*HEADER    ELECTRON TRANSPORT                      12-FEB-03   1J3S              
*TITLE     SOLUTION STRUCTURE OF REDUCED RECOMBINANT HUMAN CYTOCHROME C          
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CYTOCHROME C;                                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: FERROCYTOCHROME C;                                          
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: B1-21 (DE3);                               
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PET-21A(+)                                
*KEYWDS    FERROCYTOCHROME C                                                     
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    W.-Y.JENG, J.-H.SHIU, Y.-H.TSAI, W.-J.CHUANG                          
*REVDAT   1   18-MAY-04 1J3S    0                                                

!NOE restraints 

assign ( resid 3 and name hn ) ( resid 4 and name hn ) 2.30 0.50 0.50
assign ( resid 4 and name hn ) ( resid 5 and name hn ) 2.70 0.90 0.90
assign ( resid 5 and name hn ) ( resid 6 and name hn ) 2.70 0.90 0.90 
assign ( resid 6 and name hn ) ( resid 7 and name hn ) 2.70 0.90 0.90 
assign ( resid 7 and name hn ) ( resid 8 and name hn ) 2.70 0.90 0.90 
assign ( resid 8 and name hn ) ( resid 9 and name hn ) 2.70 0.90 0.90
assign ( resid 9 and name hn ) ( resid 10 and name hn ) 2.70 0.90 0.90
assign ( resid 10 and name hn ) ( resid 11 and name hn ) 2.70 0.90 0.90
assign ( resid 11 and name hn ) ( resid 12 and name hn ) 2.70 0.90 0.90
assign ( resid 12 and name hn ) ( resid 13 and name hn ) 2.30 0.50 0.50
assign ( resid 13 and name hn ) ( resid 14 and name hn ) 2.30 0.50 0.50
assign ( resid 14 and name hn ) ( resid 15 and name hn ) 2.30 0.50 0.50
assign ( resid 15 and name hn ) ( resid 16 and name hn ) 3.40 1.60 1.60
assign ( resid 16 and name hn ) ( resid 17 and name hn ) 2.70 0.90 0.90
assign ( resid 17 and name hn ) ( resid 18 and name hn ) 2.30 0.50 0.50
assign ( resid 18 and name hn ) ( resid 19 and name hn ) 4.10 1.80 1.90
assign ( resid 22 and name hn ) ( resid 23 and name hn ) 4.10 1.80 1.90
assign ( resid 23 and name hn ) ( resid 24 and name hn ) 4.10 1.80 1.90
assign ( resid 24 and name hn ) ( resid 25 and name hn ) 2.70 0.90 0.90
assign ( resid 25 and name hn ) ( resid 26 and name hn ) 4.10 1.80 1.90
assign ( resid 31 and name hn ) ( resid 32 and name hn ) 4.10 1.80 1.90
assign ( resid 32 and name hn ) ( resid 33 and name hn ) 3.40 1.60 1.60
assign ( resid 33 and name hn ) ( resid 34 and name hn ) 4.10 1.80 1.90
assign ( resid 34 and name hn ) ( resid 35 and name hn ) 2.70 0.90 0.90
assign ( resid 35 and name hn ) ( resid 36 and name hn ) 2.70 0.90 0.90
assign ( resid 36 and name hn ) ( resid 37 and name hn ) 4.10 1.80 1.90
assign ( resid 37 and name hn ) ( resid 38 and name hn ) 2.30 0.50 0.50
assign ( resid 39 and name hn ) ( resid 40 and name hn ) 3.40 1.60 1.60
assign ( resid 40 and name hn ) ( resid 41 and name hn ) 4.10 1.80 1.90
assign ( resid 42 and name hn ) ( resid 43 and name hn ) 3.40 1.60 1.60
assign ( resid 47 and name hn ) ( resid 48 and name hn ) 4.10 1.80 1.90
assign ( resid 48 and name hn ) ( resid 49 and name hn ) 4.10 1.80 1.90
assign ( resid 49 and name hn ) ( resid 50 and name hn ) 3.40 1.60 1.60
assign ( resid 50 and name hn ) ( resid 51 and name hn ) 2.70 0.90 0.90
assign ( resid 51 and name hn ) ( resid 52 and name hn ) 2.70 0.90 0.90
assign ( resid 52 and name hn ) ( resid 53 and name hn ) 2.70 0.90 0.90
assign ( resid 53 and name hn ) ( resid 54 and name hn ) 2.70 0.90 0.90
assign ( resid 54 and name hn ) ( resid 55 and name hn ) 2.30 0.50 0.50
assign ( resid 55 and name hn ) ( resid 56 and name hn ) 3.40 1.60 1.60
assign ( resid 56 and name hn ) ( resid 57 and name hn ) 3.40 1.60 1.60
