET  74           HG1      MET  74  -1.511   5.939   0.563
  587   1HE   MET  74           HE2      MET  74  -0.336   3.371   0.063
  588   2HE   MET  74           HE1      MET  74  -1.741   2.494   0.662
  589   3HE   MET  74           HE3      MET  74  -1.124   2.180  -0.965
  590    H    ALA  75           HN       ALA  75  -2.921   3.025   4.293
  591    HA   ALA  75           HA       ALA  75  -1.641   0.467   3.917
  592   1HB   ALA  75           HB3      ALA  75  -1.152   1.952   5.848
  593   2HB   ALA  75           HB2      ALA  75  -2.789   1.685   6.449
  594   3HB   ALA  75           HB1      ALA  75  -1.648   0.343   6.374
  595    H    PHE  76           HN       PHE  76  -4.901   1.465   4.115
  596    HA   PHE  76           HA       PHE  76  -5.974  -1.027   5.184
  597   1HB   PHE  76           HB2      PHE  76  -7.011   1.567   4.254
  598   2HB   PHE  76           HB1      PHE  76  -8.059   0.206   3.862
  599    HD1  PHE  76           HD1      PHE  76  -5.954   1.410   6.732
  600    HD2  PHE  76           HD2      PHE  76  -9.630  -0.416   5.466
  601    HE1  PHE  76           HE1      PHE  76  -6.727   1.330   9.086
  602    HE2  PHE  76           HE2      PHE  76 -10.402  -0.496   7.821
  603    HZ   PHE  76           HZ       PHE  76  -8.950   0.377   9.632
  604    H    VAL  77           HN       VAL  77  -5.473   0.401   1.984
  605    HA   VAL  77           HA       VAL  77  -6.810  -1.755   0.565
  606    HB   VAL  77           HB       VAL  77  -4.878   0.393  -0.360
  607   1HG1  VAL  77          HG13      VAL  77  -5.413  -1.948  -1.687
  608   2HG1  VAL  77          HG12      VAL  77  -6.681  -0.893  -2.308
  609   3HG1  VAL  77          HG11      VAL  77  -4.988  -0.429  -2.478
  610   1HG2  VAL  77          HG22      VAL  77  -7.564   0.518   0.444
  611   2HG2  VAL  77          HG21      VAL  77  -6.685   1.740  -0.476
  612   3HG2  VAL  77          HG23      VAL  77  -7.622   0.507  -1.319
  613    H    SER  78           HN       SER  78  -3.520  -1.118   1.649
  614    HA   SER  78           HA       SER  78  -2.340  -3.221   0.018
  615   1HB   SER  78           HB2      SER  78  -1.241  -1.844   2.483
  616   2HB   SER  78           HB1      SER  78  -0.316  -2.810   1.337
  617    HG   SER  78           HG       SER  78  -1.868  -0.644   0.438
  618    H    MET  79           HN       MET  79  -3.482  -2.971   3.380
  619    HA   MET  79           HA       MET  79  -2.486  -5.464   4.301
  620   1HB   MET  79           HB2      MET  79  -4.964  -3.907   5.077
  621   2HB   MET  79           HB1      MET  79  -4.364  -5.305   5.962
  622   1HG   MET  79           HG2      MET  79  -2.212  -3.437   5.469
  623   2HG   MET  79           HG1      MET  79  -3.552  -2.632   6.282
  624   1HE   MET  79           HE1      MET  79  -4.216  -2.657   8.133
  625   2HE   MET  79           HE3      MET  79  -4.428  -4.067   9.182
  626   3HE   MET  79           HE2      MET  79  -3.117  -2.931   9.483
  627    H    VAL  80           HN       VAL  80  -5.708  -4.693   2.922
  628    HA   VAL  80           HA       VAL  80  -6.612  -7.416   2.993
  629    HB   VAL  80           HB       VAL  80  -8.252  -6.494   1.190
  630   1HG1  VAL  80          HG12      VAL  80  -8.001  -5.978   4.075
  631   2HG1  VAL  80          HG11      VAL  80  -9.081  -4.861   3.238
  632   3HG1  VAL  80          HG13      VAL  80  -9.374  -6.599   3.160
  633   1HG2  VAL  80          HG22      VAL  80  -6.406  -4.425   1.173
  634   2HG2  VAL  80          HG21      VAL  80  -8.046  -4.342   0.528
  635   3HG2  VAL  80          HG23      VAL  80  -7.717  -3.792   2.169
  636    H    THR  81           HN       THR  81  -4.952  -5.506   0.497
  637    HA   THR  81           HA       THR  81  -5.288  -7.450  -1.593
  638    HB   THR  81           HB       THR  81  -2.972  -5.523  -1.352
  639    HG1  THR  81           HG1      THR  81  -5.690  -5.117  -1.924
  640   1HG2  THR  81          HG21      THR  81  -3.136  -7.316  -3.189
  641   2HG2  THR  81          HG23      THR  81  -4.501  -6.384  -3.806
  642   3HG2  THR  81          HG22      THR  81  -2.902  -5.650  -3.716
  643    H    THR  82           HN       THR  82  -3.496  -7.625   1.261
  644    HA   THR  82           HA       THR  82  -1.703  -9.679   0.026
  645    HB   THR  82           HB       THR  82  -0.156  -9.194   1.967
  646    HG1  THR  82           HG1      THR  82  -0.543  -7.133   2.953
  647   1HG2  THR  82          HG22      THR  82   0.123  -8.241  -0.345
  648   2HG2  THR  82          HG21      THR  82  -0.738  -6.804   0.202
  649   3HG2  THR  82          HG23      THR  82   0.810  -7.235   0.930
  650    H    ALA  83           HN       ALA  83  -4.254  -9.111   2.184
  651    HA   ALA  83           HA       ALA  83  -3.614 -11.430   3.908
  652   1HB   ALA  83           HB2      ALA  83  -5.547  -9.185   3.964
  653   2HB   ALA  83           HB1      ALA  83  -6.148 -10.713   4.606
  654   3HB   ALA  83           HB3      ALA  83  -4.700  -9.978   5.293
  655    H    CYS  84           HN       CYS  84  -3.830 -12.219   1.272
  656    HA   CYS  84           HA       CYS  84  -6.413 -13.714   1.316
  657   1HB   CYS  84           HB2      CYS  84  -5.130 -12.783  -1.251
  658   2HB   CYS  84           HB1      CYS  84  -6.782 -13.343  -0.989
  659    HG   CYS  84           HG       CYS  84  -7.040 -11.081   0.534
  660    H    HIS  85           HN       HIS  85  -6.215 -15.881   0.826
  661    HA   HIS  85           HA       HIS  85  -3.626 -17.106   0.937
  662   1HB   HIS  85           HB2      HIS  85  -6.330 -17.957   1.009
  663   2HB   HIS  85           HB1      HIS  85  -5.557 -18.845  -0.303
  664    HD1  HIS  85           HD1      HIS  85  -6.301 -19.534   2.951
  665    HD2  HIS  85           HD2      HIS  85  -2.628 -19.445   0.978
  666    HE1  HIS  85           HE1      HIS  85  -4.718 -20.958   4.321
  667    H    GLU  86           HN       GLU  86  -5.959 -17.187  -1.787
  668    HA   GLU  86           HA       GLU  86  -3.748 -17.765  -3.632
  669   1HB   GLU  86           HB2      GLU  86  -6.736 -17.624  -3.844
  670   2HB   GLU  86           HB1      GLU  86  -5.770 -17.501  -5.315
  671   1HG   GLU  86           HG2      GLU  86  -4.727 -19.622  -3.678
  672   2HG   GLU  86           HG1      GLU  86  -6.462 -19.857  -3.893
  673    H    PHE  87           HN       PHE  87  -2.472 -15.997  -3.995
  674    HA   PHE  87           HA       PHE  87  -3.647 -13.751  -5.445
  675   1HB   PHE  87           HB2      PHE  87  -3.260 -12.028  -3.924
  676   2HB   PHE  87           HB1      PHE  87  -3.827 -13.310  -2.859
  677    HD1  PHE  87           HD1      PHE  87  -1.342 -15.052  -2.888
  678    HD2  PHE  87           HD2      PHE  87  -1.843 -10.812  -2.454
  679    HE1  PHE  87           HE1      PHE  87   0.789 -14.931  -1.630
  680    HE2  PHE  87           HE2      PHE  87   0.289 -10.691  -1.194
  681    HZ   PHE  87           HZ       PHE  87   1.605 -12.751  -0.781
  682    H    PHE  88           HN       PHE  88  -1.490 -11.995  -5.355
  683    HA   PHE  88           HA       PHE  88   0.670 -11.706  -6.230
  684   1HB   PHE  88           HB2      PHE  88   0.846 -14.273  -4.730
  685   2HB   PHE  88           HB1      PHE  88   2.106 -13.977  -5.927
  686    HD1  PHE  88           HD2      PHE  88   0.432 -11.143  -4.335
  687    HD2  PHE  88           HD1      PHE  88   3.816 -13.782  -4.143
  688    HE1  PHE  88           HE2      PHE  88   1.558  -9.590  -2.766
  689    HE2  PHE  88           HE1      PHE  88   4.940 -12.230  -2.573