assign ( resid 57 and name hn ) ( resid 58 and name hn ) 4.10 1.80 1.90
assign ( resid 59 and name hn ) ( resid 60 and name hn ) 4.10 1.80 1.90
assign ( resid 61 and name hn ) ( resid 62 and name hn ) 4.10 1.80 1.90
assign ( resid 62 and name hn ) ( resid 63 and name hn ) 2.30 0.50 0.50
assign ( resid 63 and name hn ) ( resid 64 and name hn ) 2.30 0.50 0.50
assign ( resid 64 and name hn ) ( resid 65 and name hn ) 2.30 0.50 0.50
assign ( resid 65 and name hn ) ( resid 66 and name hn ) 2.30 0.50 0.50
assign ( resid 66 and name hn ) ( resid 67 and name hn ) 2.30 0.50 0.50
assign ( resid 68 and name hn ) ( resid 69 and name hn ) 2.70 0.90 0.90
assign ( resid 69 and name hn ) ( resid 70 and name hn ) 2.30 0.50 0.50
assign ( resid 72 and name hn ) ( resid 73 and name hn ) 2.30 0.50 0.50
assign ( resid 73 and name hn ) ( resid 74 and name hn ) 2.30 0.50 0.50
assign ( resid 74 and name hn ) ( resid 75 and name hn ) 2.30 0.50 0.50
assign ( resid 77 and name hn ) ( resid 78 and name hn ) 2.70 0.90 0.90
assign ( resid 78 and name hn ) ( resid 79 and name hn ) 4.10 1.80 1.90
assign ( resid 79 and name hn ) ( resid 80 and name hn ) 2.70 0.90 0.90
assign ( resid 81 and name hn ) ( resid 82 and name hn ) 3.40 1.60 1.60
assign ( resid 82 and name hn ) ( resid 83 and name hn ) 4.10 1.80 1.90
assign ( resid 86 and name hn ) ( resid 87 and name hn ) 3.40 1.60 1.60
assign ( resid 88 and name hn ) ( resid 89 and name hn ) 4.10 1.80 1.90
assign ( resid 89 and name hn ) ( resid 90 and name hn ) 2.70 0.90 0.90
assign ( resid 90 and name hn ) ( resid 91 and name hn ) 2.30 0.50 0.50
assign ( resid 91 and name hn ) ( resid 92 and name hn ) 2.30 0.50 0.50
assign ( resid 92 and name hn ) ( resid 93 and name hn ) 2.30 0.50 0.50
assign ( resid 93 and name hn ) ( resid 94 and name hn ) 2.30 0.50 0.50
assign ( resid 94 and name hn ) ( resid 95 and name hn ) 2.30 0.50 0.50
assign ( resid 95 and name hn ) ( resid 96 and name hn ) 2.70 0.90 0.90
assign ( resid 96 and name hn ) ( resid 97 and name hn ) 2.70 0.90 0.90
assign ( resid 97 and name hn ) ( resid 98 and name hn ) 2.30 0.50 0.50
assign ( resid 98 and name hn ) ( resid 99 and name hn ) 3.40 1.60 1.60
assign ( resid 99 and name hn ) ( resid 100 and name hn ) 2.70 0.90 0.90
assign ( resid 100 and name hn ) ( resid 101 and name hn ) 2.30 0.50 0.50
assign ( resid 101 and name hn ) ( resid 102 and name hn ) 2.30 0.50 0.50
assign ( resid 102 and name hn ) ( resid 103 and name hn ) 2.30 0.50 0.50
assign ( resid 103 and name hn ) ( resid 104 and name hn ) 2.30 0.50 0.50
assign ( resid 2 and name hn ) ( resid 1 and name ha1 ) 3.40 1.60 1.60
assign ( resid 2 and name hn ) ( resid 1 and name ha2 ) 3.40 1.60 1.60
assign ( resid 3 and name hn ) ( resid 2 and name ha ) 2.30 0.50 0.50
assign ( resid 6 and name hn ) ( resid 5 and name ha ) 3.40 1.60 1.60
assign ( resid 7 and name hn ) ( resid 6 and name ha1 ) 3.40 1.60 1.60
assign ( resid 7 and name hn ) ( resid 6 and name ha2 ) 3.40 1.60 1.60
assign ( resid 8 and name hn ) ( resid 7 and name ha ) 3.40 1.60 1.60
assign ( resid 9 and name hn ) ( resid 8 and name ha ) 2.70 0.90 0.90
assign ( resid 11 and name hn ) ( resid 10 and name ha ) 3.40 1.60 1.60
assign ( resid 12 and name hn ) ( resid 11 and name ha ) 3.40 1.60 1.60
assign ( resid 13 and name hn ) ( resid 12 and name ha ) 3.40 1.60 1.60
assign ( resid 14 and name hn ) ( resid 13 and name ha ) 4.10 1.80 1.90
assign ( resid 15 and name hn ) ( resid 14 and name ha ) 3.40 1.60 1.60
assign ( resid 16 and name hn ) ( resid 15 and name ha ) 3.40 1.60 1.60
assign ( resid 17 and name hn ) ( resid 16 and name ha ) 3.40 1.60 1.60
assign ( resid 18 and name hn ) ( resid 17 and name ha ) 4.10 1.80 1.90
assign ( resid 19 and name hn ) ( resid 18 and name ha ) 2.30 0.50 0.50
assign ( resid 20 and name hn ) ( resid 19 and name ha ) 2.30 0.50 0.50
assign ( resid 22 and name hn ) ( resid 21 and name ha ) 2.70 0.90 0.90
assign ( resid 23 and name hn ) ( resid 22 and name ha ) 2.70 0.90 0.90
assign ( resid 24 and name hn ) ( resid 23 and name ha1 ) 4.10 1.80 1.90
assign ( resid 24 and name hn ) ( resid 23 and name ha2 ) 4.10 1.80 1.90
assign ( resid 25 and name hn ) ( resid 24 and name ha1 ) 2.70 0.90 0.90
assign ( resid 25 and name hn ) ( resid 24 and name ha2 ) 2.70 0.90 0.90
assign ( resid 26 and name hn ) ( resid 25 and name ha ) 2.70 0.90 0.90
assign ( resid 27 and name hn ) ( resid 26 and name ha ) 2.70 0.90 0.90
assign ( resid 31 and name hn ) ( resid 30 and name ha ) 2.70 0.90 0.90
assign ( resid 32 and name hn ) ( resid 31 and name ha ) 2.70 0.90 0.90
assign ( resid 33 and name hn ) ( resid 32 and name ha ) 4.10 1.80 1.90
assign ( resid 34 and name hn ) ( resid 33 and name ha ) 2.70 0.90 0.90
assign ( resid 35 and name hn ) ( resid 34 and name ha1 ) 2.70 0.90 0.90
assign ( resid 35 and name hn ) ( resid 34 and name ha2 ) 2.70 0.90 0.90
assign ( resid 36 and name hn ) ( resid 35 and name ha ) 3.40 1.60 1.60
assign ( resid 37 and name hn ) ( resid 36 and name ha ) 2.30 0.50 0.50
assign ( resid 38 and name hn ) ( resid 37 and name ha1 ) 3.40 1.60 1.60
assign ( resid 38 and name hn ) ( resid 37 and name ha2 ) 3.40 1.60 1.60
assign ( resid 39 and name hn ) ( resid 38 and name ha ) 2.70 0.90 0.90
assign ( resid 40 and name hn ) ( resid 39 and name ha ) 2.30 0.50 0.50
assign ( resid 41 and name hn ) ( resid 40 and name ha ) 2.30 0.50 0.50
assign ( resid 42 and name hn ) ( resid 41 and name ha1 ) 2.70 0.90 0.90
assign ( resid 42 and name hn ) ( resid 41 and name ha2 ) 4.10 1.80 1.90
assign ( resid 43 and name hn ) ( resid 42 and name ha ) 3.40 1.60 1.60
assign ( resid 46 and name hn ) ( resid 45 and name ha1 ) 4.10 1.80 1.90
assign ( resid 46 and name hn ) ( resid 45 and name ha2 ) 4.10 1.80 1.90
assign ( resid 47 and name hn ) ( resid 46 and name ha ) 3.40 1.60 1.60
assign ( resid 48 and name hn ) ( resid 47 and name ha ) 2.70 0.90 0.90
assign ( resid 49 and name hn ) ( resid 48 and name ha ) 2.70 0.90 0.90
assign ( resid 50 and name hn ) ( resid 49 and name ha ) 2.30 0.50 0.50
assign ( resid 51 and name hn ) ( resid 50 and name ha ) 3.40 1.60 1.60
assign ( resid 53 and name hn ) ( resid 52 and name ha ) 3.40 1.60 1.60
assign ( resid 54 and name hn ) ( resid 53 and name ha ) 3.40 1.60 1.60
assign ( resid 55 and name hn ) ( resid 54 and name ha ) 2.70 0.90 0.90
assign ( resid 57 and name hn ) ( resid 56 and name ha1 ) 3.40 1.60 1.60
assign ( resid 57 and name hn ) ( resid 56 and name ha2 ) 3.40 1.60 1.60
assign ( resid 58 and name hn ) ( resid 57 and name ha ) 2.30 0.50 0.50
assign ( resid 59 and name hn ) ( resid 58 and name ha ) 2.70 0.90 0.90
assign ( resid 60 and name hn ) ( resid 59 and name ha ) 2.30 0.50 0.50
assign ( resid 61 and name hn ) ( resid 60 and name ha1 ) 3.40 1.60 1.60
assign ( resid 61 and name hn ) ( resid 60 and name ha2 ) 3.40 1.60 1.60
assign ( resid 62 and name hn ) ( resid 61 and name ha ) 2.70 0.90 0.90
assign ( resid 63 and name hn ) ( resid 62 and name ha ) 3.40 1.60 1.60
assign ( resid 64 and name hn ) ( resid 63 and name ha ) 3.40 1.60 1.60
assign ( resid 65 and name hn ) ( resid 64 and name ha ) 3.40 1.60 1.60
assign ( resid 66 and name hn ) ( resid 65 and name ha ) 3.40 1.60 1.60
assign ( resid 67 and name hn ) ( resid 66 and name ha ) 3.40 1.60 1.60
assign ( resid 68 and name hn ) ( resid 67 and name ha ) 3.40 1.60 1.60
assign ( resid 69 and name hn ) ( resid 68 and name ha ) 3.40 1.60 1.60
assign ( resid 70 and name hn ) ( resid 69 and name ha ) 3.40 1.60 1.60
assign ( resid 72 and name hn ) ( resid 71 and name ha ) 4.10 1.80 1.90