  690    HZ   PHE  88           HZ       PHE  88   3.810 -10.134  -1.885
  691    H    GLU  89           HN       GLU  89  -1.325 -12.304  -7.972
  692    HA   GLU  89           HA       GLU  89  -1.502 -14.363  -9.669
  693   1HB   GLU  89           HB2      GLU  89  -1.732 -11.549  -9.939
  694   2HB   GLU  89           HB1      GLU  89  -0.867 -12.134 -11.359
  695   1HG   GLU  89           HG2      GLU  89  -2.633 -13.768 -11.797
  696   2HG   GLU  89           HG1      GLU  89  -3.481 -13.279 -10.327
  697    H    HIS  90           HN       HIS  90   0.375 -15.721  -9.605
  698    HA   HIS  90           HA       HIS  90   2.683 -14.685 -11.201
  699   1HB   HIS  90           HB2      HIS  90   4.010 -16.486 -10.028
  700   2HB   HIS  90           HB1      HIS  90   3.428 -15.208  -8.964
  701    HD1  HIS  90           HD1      HIS  90   2.755 -18.799  -9.908
  702    HD2  HIS  90           HD2      HIS  90   1.551 -16.042  -7.026
  703    HE1  HIS  90           HE1      HIS  90   1.450 -20.100  -8.171
  704    H    GLU  91           HN       GLU  91   0.021 -16.281 -11.775
  705    HA   GLU  91           HA       GLU  91   1.371 -18.398 -13.403
  706   1HB   GLU  91           HB2      GLU  91  -0.444 -18.861 -11.414
  707   2HB   GLU  91           HB1      GLU  91  -1.508 -18.727 -12.815
  708   1HG   GLU  91           HG2      GLU  91  -0.156 -20.406 -14.009
  709   2HG   GLU  91           HG1      GLU  91   0.915 -20.539 -12.613
  710   1H    MET   0           HT2      MET   0 -10.480  -3.365 -15.830
  711   2H    MET   0           HT1      MET   0  -9.351  -4.592 -16.154
  712   3H    MET   0           HT3      MET   0  -9.887  -4.335 -14.566
  713    HA   MET   0           HA       MET   0  -7.811  -3.338 -14.572
  714   1HB   MET   0           HB2      MET   0  -7.337  -1.651 -16.514
  715   2HB   MET   0           HB1      MET   0  -7.157  -3.377 -16.825
  716   1HG   MET   0           HG2      MET   0  -9.479  -3.432 -17.718
  717   2HG   MET   0           HG1      MET   0  -9.591  -1.689 -17.477
  718   1HE   MET   0           HE2      MET   0  -9.268  -0.139 -19.169
  719   2HE   MET   0           HE1      MET   0  -7.649  -0.024 -18.483
  720   3HE   MET   0           HE3      MET   0  -7.870  -0.050 -20.238
  721    H    SER   1           HN       SER   1  -8.785  -2.260 -12.790
  722    HA   SER   1           HA       SER   1 -10.212   0.280 -13.422
  723   1HB   SER   1           HB2      SER   1 -11.014   0.208 -11.119
  724   2HB   SER   1           HB1      SER   1 -11.336  -1.341 -11.889
  725    HG   SER   1           HG       SER   1 -10.364  -1.938 -10.064
  726    H    GLU   2           HN       GLU   2  -9.715   1.847 -11.306
  727    HA   GLU   2           HA       GLU   2  -6.975   2.689 -11.734
  728   1HB   GLU   2           HB2      GLU   2  -9.328   3.860 -10.745
  729   2HB   GLU   2           HB1      GLU   2  -8.215   3.851  -9.378
  730   1HG   GLU   2           HG2      GLU   2  -7.704   5.869 -10.484
  731   2HG   GLU   2           HG1      GLU   2  -6.466   4.757 -11.067
  732    H    LEU   3           HN       LEU   3  -8.713   1.295  -8.941
  733    HA   LEU   3           HA       LEU   3  -6.346   1.152  -7.279
  734   1HB   LEU   3           HB2      LEU   3  -8.821   1.102  -6.549
  735   2HB   LEU   3           HB1      LEU   3  -8.787  -0.601  -6.989
  736    HG   LEU   3           HG       LEU   3  -6.787  -0.880  -5.484
  737   1HD1  LEU   3          HD11      LEU   3  -7.439   2.012  -4.981
  738   2HD1  LEU   3          HD13      LEU   3  -6.715   1.036  -3.702
  739   3HD1  LEU   3          HD12      LEU   3  -5.865   1.256  -5.231
  740   1HD2  LEU   3          HD21      LEU   3  -9.546  -0.185  -4.615
  741   2HD2  LEU   3          HD23      LEU   3  -8.629  -1.670  -4.364
  742   3HD2  LEU   3          HD22      LEU   3  -8.325  -0.264  -3.344
  743    H    GLU   4           HN       GLU   4  -8.160  -1.263  -9.158
  744    HA   GLU   4           HA       GLU   4  -6.587  -3.513  -8.546
  745   1HB   GLU   4           HB2      GLU   4  -8.711  -3.549  -9.868
  746   2HB   GLU   4           HB1      GLU   4  -7.831  -2.877 -11.240
  747   1HG   GLU   4           HG2      GLU   4  -6.223  -4.873 -10.955
  748   2HG   GLU   4           HG1      GLU   4  -7.478  -5.575  -9.931
  749    H    LYS   5           HN       LYS   5  -6.097  -1.200 -11.244
  750    HA   LYS   5           HA       LYS   5  -3.732  -2.505 -12.198
  751   1HB   LYS   5           HB2      LYS   5  -4.916   0.231 -12.541
  752   2HB   LYS   5           HB1      LYS   5  -3.275  -0.075 -13.113
  753   1HG   LYS   5           HG2      LYS   5  -4.050  -1.911 -14.507
  754   2HG   LYS   5           HG1      LYS   5  -5.685  -1.756 -13.859
  755   1HD   LYS   5           HD2      LYS   5  -5.851  -0.564 -15.863
  756   2HD   LYS   5           HD1      LYS   5  -5.494   0.719 -14.707
  757   1HE   LYS   5           HE2      LYS   5  -3.988   1.107 -16.496
  758   2HE   LYS   5           HE1      LYS   5  -3.015   0.292 -15.270
  759   1HZ   LYS   5           HZ1      LYS   5  -4.418  -1.299 -17.303
  760   2HZ   LYS   5           HZ3      LYS   5  -2.965  -0.526 -17.713
  761   3HZ   LYS   5           HZ2      LYS   5  -2.996  -1.658 -16.447
  762    H    ALA   6           HN       ALA   6  -4.167   0.097  -9.806
  763    HA   ALA   6           HA       ALA   6  -1.279   0.435  -9.490
  764   1HB   ALA   6           HB1      ALA   6  -3.270   2.124  -9.025
  765   2HB   ALA   6           HB3      ALA   6  -3.232   1.378  -7.426
  766   3HB   ALA   6           HB2      ALA   6  -1.794   2.179  -8.059
  767    H    MET   7           HN       MET   7  -3.696  -0.383  -7.001
  768    HA   MET   7           HA       MET   7  -2.032  -1.474  -5.093
  769   1HB   MET   7           HB2      MET   7  -4.488  -1.203  -4.837
  770   2HB   MET   7           HB1      MET   7  -4.736  -2.595  -5.894
  771   1HG   MET   7           HG2      MET   7  -4.852  -3.446  -3.662
  772   2HG   MET   7           HG1      MET   7  -3.265  -3.910  -4.274
  773   1HE   MET   7           HE3      MET   7  -1.428  -3.726  -3.377
  774   2HE   MET   7           HE2      MET   7  -0.917  -2.057  -3.606
  775   3HE   MET   7           HE1      MET   7  -0.861  -2.776  -1.998
  776    H    VAL   8           HN       VAL   8  -3.461  -3.249  -7.841
  777    HA   VAL   8           HA       VAL   8  -2.136  -5.722  -7.156
  778    HB   VAL   8           HB       VAL   8  -3.112  -4.924  -9.909
  779   1HG1  VAL   8          HG12      VAL   8  -1.819  -7.020  -9.728
  780   2HG1  VAL   8          HG11      VAL   8  -2.904  -7.578  -8.453
  781   3HG1  VAL   8          HG13      VAL   8  -3.512  -7.350 -10.093
  782   1HG2  VAL   8          HG22      VAL   8  -4.722  -4.619  -7.825
  783   2HG2  VAL   8          HG21      VAL   8  -5.311  -5.413  -9.285
  784   3HG2  VAL   8          HG23      VAL   8  -4.808  -6.379  -7.896
  785    H    ALA   9           HN       ALA   9  -1.265  -2.952  -9.156
  786    HA   ALA   9           HA       ALA   9   0.968  -4.143 -10.498
  787   1HB   ALA   9           HB2      ALA   9   0.301  -1.299  -9.730
  788   2HB   ALA   9           HB1      ALA   9   1.792  -1.706 -10.580
  789   3HB   ALA   9           HB3      ALA   9   0.230  -2.039 -11.328
  790    H    LEU  10           HN       LEU  10   0.569  -2.783  -7.277
  791    HA   LEU  10           HA       LEU  10   3.358  -2.579  -6.628
  792   1HB   LEU  10           HB2      LEU  10   0.879  -2.161  -5.301
  793   2HB   LEU  10           HB1      LEU  10   1.804  -3.296  -4.315
  794    HG   LEU  10           HG       LEU  10   3.008  -0.750  -5.417
  795   1HD1  LEU  10          HD11      LEU  10   1.002  -0.983  -3.415
  796   2HD1  LEU  10          HD13      LEU  10   2.523  -0.646  -2.589
  797   3HD1  LEU  10          HD12      LEU  10   1.939   0.448  -3.844
  798   1HD2  LEU  10          HD21      LEU  10   4.507  -2.628  -4.673
  799   2HD2  LEU  10          HD23      LEU  10   4.706  -1.156  -3.723
  800   3HD2  LEU  10          HD22      LEU  10   3.782  -2.510  -3.069
  801    H    ILE  11           HN       ILE  11   0.955  -5.163  -6.048
  802    HA   ILE  11           HA       ILE  11   2.665  -7.008  -4.768
  803    HB   ILE  11           HB       ILE  11   0.278  -7.350  -6.587
  804   1HG1  ILE  11          HG12      ILE  11  -0.279  -8.509  -4.177
  805   2HG1  ILE  11          HG11      ILE  11   0.855  -7.251  -3.687
  806   1HG2  ILE  11          HG21      ILE  11   2.114  -9.456  -5.460
  807   2HG2  ILE  11          HG23      ILE  11   0.396  -9.796  -5.673
  808   3HG2  ILE  11          HG22      ILE  11   1.389  -9.363  -7.065
  809   1HD1  ILE  11          HD12      ILE  11  -0.656  -5.795  -5.355
  810   2HD1  ILE  11          HD11      ILE  11  -1.862  -6.991  -4.884
  811   3HD1  ILE  11          HD13      ILE  11  -1.076  -6.003  -3.655
  812    H    ASP  12           HN       ASP  12   2.378  -6.120  -8.156
  813    HA   ASP  12           HA       ASP  12   3.835  -8.273  -9.311
  814   1HB   ASP  12           HB2      ASP  12   2.562  -6.336 -10.467
  815   2HB   ASP  12           HB1      ASP  12   4.052  -5.419 -10.273
  816    H    VAL  13           HN       VAL  13   4.982  -5.079  -8.195
  817    HA   VAL  13           HA       VAL  13   7.723  -5.371  -8.676
  818    HB   VAL  13           HB       VAL  13   6.288  -4.075  -6.344
  819   1HG1  VAL  13          HG13      VAL  13   9.217  -3.933  -7.122
  820   2HG1  VAL  13          HG12      VAL  13   8.441  -2.914  -5.911
  821   3HG1  VAL  13          HG11      VAL  13   8.568  -4.653  -5.648
  822   1HG2  VAL  13          HG22      VAL  13   6.524  -3.366  -9.028
  823   2HG2  VAL  13          HG21      VAL  13   6.101  -2.277  -7.707
  824   3HG2  VAL  13          HG23      VAL  13   7.779  -2.414  -8.235
  825    H    PHE  14           HN       PHE  14   5.768  -6.795  -6.106
  826    HA   PHE  14           HA       PHE  14   7.852  -7.740  -4.429
  827   1HB   PHE  14           HB2      PHE  14   5.251  -7.815  -4.130
  828   2HB   PHE  14           HB1      PHE  14   5.381  -9.377  -4.937
  829    HD1  PHE  14           HD2      PHE  14   6.842 -11.168  -3.956
  830    HD2  PHE  14           HD1      PHE  14   5.976  -7.518  -1.872
  831    HE1  PHE  14           HE2      PHE  14   7.587 -12.207  -1.829
  832    HE2  PHE  14           HE1      PHE  14   6.723  -8.554   0.255
  833    HZ   PHE  14           HZ       PHE  14   7.528 -10.900   0.276
  834    H    HIS  15           HN       HIS  15   6.267  -9.345  -7.202
  835    HA   HIS  15           HA       HIS  15   8.088 -11.626  -7.039
  836   1HB   HIS  15           HB2      HIS  15   5.665 -11.619  -7.936
  837   2HB   HIS  15           HB1      HIS  15   6.350 -10.926  -9.406
  838    HD1  HIS  15           HD1      HIS  15   7.408 -12.524 -11.026
  839    HD2  HIS  15           HD2      HIS  15   6.871 -14.247  -7.267
  840    HE1  HIS  15           HE1      HIS  15   8.037 -14.964 -11.260
  841    H    GLN  16           HN       GLN  16   8.499  -8.505  -8.093
  842    HA   GLN  16           HA       GLN  16  10.125  -9.146 -10.466
  843   1HB   GLN  16           HB2      GLN  16   8.923  -6.763  -9.295
  844   2HB   GLN  16           HB1      GLN  16  10.599  -6.484  -9.768
  845   1HG   GLN  16           HG2      GLN  16   8.698  -7.885 -11.634
  846   2HG   GLN  16           HG1      GLN  16   8.739  -6.124 -11.553
  847   1HE2  GLN  16          HE22      GLN  16  11.325  -7.653 -13.993
  848   2HE2  GLN  16          HE21      GLN  16   9.730  -8.147 -13.688
  849    H    TYR  17           HN       TYR  17  10.565  -8.690  -7.061
  850    HA   TYR  17           HA       TYR  17  13.528  -8.613  -7.488
  851   1HB   TYR  17           HB2      TYR  17  11.846  -7.529  -5.211
  852   2HB   TYR  17           HB1      TYR  17  13.607  -7.629  -5.165
  853    HD1  TYR  17           HD1      TYR  17  10.708  -6.032  -6.821
  854    HD2  TYR  17           HD2      TYR  17  14.990  -6.149  -6.491
  855    HE1  TYR  17           HE1      TYR  17  10.863  -3.899  -8.077
  856    HE2  TYR  17           HE2      TYR  17  15.145  -4.016  -7.748
  857    HH   TYR  17           HH       TYR  17  12.872  -2.812  -9.611
  858    H    SER  18           HN       SER  18  10.859 -10.115  -5.744
  859    HA   SER  18           HA       SER  18  12.503 -11.763  -4.033
  860   1HB   SER  18           HB2      SER  18   9.853 -11.186  -4.088
  861   2HB   SER  18           HB1      SER  18   9.833 -12.772  -4.852
  862    HG   SER  18           HG       SER  18  10.313 -13.639  -2.997
  863    H    GLY  19           HN       GLY  19  10.980 -12.265  -7.209
  864   1HA   GLY  19           HA2      GLY  19  11.476 -14.994  -7.569
  865   2HA   GLY  19           HA1      GLY  19  11.521 -13.820  -8.885
  866    H    ARG  20           HN       ARG  20  13.741 -12.279  -7.981
  867    HA   ARG  20           HA       ARG  20  15.914 -13.687  -9.099
  868   1HB   ARG  20           HB2      ARG  20  15.814 -11.350  -7.187
  869   2HB   ARG  20           HB1      ARG  20  17.334 -11.968  -7.836
  870   1HG   ARG  20           HG2      ARG  20  16.675 -11.486 -10.087
  871   2HG   ARG  20           HG1      ARG  20  15.008 -11.171  -9.600
  872   1HD   ARG  20           HD2      ARG  20  16.548  -9.127 -10.021
  873   2HD   ARG  20           HD1      ARG  20  15.571  -9.136  -8.552
  874    HE   ARG  20           HE       ARG  20  17.569  -9.589  -7.270
  875   1HH1  ARG  20          HH21      ARG  20  19.091 -11.303  -9.132
  876   2HH1  ARG  20          HH22      ARG  20  20.348 -10.249  -9.688
  877   1HH2  ARG  20          HH11      ARG  20  18.745  -7.358  -8.652
  878   2HH2  ARG  20          HH12      ARG  20  20.151  -8.016  -9.417
  879    H    GLU  21           HN       GLU  21  16.105 -15.774  -8.177
  880    HA   GLU  21           HA       GLU  21  16.609 -17.377  -6.513
  881   1HB   GLU  21           HB2      GLU  21  18.777 -17.010  -5.532
  882   2HB   GLU  21           HB1      GLU  21  18.807 -16.278  -7.138
  883   1HG   GLU  21           HG2      GLU  21  18.501 -14.076  -6.235
  884   2HG   GLU  21           HG1      GLU  21  18.149 -14.718  -4.630
  885    H    GLY  22           HN       GLY  22  17.723 -16.875  -3.900
  886   1HA   GLY  22           HA2      GLY  22  17.113 -15.929  -1.774
  887   2HA   GLY  22           HA1      GLY  22  15.672 -15.237  -2.526
  888    H    ASP  23           HN       ASP  23  14.404 -16.181  -0.763
  889    HA   ASP  23           HA       ASP  23  14.242 -19.144  -0.761
  890   1HB   ASP  23           HB2      ASP  23  14.338 -18.165   1.441
  891   2HB   ASP  23           HB1      ASP  23  13.043 -17.035   1.048
  892    H    LYS  24           HN       LYS  24  11.506 -17.010  -0.116
  893    HA   LYS  24           HA       LYS  24  10.241 -17.154  -2.658
  894   1HB   LYS  24           HB2      LYS  24  10.366 -19.643  -1.996
  895   2HB   LYS  24           HB1      LYS  24   9.142 -19.254  -0.788
  896   1HG   LYS  24           HG2      LYS  24   7.502 -19.115  -2.341
  897   2HG   LYS  24           HG1      LYS  24   8.510 -18.162  -3.432
  898   1HD   LYS  24           HD2      LYS  24   9.764 -20.429  -3.828