assign ( resid 73 and name hn ) ( resid 72 and name ha ) 2.70 0.90 0.90
assign ( resid 74 and name hn ) ( resid 73 and name ha ) 3.40 1.60 1.60
assign ( resid 77 and name hn ) ( resid 76 and name ha ) 2.30 0.50 0.50
assign ( resid 78 and name hn ) ( resid 77 and name ha1 ) 3.40 1.60 1.60
assign ( resid 78 and name hn ) ( resid 77 and name ha2 ) 3.40 1.60 1.60
assign ( resid 79 and name hn ) ( resid 78 and name ha ) 2.70 0.90 0.90
assign ( resid 80 and name hn ) ( resid 79 and name ha ) 2.70 0.90 0.90
assign ( resid 81 and name hn ) ( resid 80 and name ha ) 2.30 0.50 0.50
assign ( resid 82 and name hn ) ( resid 81 and name ha ) 2.70 0.90 0.90
assign ( resid 83 and name hn ) ( resid 82 and name ha ) 2.70 0.90 0.90
assign ( resid 85 and name hn ) ( resid 84 and name ha1 ) 2.70 0.90 0.90
assign ( resid 85 and name hn ) ( resid 84 and name ha2 ) 2.70 0.90 0.90
assign ( resid 86 and name hn ) ( resid 85 and name ha ) 2.70 0.90 0.90
assign ( resid 87 and name hn ) ( resid 86 and name ha ) 3.40 1.60 1.60
assign ( resid 88 and name hn ) ( resid 87 and name ha ) 2.70 0.90 0.90
assign ( resid 89 and name hn ) ( resid 88 and name ha ) 4.10 1.80 1.90
assign ( resid 90 and name hn ) ( resid 89 and name ha ) 3.40 1.60 1.60
assign ( resid 91 and name hn ) ( resid 90 and name ha ) 3.40 1.60 1.60
assign ( resid 92 and name hn ) ( resid 91 and name ha ) 3.40 1.60 1.60
assign ( resid 93 and name hn ) ( resid 92 and name ha ) 2.70 0.90 0.90
assign ( resid 95 and name hn ) ( resid 94 and name ha ) 3.40 1.60 1.60
assign ( resid 96 and name hn ) ( resid 95 and name ha ) 3.40 1.60 1.60
assign ( resid 97 and name hn ) ( resid 96 and name ha ) 3.40 1.60 1.60
assign ( resid 98 and name hn ) ( resid 97 and name ha ) 3.40 1.60 1.60
assign ( resid 99 and name hn ) ( resid 98 and name ha ) 3.40 1.60 1.60
assign ( resid 100 and name hn ) ( resid 99 and name ha ) 3.40 1.60 1.60
assign ( resid 101 and name hn ) ( resid 100 and name ha ) 2.70 0.90 0.90
assign ( resid 102 and name hn ) ( resid 101 and name ha ) 3.40 1.60 1.60
assign ( resid 103 and name hn ) ( resid 102 and name ha ) 3.40 1.60 1.60
assign ( resid 104 and name hn ) ( resid 103 and name ha ) 2.70 0.90 0.90
assign ( resid 2 and name hn ) ( resid 2 and name ha ) 4.10 1.80 1.90
assign ( resid 3 and name hn ) ( resid 3 and name ha ) 2.70 0.90 0.90
assign ( resid 4 and name hn ) ( resid 4 and name ha ) 2.70 0.90 0.90
assign ( resid 5 and name hn ) ( resid 5 and name ha ) 2.70 0.90 0.90
assign ( resid 6 and name hn ) ( resid 6 and name ha1 ) 2.70 0.90 0.90
assign ( resid 6 and name hn ) ( resid 6 and name ha2 ) 2.70 0.90 0.90
assign ( resid 7 and name hn ) ( resid 7 and name ha ) 2.70 0.90 0.90
assign ( resid 8 and name hn ) ( resid 8 and name ha ) 2.70 0.90 0.90
assign ( resid 9 and name hn ) ( resid 9 and name ha ) 2.70 0.90 0.90
assign ( resid 10 and name hn ) ( resid 10 and name ha ) 2.70 0.90 0.90
assign ( resid 11 and name hn ) ( resid 11 and name ha ) 2.70 0.90 0.90
assign ( resid 12 and name hn ) ( resid 12 and name ha ) 2.70 0.90 0.90
assign ( resid 13 and name hn ) ( resid 13 and name ha ) 2.70 0.90 0.90
assign ( resid 14 and name hn ) ( resid 14 and name ha ) 3.40 1.60 1.60
assign ( resid 15 and name hn ) ( resid 15 and name ha ) 2.70 0.90 0.90
assign ( resid 16 and name hn ) ( resid 16 and name ha ) 2.70 0.90 0.90
assign ( resid 17 and name hn ) ( resid 17 and name ha ) 3.40 1.60 1.60
assign ( resid 18 and name hn ) ( resid 18 and name ha ) 2.70 0.90 0.90
assign ( resid 19 and name hn ) ( resid 19 and name ha ) 3.40 1.60 1.60
assign ( resid 20 and name hn ) ( resid 20 and name ha ) 3.40 1.60 1.60
assign ( resid 22 and name hn ) ( resid 22 and name ha ) 2.70 0.90 0.90
assign ( resid 23 and name hn ) ( resid 23 and name ha1 ) 2.30 0.50 3.20
assign ( resid 23 and name hn ) ( resid 23 and name ha2 ) 2.30 0.50 3.20
assign ( resid 24 and name hn ) ( resid 24 and name ha1 ) 2.30 0.50 0.50
assign ( resid 24 and name hn ) ( resid 24 and name ha2 ) 2.70 0.90 0.90
assign ( resid 25 and name hn ) ( resid 25 and name ha ) 2.70 0.90 0.90
assign ( resid 26 and name hn ) ( resid 26 and name ha ) 2.70 0.90 0.90
assign ( resid 27 and name hn ) ( resid 27 and name ha ) 2.30 0.50 0.50
assign ( resid 29 and name hn ) ( resid 29 and name ha1 ) 2.70 0.90 0.90
assign ( resid 29 and name hn ) ( resid 29 and name ha2 ) 2.70 0.90 0.90
assign ( resid 31 and name hn ) ( resid 31 and name ha ) 4.10 1.80 1.90
assign ( resid 32 and name hn ) ( resid 32 and name ha ) 2.30 0.50 0.50
assign ( resid 33 and name hn ) ( resid 33 and name ha ) 3.40 1.60 1.60
assign ( resid 34 and name hn ) ( resid 34 and name ha1 ) 2.70 0.90 0.90
assign ( resid 34 and name hn ) ( resid 34 and name ha2 ) 2.70 0.90 0.90
assign ( resid 35 and name hn ) ( resid 35 and name ha ) 2.30 0.50 0.50
assign ( resid 36 and name hn ) ( resid 36 and name ha ) 2.70 0.90 0.90
assign ( resid 37 and name hn ) ( resid 37 and name ha1 ) 2.70 0.90 0.90
assign ( resid 37 and name hn ) ( resid 37 and name ha2 ) 3.40 1.60 1.60
assign ( resid 38 and name hn ) ( resid 38 and name ha ) 2.70 0.90 0.90
assign ( resid 39 and name hn ) ( resid 39 and name ha ) 2.70 0.90 0.90
assign ( resid 40 and name hn ) ( resid 40 and name ha ) 2.70 0.90 0.90
assign ( resid 41 and name hn ) ( resid 41 and name ha1 ) 2.30 0.50 0.50
assign ( resid 41 and name hn ) ( resid 41 and name ha2 ) 2.70 0.90 0.90
assign ( resid 42 and name hn ) ( resid 42 and name ha ) 2.70 0.90 0.90
assign ( resid 43 and name hn ) ( resid 43 and name ha ) 3.40 1.60 1.60
assign ( resid 46 and name hn ) ( resid 46 and name ha ) 4.10 1.80 1.90
assign ( resid 47 and name hn ) ( resid 47 and name ha ) 3.40 1.60 1.60
assign ( resid 48 and name hn ) ( resid 48 and name ha ) 3.40 1.60 1.60
assign ( resid 49 and name hn ) ( resid 49 and name ha ) 3.40 1.60 1.60
assign ( resid 50 and name hn ) ( resid 50 and name ha ) 2.30 0.50 0.50
assign ( resid 51 and name hn ) ( resid 51 and name ha ) 2.30 0.50 0.50
assign ( resid 52 and name hn ) ( resid 52 and name ha ) 2.70 0.90 0.90
assign ( resid 53 and name hn ) ( resid 53 and name ha ) 2.30 0.50 0.50
assign ( resid 54 and name hn ) ( resid 54 and name ha ) 2.30 0.50 0.50
assign ( resid 55 and name hn ) ( resid 55 and name ha ) 2.30 0.50 0.50
assign ( resid 56 and name hn ) ( resid 56 and name ha1 ) 2.70 0.90 0.90
assign ( resid 56 and name hn ) ( resid 56 and name ha2 ) 2.70 0.90 0.90
assign ( resid 57 and name hn ) ( resid 57 and name ha ) 3.40 1.60 1.60
assign ( resid 58 and name hn ) ( resid 58 and name ha ) 2.70 0.90 0.90
assign ( resid 59 and name hn ) ( resid 59 and name ha ) 2.30 0.50 0.50
assign ( resid 60 and name hn ) ( resid 60 and name ha1 ) 2.70 0.90 0.90
assign ( resid 60 and name hn ) ( resid 60 and name ha2 ) 2.70 0.90 0.90
assign ( resid 61 and name hn ) ( resid 61 and name ha ) 2.70 0.90 0.90
assign ( resid 62 and name hn ) ( resid 62 and name ha ) 2.30 0.50 0.50
assign ( resid 63 and name hn ) ( resid 63 and name ha ) 2.30 0.50 0.50
assign ( resid 64 and name hn ) ( resid 64 and name ha ) 2.70 0.90 0.90
assign ( resid 65 and name hn ) ( resid 65 and name ha ) 2.30 0.50 0.50
assign ( resid 66 and name hn ) ( resid 66 and name ha ) 2.30 0.50 0.50
assign ( resid 67 and name hn ) ( resid 67 and name ha ) 2.70 0.90 0.90
assign ( resid 68 and name hn ) ( resid 68 and name ha ) 3.40 1.60 1.60
assign ( resid 69 and name hn ) ( resid 69 and name ha ) 2.30 0.50 0.50
assign ( resid 70 and name hn ) ( resid 70 and name ha ) 2.70 0.90 0.90
assign ( resid 72 and name hn ) ( resid 72 and name ha ) 2.30 0.50 0.50
assign ( resid 73 and name hn ) ( resid 73 and name ha ) 2.70 0.90 0.90