  899   2HD   LYS  24           HD1      LYS  24   8.279 -21.148  -3.202
  900   1HE   LYS  24           HE2      LYS  24   7.295 -19.291  -4.973
  901   2HE   LYS  24           HE1      LYS  24   8.773 -19.814  -5.781
  902   1HZ   LYS  24           HZ1      LYS  24   8.044 -22.122  -5.447
  903   2HZ   LYS  24           HZ3      LYS  24   6.584 -21.559  -4.794
  904   3HZ   LYS  24           HZ2      LYS  24   6.968 -21.234  -6.417
  905    H    HIS  25           HN       HIS  25   8.469 -15.830  -2.607
  906    HA   HIS  25           HA       HIS  25   6.994 -14.245  -1.695
  907   1HB   HIS  25           HB2      HIS  25   6.527 -16.721  -0.030
  908   2HB   HIS  25           HB1      HIS  25   5.524 -15.279   0.124
  909    HD1  HIS  25           HD1      HIS  25   6.012 -14.845  -3.168
  910    HD2  HIS  25           HD2      HIS  25   4.153 -18.001  -1.175
  911    HE1  HIS  25           HE1      HIS  25   4.482 -15.953  -4.853
  912    H    LYS  26           HN       LYS  26   9.632 -13.894  -0.744
  913    HA   LYS  26           HA       LYS  26   9.023 -12.637   1.856
  914   1HB   LYS  26           HB2      LYS  26  10.782 -13.689   3.075
  915   2HB   LYS  26           HB1      LYS  26   9.913 -14.999   2.278
  916   1HG   LYS  26           HG2      LYS  26  12.022 -15.598   1.624
  917   2HG   LYS  26           HG1      LYS  26  11.715 -14.420   0.348
  918   1HD   LYS  26           HD2      LYS  26  12.846 -12.681   1.617
  919   2HD   LYS  26           HD1      LYS  26  13.044 -13.767   2.994
  920   1HE   LYS  26           HE2      LYS  26  15.061 -14.264   2.087
  921   2HE   LYS  26           HE1      LYS  26  14.144 -15.225   0.927
  922   1HZ   LYS  26           HZ2      LYS  26  13.913 -12.861  -0.201
  923   2HZ   LYS  26           HZ1      LYS  26  15.389 -12.608   0.601
  924   3HZ   LYS  26           HZ3      LYS  26  15.237 -13.881  -0.508
  925    H    LEU  27           HN       LEU  27  10.017 -10.674   1.964
  926    HA   LEU  27           HA       LEU  27  12.004 -10.036  -0.155
  927   1HB   LEU  27           HB2      LEU  27   9.851  -8.594   1.114
  928   2HB   LEU  27           HB1      LEU  27  11.366  -7.716   1.331
  929    HG   LEU  27           HG       LEU  27  10.172  -7.114  -0.791
  930   1HD1  LEU  27          HD12      LEU  27  12.690  -7.006  -0.490
  931   2HD1  LEU  27          HD11      LEU  27  12.781  -8.565  -1.305
  932   3HD1  LEU  27          HD13      LEU  27  12.149  -7.159  -2.162
  933   1HD2  LEU  27          HD22      LEU  27   9.723  -9.836  -0.955
  934   2HD2  LEU  27          HD21      LEU  27   9.495  -8.690  -2.276
  935   3HD2  LEU  27          HD23      LEU  27  11.006  -9.587  -2.139
  936    H    LYS  28           HN       LYS  28  13.225  -7.836   1.178
  937    HA   LYS  28           HA       LYS  28  14.397  -8.948   3.655
  938   1HB   LYS  28           HB2      LYS  28  15.734  -8.963   1.042
  939   2HB   LYS  28           HB1      LYS  28  16.672  -8.154   2.298
  940   1HG   LYS  28           HG2      LYS  28  15.802 -10.335   3.669
  941   2HG   LYS  28           HG1      LYS  28  15.930 -11.008   2.044
  942   1HD   LYS  28           HD2      LYS  28  18.153  -9.390   3.300
  943   2HD   LYS  28           HD1      LYS  28  18.042 -11.141   3.480
  944   1HE   LYS  28           HE2      LYS  28  17.728 -10.975   0.814
  945   2HE   LYS  28           HE1      LYS  28  18.692  -9.521   1.067
  946   1HZ   LYS  28           HZ1      LYS  28  19.467 -12.116   2.250
  947   2HZ   LYS  28           HZ3      LYS  28  19.926 -11.690   0.673
  948   3HZ   LYS  28           HZ2      LYS  28  20.430 -10.742   1.989
  949    H    LYS  29           HN       LYS  29  16.360  -7.233   4.196
  950    HA   LYS  29           HA       LYS  29  14.955  -4.631   4.278
  951   1HB   LYS  29           HB2      LYS  29  17.586  -5.323   5.596
  952   2HB   LYS  29           HB1      LYS  29  16.452  -4.049   6.041
  953   1HG   LYS  29           HG2      LYS  29  15.940  -7.030   6.235
  954   2HG   LYS  29           HG1      LYS  29  16.244  -5.943   7.589
  955   1HD   LYS  29           HD2      LYS  29  14.220  -4.593   6.663
  956   2HD   LYS  29           HD1      LYS  29  13.835  -6.073   5.785
  957   1HE   LYS  29           HE2      LYS  29  13.399  -7.275   7.725
  958   2HE   LYS  29           HE1      LYS  29  14.443  -6.256   8.713
  959   1HZ   LYS  29           HZ3      LYS  29  12.643  -4.475   7.963
  960   2HZ   LYS  29           HZ2      LYS  29  11.668  -5.866   7.925
  961   3HZ   LYS  29           HZ1      LYS  29  12.464  -5.424   9.359
  962    H    SER  30           HN       SER  30  17.624  -6.164   2.677
  963    HA   SER  30           HA       SER  30  18.942  -3.652   1.943
  964   1HB   SER  30           HB2      SER  30  20.310  -5.657   2.100
  965   2HB   SER  30           HB1      SER  30  19.282  -6.494   0.941
  966    HG   SER  30           HG       SER  30  21.327  -5.432   0.182
  967    H    GLU  31           HN       GLU  31  16.847  -6.038   0.314
  968    HA   GLU  31           HA       GLU  31  16.750  -4.455  -2.141
  969   1HB   GLU  31           HB2      GLU  31  16.426  -6.984  -2.006
  970   2HB   GLU  31           HB1      GLU  31  14.844  -6.658  -1.295
  971   1HG   GLU  31           HG2      GLU  31  14.086  -6.571  -3.426
  972   2HG   GLU  31           HG1      GLU  31  14.873  -4.994  -3.504
  973    H    LEU  32           HN       LEU  32  15.045  -4.629   0.871
  974    HA   LEU  32           HA       LEU  32  12.657  -3.237  -0.057
  975   1HB   LEU  32           HB2      LEU  32  12.406  -4.576   1.921
  976   2HB   LEU  32           HB1      LEU  32  13.803  -3.822   2.687
  977    HG   LEU  32           HG       LEU  32  12.648  -1.727   2.915
  978   1HD1  LEU  32          HD12      LEU  32  10.989  -2.876   0.796
  979   2HD1  LEU  32          HD11      LEU  32  10.030  -2.136   2.078
  980   3HD1  LEU  32          HD13      LEU  32  11.246  -1.185   1.223
  981   1HD2  LEU  32          HD21      LEU  32  11.962  -3.933   4.305
  982   2HD2  LEU  32          HD23      LEU  32  11.217  -2.362   4.601
  983   3HD2  LEU  32          HD22      LEU  32  10.393  -3.552   3.595
  984    H    LYS  33           HN       LYS  33  15.692  -2.386   1.559
  985    HA   LYS  33           HA       LYS  33  15.162   0.370   2.019
  986   1HB   LYS  33           HB2      LYS  33  17.206  -1.148   2.692
  987   2HB   LYS  33           HB1      LYS  33  17.884  -0.588   1.166
  988   1HG   LYS  33           HG2      LYS  33  16.719   1.616   2.654
  989   2HG   LYS  33           HG1      LYS  33  17.937   0.776   3.615
  990   1HD   LYS  33           HD2      LYS  33  19.556   0.986   1.774
  991   2HD   LYS  33           HD1      LYS  33  18.340   1.803   0.789
  992   1HE   LYS  33           HE2      LYS  33  18.297   3.697   2.222
  993   2HE   LYS  33           HE1      LYS  33  19.150   2.842   3.507
  994   1HZ   LYS  33           HZ3      LYS  33  20.444   3.152   0.889
  995   2HZ   LYS  33           HZ2      LYS  33  20.416   4.475   1.953
  996   3HZ   LYS  33           HZ1      LYS  33  21.146   3.016   2.427
  997    H    GLU  34           HN       GLU  34  16.576  -1.302  -0.783
  998    HA   GLU  34           HA       GLU  34  16.888   1.101  -2.359
  999   1HB   GLU  34           HB2      GLU  34  17.719  -0.319  -3.995
 1000   2HB   GLU  34           HB1      GLU  34  17.912  -1.350  -2.580
 1001   1HG   GLU  34           HG2      GLU  34  16.834  -2.820  -3.984
 1002   2HG   GLU  34           HG1      GLU  34  15.441  -2.093  -3.194
 1003    H    LEU  35           HN       LEU  35  14.371  -1.253  -1.855
 1004    HA   LEU  35           HA       LEU  35  12.639  -0.663  -4.016
 1005   1HB   LEU  35           HB2      LEU  35  12.559  -2.278  -1.761
 1006   2HB   LEU  35           HB1      LEU  35  11.261  -1.116  -1.464
 1007    HG   LEU  35           HG       LEU  35  10.494  -3.132  -2.729
 1008   1HD1  LEU  35          HD12      LEU  35   9.514  -0.769  -2.969
 1009   2HD1  LEU  35          HD11      LEU  35  10.400  -0.678  -4.491
 1010   3HD1  LEU  35          HD13      LEU  35   9.154  -1.906  -4.267
 1011   1HD2  LEU  35          HD23      LEU  35  12.871  -2.530  -4.230
 1012   2HD2  LEU  35          HD22      LEU  35  11.797  -3.919  -4.388
 1013   3HD2  LEU  35          HD21      LEU  35  11.479  -2.449  -5.311
 1014    H    ILE  36           HN       ILE  36  12.950   0.898  -0.832
 1015    HA   ILE  36           HA       ILE  36  10.811   2.798  -1.332
 1016    HB   ILE  36           HB       ILE  36  12.992   3.410   0.620
 1017   1HG1  ILE  36          HG12      ILE  36  11.203   0.983   0.701
 1018   2HG1  ILE  36          HG11      ILE  36  12.922   1.101   1.068
 1019   1HG2  ILE  36          HG23      ILE  36  10.721   4.641   0.226
 1020   2HG2  ILE  36          HG22      ILE  36  10.027   3.295   1.130
 1021   3HG2  ILE  36          HG21      ILE  36  11.241   4.327   1.881
 1022   1HD1  ILE  36          HD11      ILE  36  12.404   2.411   3.095
 1023   2HD1  ILE  36          HD13      ILE  36  10.682   2.286   2.734
 1024   3HD1  ILE  36          HD12      ILE  36  11.606   0.839   3.136
 1025    H    ASN  37           HN       ASN  37  14.355   3.146  -1.145
 1026    HA   ASN  37           HA       ASN  37  14.345   5.826  -2.205
 1027   1HB   ASN  37           HB2      ASN  37  16.193   4.850  -0.817
 1028   2HB   ASN  37           HB1      ASN  37  16.631   3.839  -2.194
 1029   1HD2  ASN  37          HD22      ASN  37  18.811   6.733  -2.637
 1030   2HD2  ASN  37          HD21      ASN  37  18.719   5.314  -1.712
 1031    H    ASN  38           HN       ASN  38  13.601   2.972  -3.732
 1032    HA   ASN  38           HA       ASN  38  14.960   3.591  -6.274
 1033   1HB   ASN  38           HB2      ASN  38  14.760   1.257  -5.796
 1034   2HB   ASN  38           HB1      ASN  38  13.049   1.413  -5.402
 1035   1HD2  ASN  38          HD22      ASN  38  12.231   0.551  -8.712
 1036   2HD2  ASN  38          HD21      ASN  38  11.962   0.309  -7.054
 1037    H    GLU  39           HN       GLU  39  11.707   3.708  -4.878
 1038    HA   GLU  39           HA       GLU  39  10.891   5.382  -7.214
 1039   1HB   GLU  39           HB2      GLU  39   9.702   3.426  -7.678
 1040   2HB   GLU  39           HB1      GLU  39   9.517   3.014  -5.975
 1041   1HG   GLU  39           HG2      GLU  39   7.396   3.805  -7.115
 1042   2HG   GLU  39           HG1      GLU  39   7.835   4.708  -5.668
 1043    H    LEU  40           HN       LEU  40  10.410   4.568  -3.799
 1044    HA   LEU  40           HA       LEU  40   8.589   6.742  -3.272
 1045   1HB   LEU  40           HB2      LEU  40  10.274   4.931  -1.549
 1046   2HB   LEU  40           HB1      LEU  40   9.360   6.253  -0.847
 1047    HG   LEU  40           HG       LEU  40   7.464   5.042  -0.920
 1048   1HD1  LEU  40          HD12      LEU  40   8.138   4.468  -3.818
 1049   2HD1  LEU  40          HD11      LEU  40   6.625   4.007  -3.041
 1050   3HD1  LEU  40          HD13      LEU  40   7.040   5.711  -3.217
 1051   1HD2  LEU  40          HD23      LEU  40   9.194   3.223  -0.515
 1052   2HD2  LEU  40          HD22      LEU  40   7.637   2.672  -1.129
 1053   3HD2  LEU  40          HD21      LEU  40   9.020   2.804  -2.218
 1054    H    SER  41           HN       SER  41  11.813   6.805  -4.103
 1055    HA   SER  41           HA       SER  41  12.669   8.927  -2.281
 1056   1HB   SER  41           HB2      SER  41  14.283   7.319  -3.301
 1057   2HB   SER  41           HB1      SER  41  13.919   7.998  -4.884
 1058    HG   SER  41           HG       SER  41  15.584   9.206  -4.275
 1059    H    HIS  42           HN       HIS  42  10.795   8.758  -5.123
 1060    HA   HIS  42           HA       HIS  42  11.489  11.210  -6.407
 1061   1HB   HIS  42           HB2      HIS  42   9.630   9.192  -6.834
 1062   2HB   HIS  42           HB1      HIS  42   8.629  10.597  -6.475
 1063    HD1  HIS  42           HD1      HIS  42  11.914  10.322  -8.401
 1064    HD2  HIS  42           HD2      HIS  42   8.011  11.685  -8.936
 1065    HE1  HIS  42           HE1      HIS  42  11.834  11.378 -10.702
 1066    H    PHE  43           HN       PHE  43   9.666  10.532  -3.510
 1067    HA   PHE  43           HA       PHE  43   8.918  13.423  -3.357
 1068   1HB   PHE  43           HB2      PHE  43   7.687  11.408  -1.525
 1069   2HB   PHE  43           HB1      PHE  43   6.977  12.855  -2.238
 1070    HD1  PHE  43           HD1      PHE  43   6.628  12.837  -4.827
 1071    HD2  PHE  43           HD2      PHE  43   7.228   9.305  -2.455
 1072    HE1  PHE  43           HE1      PHE  43   5.626  11.458  -6.628
 1073    HE2  PHE  43           HE2      PHE  43   6.227   7.927  -4.255
 1074    HZ   PHE  43           HZ       PHE  43   5.425   9.003  -6.342
 1075    H    LEU  44           HN       LEU  44  11.458  13.159  -2.701
 1076    HA   LEU  44           HA       LEU  44  11.460  13.043   0.289
 1077   1HB   LEU  44           HB2      LEU  44  12.965  11.449  -1.513
 1078   2HB   LEU  44           HB1      LEU  44  14.090  12.591  -0.780
 1079    HG   LEU  44           HG       LEU  44  12.172  11.430   1.125
 1080   1HD1  LEU  44          HD13      LEU  44  14.157   9.696  -0.366
 1081   2HD1  LEU  44          HD12      LEU  44  13.501   9.264   1.213
 1082   3HD1  LEU  44          HD11      LEU  44  12.424   9.427  -0.174
 1083   1HD2  LEU  44          HD23      LEU  44  15.099  12.068   0.929
 1084   2HD2  LEU  44          HD22      LEU  44  13.917  12.606   2.122
 1085   3HD2  LEU  44          HD21      LEU  44  14.551  10.963   2.190
 1086    H    GLU  45           HN       GLU  45  10.885  15.435  -0.445
 1087    HA   GLU  45           HA       GLU  45  13.477  16.921  -0.591
 1088   1HB   GLU  45           HB2      GLU  45  10.817  17.825  -1.736
 1089   2HB   GLU  45           HB1      GLU  45  12.364  18.663  -1.877
 1090   1HG   GLU  45           HG2      GLU  45  13.029  16.198  -2.836
 1091   2HG   GLU  45           HG1      GLU  45  11.350  16.320  -3.363
 1092    H    GLU  46           HN       GLU  46  10.190  16.786   0.682
 1093    HA   GLU  46           HA       GLU  46  11.021  18.768   2.763
 1094   1HB   GLU  46           HB2      GLU  46   8.260  18.323   1.581
 1095   2HB   GLU  46           HB1      GLU  46   8.630  19.427   2.905
 1096   1HG   GLU  46           HG2      GLU  46  10.369  19.803   0.571
 1097   2HG   GLU  46           HG1      GLU  46   8.663  20.094   0.222
 1098    H    ILE  47           HN       ILE  47   9.051  15.898   2.042
 1099    HA   ILE  47           HA       ILE  47   8.389  14.131   3.433
 1100    HB   ILE  47           HB       ILE  47  10.452  15.177   5.385
 1101   1HG1  ILE  47          HG12      ILE  47  10.881  13.347   3.002
 1102   2HG1  ILE  47          HG11      ILE  47  11.402  15.029   3.083
 1103   1HG2  ILE  47          HG22      ILE  47   9.288  12.447   4.774
 1104   2HG2  ILE  47          HG21      ILE  47  10.671  12.706   5.837
 1105   3HG2  ILE  47          HG23      ILE  47   9.094  13.374   6.260
 1106   1HD1  ILE  47          HD12      ILE  47  12.226  13.258   5.332