assign ( resid 74 and name hn ) ( resid 74 and name ha ) 2.70 0.90 0.90
assign ( resid 75 and name hn ) ( resid 75 and name ha ) 4.10 1.80 1.90
assign ( resid 77 and name hn ) ( resid 77 and name ha1 ) 2.70 0.90 0.90
assign ( resid 77 and name hn ) ( resid 77 and name ha2 ) 2.70 0.90 0.90
assign ( resid 78 and name hn ) ( resid 78 and name ha ) 2.70 0.90 0.90
assign ( resid 79 and name hn ) ( resid 79 and name ha ) 4.10 1.80 1.90
assign ( resid 80 and name hn ) ( resid 80 and name ha ) 3.40 1.60 1.60
assign ( resid 81 and name hn ) ( resid 81 and name ha ) 2.70 0.90 0.90
assign ( resid 82 and name hn ) ( resid 82 and name ha ) 3.40 1.60 1.60
assign ( resid 83 and name hn ) ( resid 83 and name ha ) 2.70 0.90 0.90
assign ( resid 85 and name hn ) ( resid 85 and name ha ) 3.40 1.60 1.60
assign ( resid 86 and name hn ) ( resid 86 and name ha ) 3.40 1.60 1.60
assign ( resid 87 and name hn ) ( resid 87 and name ha ) 2.70 0.90 0.90
assign ( resid 88 and name hn ) ( resid 88 and name ha ) 4.10 1.80 1.90
assign ( resid 89 and name hn ) ( resid 89 and name ha ) 2.30 0.50 0.50
assign ( resid 90 and name hn ) ( resid 90 and name ha ) 2.70 0.90 0.90
assign ( resid 91 and name hn ) ( resid 91 and name ha ) 2.70 0.90 0.90
assign ( resid 92 and name hn ) ( resid 92 and name ha ) 2.30 0.50 0.50
assign ( resid 93 and name hn ) ( resid 93 and name ha ) 2.30 0.50 0.50
assign ( resid 94 and name hn ) ( resid 94 and name ha ) 2.70 0.90 0.90
assign ( resid 95 and name hn ) ( resid 95 and name ha ) 2.70 0.90 0.90
assign ( resid 96 and name hn ) ( resid 96 and name ha ) 2.30 0.50 0.50
assign ( resid 97 and name hn ) ( resid 97 and name ha ) 2.30 0.50 0.50
assign ( resid 98 and name hn ) ( resid 98 and name ha ) 2.70 0.90 0.90
assign ( resid 99 and name hn ) ( resid 99 and name ha ) 2.30 0.50 0.50
assign ( resid 100 and name hn ) ( resid 100 and name ha ) 2.70 0.90 0.90
assign ( resid 101 and name hn ) ( resid 101 and name ha ) 2.30 0.50 0.50
assign ( resid 102 and name hn ) ( resid 102 and name ha ) 2.70 0.90 0.90
assign ( resid 103 and name hn ) ( resid 103 and name ha ) 2.30 0.50 0.50
assign ( resid 104 and name hn ) ( resid 104 and name ha ) 2.70 0.90 0.90
assign ( resid 2 and name hn ) ( resid 2 and name hb1 ) 3.40 1.60 1.60
assign ( resid 2 and name hn ) ( resid 2 and name hb2 ) 3.40 1.60 1.60
assign ( resid 3 and name hn ) ( resid 3 and name hb ) 2.30 0.50 0.50
assign ( resid 4 and name hn ) ( resid 4 and name hb* ) 2.30 0.50 1.00
assign ( resid 5 and name hn ) ( resid 5 and name hb* ) 2.30 0.50 1.00
assign ( resid 7 and name hn ) ( resid 7 and name hb1 ) 2.30 0.50 0.50
assign ( resid 7 and name hn ) ( resid 7 and name hb2 ) 2.30 0.50 0.50
assign ( resid 8 and name hn ) ( resid 8 and name hb* ) 2.30 0.50 1.00
assign ( resid 9 and name hn ) ( resid 9 and name hb ) 2.30 0.50 0.50
assign ( resid 10 and name hn ) ( resid 10 and name hb1 ) 2.30 0.50 0.50
assign ( resid 10 and name hn ) ( resid 10 and name hb2 ) 2.30 0.50 0.50
assign ( resid 11 and name hn ) ( resid 11 and name hb ) 2.30 0.50 0.50
assign ( resid 12 and name hn ) ( resid 12 and name hb* ) 2.30 0.50 1.00
assign ( resid 13 and name hn ) ( resid 13 and name hb1 ) 2.70 0.90 0.90
assign ( resid 13 and name hn ) ( resid 13 and name hb2 ) 2.70 0.90 0.90
assign ( resid 14 and name hn ) ( resid 14 and name hb1 ) 3.40 1.60 1.60
assign ( resid 14 and name hn ) ( resid 14 and name hb2 ) 3.40 1.60 1.60
assign ( resid 15 and name hn ) ( resid 15 and name hb1 ) 2.30 0.50 0.50
assign ( resid 15 and name hn ) ( resid 15 and name hb2 ) 2.30 0.50 0.50
assign ( resid 16 and name hn ) ( resid 16 and name hb1 ) 2.70 0.90 0.90
assign ( resid 16 and name hn ) ( resid 16 and name hb2 ) 2.70 0.90 0.90
assign ( resid 17 and name hn ) ( resid 17 and name hb1 ) 2.70 0.90 0.90