 1107   2HD1  ILE  47          HD11      ILE  47  13.019  12.997   3.779
 1108   3HD1  ILE  47          HD13      ILE  47  13.106  14.576   4.557
 1109    H    LYS  48           HN       LYS  48   6.483  14.188   4.512
 1110    HA   LYS  48           HA       LYS  48   5.926  16.501   6.287
 1111   1HB   LYS  48           HB2      LYS  48   4.382  15.134   4.397
 1112   2HB   LYS  48           HB1      LYS  48   3.740  14.608   5.954
 1113   1HG   LYS  48           HG2      LYS  48   4.181  17.374   6.220
 1114   2HG   LYS  48           HG1      LYS  48   3.440  17.167   4.634
 1115   1HD   LYS  48           HD2      LYS  48   1.598  15.899   5.614
 1116   2HD   LYS  48           HD1      LYS  48   2.356  15.980   7.205
 1117   1HE   LYS  48           HE2      LYS  48   2.194  18.459   7.128
 1118   2HE   LYS  48           HE1      LYS  48   1.366  18.338   5.576
 1119   1HZ   LYS  48           HZ2      LYS  48   0.374  16.891   7.950
 1120   2HZ   LYS  48           HZ1      LYS  48  -0.045  18.515   7.678
 1121   3HZ   LYS  48           HZ3      LYS  48  -0.469  17.331   6.542
 1122    H    GLU  49           HN       GLU  49   5.431  12.950   6.344
 1123    HA   GLU  49           HA       GLU  49   5.252  13.033   9.286
 1124   1HB   GLU  49           HB2      GLU  49   4.550  11.143   7.157
 1125   2HB   GLU  49           HB1      GLU  49   5.298  10.367   8.554
 1126   1HG   GLU  49           HG2      GLU  49   2.999  12.329   8.756
 1127   2HG   GLU  49           HG1      GLU  49   2.789  10.578   8.718
 1128    H    GLN  50           HN       GLN  50   7.499  13.789   9.582
 1129    HA   GLN  50           HA       GLN  50   9.788  12.372   8.680
 1130   1HB   GLN  50           HB2      GLN  50   9.518  14.655   9.992
 1131   2HB   GLN  50           HB1      GLN  50   9.770  13.625  11.401
 1132   1HG   GLN  50           HG2      GLN  50  11.613  13.460   9.021
 1133   2HG   GLN  50           HG1      GLN  50  11.860  14.678  10.272
 1134   1HE2  GLN  50          HE22      GLN  50  13.704  11.485  11.154
 1135   2HE2  GLN  50          HE21      GLN  50  13.688  12.448   9.756
 1136    H    GLU  51           HN       GLU  51   7.472  11.601  11.155
 1137    HA   GLU  51           HA       GLU  51   9.216   9.713  12.549
 1138   1HB   GLU  51           HB2      GLU  51   7.107  10.976  13.456
 1139   2HB   GLU  51           HB1      GLU  51   6.212   9.656  12.705
 1140   1HG   GLU  51           HG2      GLU  51   7.386   8.013  14.025
 1141   2HG   GLU  51           HG1      GLU  51   8.501   9.231  14.643
 1142    H    VAL  52           HN       VAL  52   6.678   9.545  10.079
 1143    HA   VAL  52           HA       VAL  52   6.489   6.691   9.991
 1144    HB   VAL  52           HB       VAL  52   6.013   8.750   7.813
 1145   1HG1  VAL  52          HG11      VAL  52   6.184   5.944   7.623
 1146   2HG1  VAL  52          HG13      VAL  52   4.460   6.317   7.636
 1147   3HG1  VAL  52          HG12      VAL  52   5.511   7.051   6.425
 1148   1HG2  VAL  52          HG21      VAL  52   4.661   8.872   9.984
 1149   2HG2  VAL  52          HG23      VAL  52   3.724   8.703   8.500
 1150   3HG2  VAL  52          HG22      VAL  52   3.992   7.303   9.539
 1151    H    VAL  53           HN       VAL  53   8.231   8.912   7.778
 1152    HA   VAL  53           HA       VAL  53   9.654   6.804   6.455
 1153    HB   VAL  53           HB       VAL  53  10.338   9.745   6.742
 1154   1HG1  VAL  53          HG11      VAL  53  11.799   7.526   5.602
 1155   2HG1  VAL  53          HG13      VAL  53  11.343   8.666   4.334
 1156   3HG1  VAL  53          HG12      VAL  53  12.278   9.218   5.724
 1157   1HG2  VAL  53          HG21      VAL  53   8.130   9.126   5.655
 1158   2HG2  VAL  53          HG23      VAL  53   9.242  10.012   4.611
 1159   3HG2  VAL  53          HG22      VAL  53   9.058   8.269   4.426
 1160    H    ASP  54           HN       ASP  54  10.269   8.628   9.387
 1161    HA   ASP  54           HA       ASP  54  13.048   7.807   9.617
 1162   1HB   ASP  54           HB2      ASP  54  12.231   9.809  10.781
 1163   2HB   ASP  54           HB1      ASP  54  11.104   8.823  11.716
 1164    H    LYS  55           HN       LYS  55   9.969   6.383  10.348
 1165    HA   LYS  55           HA       LYS  55  11.042   4.432  12.249
 1166   1HB   LYS  55           HB2      LYS  55   8.453   5.292  11.393
 1167   2HB   LYS  55           HB1      LYS  55   8.566   3.555  11.117
 1168   1HG   LYS  55           HG2      LYS  55   8.345   3.165  13.320
 1169   2HG   LYS  55           HG1      LYS  55   9.766   4.157  13.651
 1170   1HD   LYS  55           HD2      LYS  55   8.354   5.588  14.681
 1171   2HD   LYS  55           HD1      LYS  55   7.799   6.029  13.064
 1172   1HE   LYS  55           HE2      LYS  55   5.921   4.647  13.186
 1173   2HE   LYS  55           HE1      LYS  55   6.639   3.613  14.422
 1174   1HZ   LYS  55           HZ2      LYS  55   5.783   6.428  14.820
 1175   2HZ   LYS  55           HZ1      LYS  55   4.921   5.057  15.334
 1176   3HZ   LYS  55           HZ3      LYS  55   6.438   5.405  16.010
 1177    H    VAL  56           HN       VAL  56   9.774   4.232   8.891
 1178    HA   VAL  56           HA       VAL  56  10.545   1.498   8.536
 1179    HB   VAL  56           HB       VAL  56  10.256   1.993   6.117
 1180   1HG1  VAL  56          HG11      VAL  56   8.326   2.348   8.219
 1181   2HG1  VAL  56          HG13      VAL  56   7.927   3.420   6.876
 1182   3HG1  VAL  56          HG12      VAL  56   8.081   1.685   6.604
 1183   1HG2  VAL  56          HG22      VAL  56  10.208   4.814   7.175
 1184   2HG2  VAL  56          HG21      VAL  56  11.150   4.162   5.835
 1185   3HG2  VAL  56          HG23      VAL  56   9.411   4.400   5.658
 1186    H    MET  57           HN       MET  57  12.132   4.549   7.581
 1187    HA   MET  57           HA       MET  57  14.461   3.336   6.439
 1188   1HB   MET  57           HB2      MET  57  13.915   5.714   6.102
 1189   2HB   MET  57           HB1      MET  57  14.139   6.013   7.827
 1190   1HG   MET  57           HG2      MET  57  16.165   6.663   6.623
 1191   2HG   MET  57           HG1      MET  57  16.502   5.248   7.622
 1192   1HE   MET  57           HE1      MET  57  16.419   6.862   4.262
 1193   2HE   MET  57           HE3      MET  57  16.196   5.571   3.075
 1194   3HE   MET  57           HE2      MET  57  14.865   6.041   4.128
 1195    H    GLU  58           HN       GLU  58  13.421   3.830   9.709
 1196    HA   GLU  58           HA       GLU  58  16.044   3.645  10.933
 1197   1HB   GLU  58           HB2      GLU  58  13.256   3.807  11.823
 1198   2HB   GLU  58           HB1      GLU  58  14.230   2.738  12.833
 1199   1HG   GLU  58           HG2      GLU  58  15.979   4.618  12.861
 1200   2HG   GLU  58           HG1      GLU  58  14.708   5.655  12.212
 1201    H    THR  59           HN       THR  59  13.355   1.257  10.687
 1202    HA   THR  59           HA       THR  59  14.909  -0.927  11.696
 1203    HB   THR  59           HB       THR  59  12.874  -1.545   9.624
 1204    HG1  THR  59           HG1      THR  59  12.290  -0.131  12.008
 1205   1HG2  THR  59          HG23      THR  59  13.596  -2.416  12.411
 1206   2HG2  THR  59          HG22      THR  59  12.033  -2.854  11.721
 1207   3HG2  THR  59          HG21      THR  59  13.523  -3.375  10.934
 1208    H    LEU  60           HN       LEU  60  14.637   0.580   8.571
 1209    HA   LEU  60           HA       LEU  60  15.840  -1.454   6.964
 1210   1HB   LEU  60           HB2      LEU  60  15.324   1.470   6.755