assign ( resid 17 and name hn ) ( resid 17 and name hb2 ) 2.70 0.90 0.90
assign ( resid 18 and name hn ) ( resid 18 and name hb1 ) 3.40 1.60 1.60
assign ( resid 18 and name hn ) ( resid 18 and name hb2 ) 3.40 1.60 1.60
assign ( resid 19 and name hn ) ( resid 19 and name hb ) 3.40 1.60 1.60
assign ( resid 20 and name hn ) ( resid 20 and name hb ) 2.70 0.90 0.90
assign ( resid 22 and name hn ) ( resid 22 and name hb1 ) 2.30 0.50 0.50
assign ( resid 22 and name hn ) ( resid 22 and name hb2 ) 2.30 0.50 0.50
assign ( resid 25 and name hn ) ( resid 25 and name hb1 ) 2.30 0.50 0.50
assign ( resid 25 and name hn ) ( resid 25 and name hb2 ) 2.30 0.50 0.50
assign ( resid 26 and name hn ) ( resid 26 and name hb1 ) 4.10 1.80 1.90
assign ( resid 26 and name hn ) ( resid 26 and name hb2 ) 2.70 0.90 0.90
assign ( resid 27 and name hn ) ( resid 27 and name hb1 ) 2.70 0.90 0.90
assign ( resid 27 and name hn ) ( resid 27 and name hb2 ) 4.10 1.80 1.90
assign ( resid 31 and name hn ) ( resid 31 and name hb1 ) 2.30 0.50 3.20
assign ( resid 31 and name hn ) ( resid 31 and name hb2 ) 2.30 0.50 3.20
assign ( resid 32 and name hn ) ( resid 32 and name hb1 ) 2.70 0.90 0.90
assign ( resid 32 and name hn ) ( resid 32 and name hb2 ) 2.30 0.50 1.80
assign ( resid 33 and name hn ) ( resid 33 and name hb* ) 2.30 0.50 1.00
assign ( resid 35 and name hn ) ( resid 35 and name hb1 ) 2.30 0.50 0.50
assign ( resid 35 and name hn ) ( resid 35 and name hb2 ) 2.30 0.50 0.50
assign ( resid 36 and name hn ) ( resid 36 and name hb1 ) 2.70 0.90 0.90
assign ( resid 36 and name hn ) ( resid 36 and name hb2 ) 2.30 0.50 0.50
assign ( resid 38 and name hn ) ( resid 38 and name hb1 ) 2.70 0.90 0.90
assign ( resid 38 and name hn ) ( resid 38 and name hb2 ) 2.70 0.90 0.90
assign ( resid 39 and name hn ) ( resid 39 and name hb* ) 2.70 0.90 1.40
assign ( resid 42 and name hn ) ( resid 42 and name hb1 ) 1.80 0.00 2.50
assign ( resid 42 and name hn ) ( resid 42 and name hb2 ) 3.40 1.60 1.60
assign ( resid 43 and name hn ) ( resid 43 and name hb* ) 2.30 0.50 1.00
assign ( resid 46 and name hn ) ( resid 46 and name hb1 ) 2.70 0.90 0.90
assign ( resid 46 and name hn ) ( resid 46 and name hb2 ) 2.70 0.90 0.90
assign ( resid 47 and name hn ) ( resid 47 and name hb1 ) 3.40 1.60 1.60
assign ( resid 47 and name hn ) ( resid 47 and name hb2 ) 3.40 1.60 1.60
assign ( resid 48 and name hn ) ( resid 48 and name hb1 ) 2.70 0.90 0.90
assign ( resid 48 and name hn ) ( resid 48 and name hb2 ) 2.70 0.90 0.90
assign ( resid 49 and name hn ) ( resid 49 and name hb ) 4.10 1.80 1.90
assign ( resid 50 and name hn ) ( resid 50 and name hb* ) 2.30 0.50 1.00
assign ( resid 51 and name hn ) ( resid 51 and name hb* ) 2.30 0.50 1.00
assign ( resid 52 and name hn ) ( resid 52 and name hb1 ) 2.70 0.90 0.90
assign ( resid 52 and name hn ) ( resid 52 and name hb2 ) 2.30 0.50 0.50
assign ( resid 53 and name hn ) ( resid 53 and name hb* ) 2.30 0.50 1.00
assign ( resid 54 and name hn ) ( resid 54 and name hb* ) 2.30 0.50 1.00
assign ( resid 55 and name hn ) ( resid 55 and name hb1 ) 2.30 0.50 0.50
assign ( resid 55 and name hn ) ( resid 55 and name hb2 ) 2.30 0.50 0.50
assign ( resid 57 and name hn ) ( resid 57 and name hb ) 3.40 1.60 1.60
assign ( resid 58 and name hn ) ( resid 58 and name hb ) 2.70 0.90 0.90
assign ( resid 59 and name hn ) ( resid 59 and name hb1 ) 2.70 0.90 0.90
assign ( resid 59 and name hn ) ( resid 59 and name hb2 ) 2.70 0.90 0.90
assign ( resid 61 and name hn ) ( resid 61 and name hb* ) 2.70 0.90 1.40
assign ( resid 62 and name hn ) ( resid 62 and name hb* ) 2.30 0.50 1.00
assign ( resid 63 and name hn ) ( resid 63 and name hb ) 3.40 1.60 1.60
assign ( resid 64 and name hn ) ( resid 64 and name hb1 ) 2.30 0.50 1.00