 1211   2HB   LEU  60           HB1      LEU  60  16.571   0.820   5.694
 1212    HG   LEU  60           HG       LEU  60  13.781  -0.334   5.946
 1213   1HD1  LEU  60          HD13      LEU  60  14.989   1.645   4.006
 1214   2HD1  LEU  60          HD12      LEU  60  13.591   0.659   3.576
 1215   3HD1  LEU  60          HD11      LEU  60  13.490   1.791   4.923
 1216   1HD2  LEU  60          HD23      LEU  60  16.201  -0.916   4.244
 1217   2HD2  LEU  60          HD22      LEU  60  15.197  -2.043   5.155
 1218   3HD2  LEU  60          HD21      LEU  60  14.584  -1.318   3.667
 1219    H    ASP  61           HN       ASP  61  17.258   1.461   8.456
 1220    HA   ASP  61           HA       ASP  61  19.980   0.568   7.889
 1221   1HB   ASP  61           HB2      ASP  61  18.718   3.008   8.574
 1222   2HB   ASP  61           HB1      ASP  61  19.840   2.643   9.888
 1223    H    GLU  62           HN       GLU  62  17.697  -0.266  10.196
 1224    HA   GLU  62           HA       GLU  62  19.399  -0.460  12.529
 1225   1HB   GLU  62           HB2      GLU  62  16.814  -0.466  12.429
 1226   2HB   GLU  62           HB1      GLU  62  16.967  -2.172  12.014
 1227   1HG   GLU  62           HG2      GLU  62  18.288  -2.549  14.075
 1228   2HG   GLU  62           HG1      GLU  62  18.094  -0.848  14.499
 1229    H    ASP  63           HN       ASP  63  18.744  -2.506   9.762
 1230    HA   ASP  63           HA       ASP  63  20.887  -4.325  10.700
 1231   1HB   ASP  63           HB2      ASP  63  18.162  -5.295   9.793
 1232   2HB   ASP  63           HB1      ASP  63  19.542  -6.321  10.188
 1233    H    GLY  64           HN       GLY  64  18.497  -4.003   8.063
 1234   1HA   GLY  64           HA2      GLY  64  18.908  -3.674   5.753
 1235   2HA   GLY  64           HA1      GLY  64  20.635  -3.597   6.106
 1236    H    ASP  65           HN       ASP  65  19.782  -6.289   7.679
 1237    HA   ASP  65           HA       ASP  65  19.960  -8.038   5.267
 1238   1HB   ASP  65           HB2      ASP  65  22.146  -7.677   6.638
 1239   2HB   ASP  65           HB1      ASP  65  21.374  -8.708   7.842
 1240    H    GLY  66           HN       GLY  66  17.756  -7.212   7.212
 1241   1HA   GLY  66           HA2      GLY  66  17.175  -9.753   8.586
 1242   2HA   GLY  66           HA1      GLY  66  16.214  -8.279   8.696
 1243    H    GLU  67           HN       GLU  67  14.658 -10.353   8.334
 1244    HA   GLU  67           HA       GLU  67  14.222 -10.652   5.395
 1245   1HB   GLU  67           HB2      GLU  67  13.397 -12.326   7.775
 1246   2HB   GLU  67           HB1      GLU  67  12.656 -12.535   6.188
 1247   1HG   GLU  67           HG2      GLU  67  14.909 -12.904   5.207
 1248   2HG   GLU  67           HG1      GLU  67  15.615 -12.763   6.818
 1249    H    CYS  68           HN       CYS  68  12.270  -9.987   4.496
 1250    HA   CYS  68           HA       CYS  68  10.378  -8.614   6.365
 1251   1HB   CYS  68           HB2      CYS  68  11.481  -7.876   3.699
 1252   2HB   CYS  68           HB1      CYS  68   9.785  -7.487   3.988
 1253    HG   CYS  68           HG       CYS  68  11.808  -5.717   4.922
 1254    H    ASP  69           HN       ASP  69   8.086  -8.726   5.743
 1255    HA   ASP  69           HA       ASP  69   7.482 -11.296   4.364
 1256   1HB   ASP  69           HB2      ASP  69   5.783  -9.567   6.189
 1257   2HB   ASP  69           HB1      ASP  69   5.253 -11.081   5.458
 1258    H    PHE  70           HN       PHE  70   4.805 -10.741   3.680
 1259    HA   PHE  70           HA       PHE  70   5.260  -9.024   1.322
 1260   1HB   PHE  70           HB2      PHE  70   2.746  -9.778   0.924
 1261   2HB   PHE  70           HB1      PHE  70   4.078 -10.886   0.608
 1262    HD1  PHE  70           HD2      PHE  70   4.580 -12.733   2.144
 1263    HD2  PHE  70           HD1      PHE  70   1.289 -10.066   2.857
 1264    HE1  PHE  70           HE2      PHE  70   3.658 -14.317   3.813
 1265    HE2  PHE  70           HE1      PHE  70   0.366 -11.652   4.526
 1266    HZ   PHE  70           HZ       PHE  70   1.550 -13.778   5.005
 1267    H    GLN  71           HN       GLN  71   2.979  -9.173   4.079
 1268    HA   GLN  71           HA       GLN  71   1.719  -6.654   3.393
 1269   1HB   GLN  71           HB2      GLN  71   1.835  -7.907   6.150
 1270   2HB   GLN  71           HB1      GLN  71   0.595  -6.833   5.502
 1271   1HG   GLN  71           HG2      GLN  71   0.307  -8.707   3.689
 1272   2HG   GLN  71           HG1      GLN  71   1.089  -9.729   4.895
 1273   1HE2  GLN  71          HE22      GLN  71  -2.563  -8.082   5.863
 1274   2HE2  GLN  71          HE21      GLN  71  -1.538  -7.242   4.804
 1275    H    GLU  72           HN       GLU  72   4.696  -7.505   4.859
 1276    HA   GLU  72           HA       GLU  72   4.973  -5.042   6.411
 1277   1HB   GLU  72           HB2      GLU  72   6.685  -7.417   5.797
 1278   2HB   GLU  72           HB1      GLU  72   7.490  -5.934   6.302
 1279   1HG   GLU  72           HG2      GLU  72   5.196  -6.408   7.983
 1280   2HG   GLU  72           HG1      GLU  72   6.218  -7.845   7.959
 1281    H    PHE  73           HN       PHE  73   6.716  -6.352   3.565
 1282    HA   PHE  73           HA       PHE  73   7.940  -3.851   2.881
 1283   1HB   PHE  73           HB2      PHE  73   8.966  -5.694   1.865
 1284   2HB   PHE  73           HB1      PHE  73   7.431  -6.445   1.447
 1285    HD1  PHE  73           HD2      PHE  73   8.820  -3.010   0.816
 1286    HD2  PHE  73           HD1      PHE  73   7.280  -6.646  -0.866
 1287    HE1  PHE  73           HE2      PHE  73   8.935  -2.011  -1.453
 1288    HE2  PHE  73           HE1      PHE  73   7.395  -5.649  -3.133
 1289    HZ   PHE  73           HZ       PHE  73   8.222  -3.332  -3.428
 1290    H    MET  74           HN       MET  74   4.738  -5.076   2.492
 1291    HA   MET  74           HA       MET  74   4.032  -3.307   0.271
 1292   1HB   MET  74           HB2      MET  74   2.661  -5.322   1.964
 1293   2HB   MET  74           HB1      MET  74   1.641  -4.019   1.363
 1294   1HG   MET  74           HG2      MET  74   3.385  -5.849  -0.311
 1295   2HG   MET  74           HG1      MET  74   1.625  -5.873  -0.230
 1296   1HE   MET  74           HE2      MET  74   0.440  -3.264  -0.361
 1297   2HE   MET  74           HE1      MET  74   1.876  -2.466   0.273
 1298   3HE   MET  74           HE3      MET  74   1.185  -1.954  -1.273
 1299    H    ALA  75           HN       ALA  75   3.220  -3.436   3.754
 1300    HA   ALA  75           HA       ALA  75   1.937  -0.852   3.750
 1301   1HB   ALA  75           HB3      ALA  75   1.530  -2.563   5.507
 1302   2HB   ALA  75           HB2      ALA  75   3.196  -2.371   6.060
 1303   3HB   ALA  75           HB1      ALA  75   2.059  -1.031   6.201
 1304    H    PHE  76           HN       PHE  76   5.197  -1.864   3.674
 1305    HA   PHE  76           HA       PHE  76   6.332   0.479   4.982
 1306   1HB   PHE  76           HB2      PHE  76   7.312  -1.981   3.699
 1307   2HB   PHE  76           HB1      PHE  76   8.347  -0.582   3.427
 1308    HD1  PHE  76           HD1      PHE  76   6.372  -2.130   6.224
 1309    HD2  PHE  76           HD2      PHE  76   9.994  -0.160   5.018
 1310    HE1  PHE  76           HE1      PHE  76   7.253  -2.339   8.532
 1311    HE2  PHE  76           HE2      PHE  76  10.875  -0.368   7.327
 1312    HZ   PHE  76           HZ       PHE  76   9.505  -1.458   9.084
 1313    H    VAL  77           HN       VAL  77   5.675  -0.548   1.661
 1314    HA   VAL  77           HA       VAL  77   6.956   1.768   0.452
 1315    HB   VAL  77           HB       VAL  77   4.972  -0.252  -0.634
 1316   1HG1  VAL  77          HG13      VAL  77   5.456   2.234  -1.692
 1317   2HG1  VAL  77          HG12      VAL  77   6.689   1.264  -2.495
 1318   3HG1  VAL  77          HG11      VAL  77   4.988   0.824  -2.639
 1319   1HG2  VAL  77          HG22      VAL  77   7.692  -0.473   0.022
 1320   2HG2  VAL  77          HG21      VAL  77   6.765  -1.573  -0.995
 1321   3HG2  VAL  77          HG23      VAL  77   7.668  -0.246  -1.726
 1322    H    SER  78           HN       SER  78   3.716   1.000   1.604
 1323    HA   SER  78           HA       SER  78   2.473   3.287   0.297
 1324   1HB   SER  78           HB2      SER  78   1.482   1.617   2.625
 1325   2HB   SER  78           HB1      SER  78   0.510   2.716   1.649
 1326    HG   SER  78           HG       SER  78   2.007   0.676   0.423
 1327    H    MET  79           HN       MET  79   3.768   2.628   3.546
 1328    HA   MET  79           HA       MET  79   2.829   4.987   4.807
 1329   1HB   MET  79           HB2      MET  79   5.333   3.348   5.272
 1330   2HB   MET  79           HB1      MET  79   4.780   4.628   6.347
 1331   1HG   MET  79           HG2      MET  79   2.598   2.833   5.733
 1332   2HG   MET  79           HG1      MET  79   3.972   1.936   6.379
 1333   1HE   MET  79           HE1      MET  79   4.721   1.735   8.186
 1334   2HE   MET  79           HE3      MET  79   4.989   3.005   9.387
 1335   3HE   MET  79           HE2      MET  79   3.687   1.839   9.609
 1336    H    VAL  80           HN       VAL  80   5.978   4.394   3.196
 1337    HA   VAL  80           HA       VAL  80   6.899   7.089   3.553
 1338    HB   VAL  80           HB       VAL  80   8.449   6.396   1.577
 1339   1HG1  VAL  80          HG12      VAL  80   8.329   5.530   4.387
 1340   2HG1  VAL  80          HG11      VAL  80   9.363   4.526   3.373
 1341   3HG1  VAL  80          HG13      VAL  80   9.662   6.259   3.490
 1342   1HG2  VAL  80          HG22      VAL  80   6.594   4.343   1.396
 1343   2HG2  VAL  80          HG21      VAL  80   8.201   4.341   0.670
 1344   3HG2  VAL  80          HG23      VAL  80   7.945   3.593   2.247
 1345    H    THR  81           HN       THR  81   5.115   5.499   0.926
 1346    HA   THR  81           HA       THR  81   5.363   7.684  -0.927
 1347    HB   THR  81           HB       THR  81   3.051   5.740  -0.813
 1348    HG1  THR  81           HG1      THR  81   5.738   5.409  -1.557
 1349   1HG2  THR  81          HG21      THR  81   3.138   7.745  -2.426
 1350   2HG2  THR  81          HG23      THR  81   4.468   6.897  -3.214
 1351   3HG2  THR  81          HG22      THR  81   2.870   6.156  -3.138
 1352    H    THR  82           HN       THR  82   3.706   7.506   2.006
 1353    HA   THR  82           HA       THR  82   1.868   9.695   1.114
 1354    HB   THR  82           HB       THR  82   0.411   8.974   3.053
 1355    HG1  THR  82           HG1      THR  82   0.833   6.809   3.763
 1356   1HG2  THR  82          HG22      THR  82   0.019   8.312   0.658
 1357   2HG2  THR  82          HG21      THR  82   0.899   6.820   0.986
 1358   3HG2  THR  82          HG23      THR  82  -0.611   7.156   1.833
 1359    H    ALA  83           HN       ALA  83   4.514   8.870   3.066
 1360    HA   ALA  83           HA       ALA  83   3.967  10.958   5.084
 1361   1HB   ALA  83           HB2      ALA  83   5.887   8.725   4.780
 1362   2HB   ALA  83           HB1      ALA  83   6.526  10.164   5.572
 1363   3HB   ALA  83           HB3      ALA  83   5.108   9.348   6.233
 1364    H    CYS  84           HN       CYS  84   4.063  12.065   2.558
 1365    HA   CYS  84           HA       CYS  84   6.653  13.546   2.660
 1366   1HB   CYS  84           HB2      CYS  84   5.247  12.936   0.062
 1367   2HB   CYS  84           HB1      CYS  84   6.914  13.460   0.313
 1368    HG   CYS  84           HG       CYS  84   7.229  11.029   1.537
 1369    H    HIS  85           HN       HIS  85   6.444  15.757   2.445
 1370    HA   HIS  85           HA       HIS  85   3.868  16.956   2.824
 1371   1HB   HIS  85           HB2      HIS  85   6.578  17.795   2.872
 1372   2HB   HIS  85           HB1      HIS  85   5.748  18.836   1.715
 1373    HD1  HIS  85           HD1      HIS  85   6.645  19.121   4.989
 1374    HD2  HIS  85           HD2      HIS  85   2.885  19.273   3.195
 1375    HE1  HIS  85           HE1      HIS  85   5.136  20.367   6.595
 1376    H    GLU  86           HN       GLU  86   6.073  17.372   0.025
 1377    HA   GLU  86           HA       GLU  86   3.780  18.171  -1.631
 1378   1HB   GLU  86           HB2      GLU  86   6.755  18.059  -1.999
 1379   2HB   GLU  86           HB1      GLU  86   5.721  18.117  -3.427
 1380   1HG   GLU  86           HG2      GLU  86   4.765  20.020  -1.499
 1381   2HG   GLU  86           HG1      GLU  86   6.490  20.281  -1.765
 1382    H    PHE  87           HN       PHE  87   2.480  16.459  -2.145
 1383    HA   PHE  87           HA       PHE  87   3.576  14.409  -3.909
 1384   1HB   PHE  87           HB2      PHE  87   3.252  12.511  -2.592
 1385   2HB   PHE  87           HB1      PHE  87   3.874  13.655  -1.407
 1386    HD1  PHE  87           HD1      PHE  87   1.399  15.385  -1.110
 1387    HD2  PHE  87           HD2      PHE  87   1.899  11.123  -1.215
 1388    HE1  PHE  87           HE1      PHE  87  -0.672  15.109   0.223
 1389    HE2  PHE  87           HE2      PHE  87  -0.174  10.847   0.120
 1390    HZ   PHE  87           HZ       PHE  87  -1.459  12.841   0.840
 1391    H    PHE  88           HN       PHE  88   1.417  12.653  -3.931
 1392    HA   PHE  88           HA       PHE  88  -0.783  12.471  -4.733
 1393   1HB   PHE  88           HB2      PHE  88  -0.877  14.836  -2.927
 1394   2HB   PHE  88           HB1      PHE  88  -2.192  14.689  -4.091
 1395    HD1  PHE  88           HD2      PHE  88  -0.460  11.681  -2.933
 1396    HD2  PHE  88           HD1      PHE  88  -3.818  14.276  -2.266
 1397    HE1  PHE  88           HE2      PHE  88  -1.520   9.947  -1.512
 1398    HE2  PHE  88           HE1      PHE  88  -4.876  12.541  -0.844
 1399    HZ   PHE  88           HZ       PHE  88  -3.727  10.377  -0.468
 1400    H    GLU  89           HN       GLU  89   1.132  13.281  -6.480
 1401    HA   GLU  89           HA       GLU  89   1.239  15.532  -7.923
 1402   1HB   GLU  89           HB2      GLU  89   1.442  12.772  -8.541
 1403   2HB   GLU  89           HB1      GLU  89   0.517  13.526  -9.838
 1404   1HG   GLU  89           HG2      GLU  89   2.268  15.204 -10.157
 1405   2HG   GLU  89           HG1      GLU  89   3.180  14.540  -8.800
 1406    H    HIS  90           HN       HIS  90  -0.626  16.872  -7.607
 1407    HA   HIS  90           HA       HIS  90  -3.011  16.037  -9.208
 1408   1HB   HIS  90           HB2      HIS  90  -4.272  17.679  -7.765
 1409   2HB   HIS  90           HB1      HIS  90  -3.649  16.281  -6.892
 1410    HD1  HIS  90           HD1      HIS  90  -3.002  19.962  -7.426
 1411    HD2  HIS  90           HD2      HIS  90  -1.678  16.873  -4.957
 1412    HE1  HIS  90           HE1      HIS  90  -1.610  21.042  -5.606
 1413    H    GLU  91           HN       GLU  91  -0.370  17.693  -9.707
 1414    HA   GLU  91           HA       GLU  91  -1.784  19.992 -11.003
 1415   1HB   GLU  91           HB2      GLU  91   0.124  20.209  -9.060
 1416   2HB   GLU  91           HB1      GLU  91   1.121  20.249 -10.516
 1417   1HG   GLU  91           HG2      GLU  91  -0.276  22.063 -11.432
 1418   2HG   GLU  91           HG1      GLU  91  -1.281  22.022  -9.983
   
  No H/Q in entry =        1418