assign ( resid 64 and name hn ) ( resid 64 and name hb2 ) 2.30 0.50 1.00
assign ( resid 65 and name hn ) ( resid 65 and name hb1 ) 2.30 0.50 0.50
assign ( resid 65 and name hn ) ( resid 65 and name hb2 ) 2.30 0.50 0.50
assign ( resid 66 and name hn ) ( resid 66 and name hb1 ) 2.30 0.50 0.50
assign ( resid 66 and name hn ) ( resid 66 and name hb2 ) 2.30 0.50 0.50
assign ( resid 67 and name hn ) ( resid 67 and name hb1 ) 2.70 0.90 0.90
assign ( resid 67 and name hn ) ( resid 67 and name hb2 ) 2.70 0.90 0.90
assign ( resid 68 and name hn ) ( resid 68 and name hb1 ) 2.70 0.90 0.90
assign ( resid 68 and name hn ) ( resid 68 and name hb2 ) 2.30 0.50 0.50
assign ( resid 69 and name hn ) ( resid 69 and name hb1 ) 2.30 0.50 0.50
assign ( resid 69 and name hn ) ( resid 69 and name hb2 ) 2.30 0.50 0.50
assign ( resid 70 and name hn ) ( resid 70 and name hb* ) 2.70 0.90 1.40
assign ( resid 72 and name hn ) ( resid 72 and name hb1 ) 2.30 0.50 0.50
assign ( resid 72 and name hn ) ( resid 72 and name hb2 ) 2.30 0.50 0.50
assign ( resid 73 and name hn ) ( resid 73 and name hb* ) 2.30 0.50 1.00
assign ( resid 74 and name hn ) ( resid 74 and name hb1 ) 2.70 0.90 0.90
assign ( resid 74 and name hn ) ( resid 74 and name hb2 ) 2.30 0.50 0.50
assign ( resid 75 and name hn ) ( resid 75 and name hb ) 2.30 0.50 0.50
assign ( resid 78 and name hn ) ( resid 78 and name hb ) 2.30 0.50 0.50
assign ( resid 79 and name hn ) ( resid 79 and name hb1 ) 3.40 1.60 1.60
assign ( resid 79 and name hn ) ( resid 79 and name hb2 ) 4.10 1.80 1.90
assign ( resid 80 and name hn ) ( resid 80 and name hb1 ) 2.70 0.90 0.90
assign ( resid 80 and name hn ) ( resid 80 and name hb2 ) 4.10 1.80 1.90
assign ( resid 81 and name hn ) ( resid 81 and name hb ) 2.30 0.50 0.50
assign ( resid 82 and name hn ) ( resid 82 and name hb1 ) 1.80 0.00 2.50
assign ( resid 82 and name hn ) ( resid 82 and name hb2 ) 3.40 1.60 1.60
assign ( resid 83 and name hn ) ( resid 83 and name hb ) 2.70 0.90 0.90
assign ( resid 85 and name hn ) ( resid 85 and name hb ) 2.70 0.90 0.90
assign ( resid 86 and name hn ) ( resid 86 and name hb* ) 2.70 0.90 1.40
assign ( resid 87 and name hn ) ( resid 87 and name hb1 ) 2.70 0.90 0.90
assign ( resid 87 and name hn ) ( resid 87 and name hb2 ) 1.80 0.00 2.50
assign ( resid 88 and name hn ) ( resid 88 and name hb1 ) 3.40 1.60 1.60
assign ( resid 88 and name hn ) ( resid 88 and name hb2 ) 3.40 1.60 1.60
assign ( resid 89 and name hn ) ( resid 89 and name hb* ) 2.30 0.50 1.00
assign ( resid 90 and name hn ) ( resid 90 and name hb* ) 2.30 0.50 1.00
assign ( resid 91 and name hn ) ( resid 91 and name hb1 ) 2.70 0.90 0.90
assign ( resid 91 and name hn ) ( resid 91 and name hb2 ) 2.70 0.90 0.90
assign ( resid 92 and name hn ) ( resid 92 and name hb* ) 2.30 0.50 1.00
assign ( resid 93 and name hn ) ( resid 93 and name hb* ) 2.30 0.50 1.00
assign ( resid 94 and name hn ) ( resid 94 and name hb1 ) 2.70 0.90 0.90
assign ( resid 94 and name hn ) ( resid 94 and name hb2 ) 2.30 0.50 0.50
assign ( resid 95 and name hn ) ( resid 95 and name hb* ) 2.30 0.50 1.00
assign ( resid 96 and name hn ) ( resid 96 and name hb* ) 2.30 0.50 1.00
assign ( resid 97 and name hn ) ( resid 97 and name hb1 ) 2.30 0.50 0.50
assign ( resid 97 and name hn ) ( resid 97 and name hb2 ) 2.30 0.50 0.50
assign ( resid 98 and name hn ) ( resid 98 and name hb* ) 2.30 0.50 1.00
assign ( resid 99 and name hn ) ( resid 99 and name hb1 ) 2.30 0.50 1.00
assign ( resid 99 and name hn ) ( resid 99 and name hb2 ) 2.30 0.50 1.00
assign ( resid 100 and name hn ) ( resid 100 and name hb* ) 2.30 0.50 1.00
assign ( resid 101 and name hn ) ( resid 101 and name hb* ) 2.30 0.50 1.00
assign ( resid 102 and name hn ) ( resid 102 and name hb ) 2.70 0.90 0.90
assign ( resid 103 and name hn ) ( resid 103 and name hb1 ) 2.70 0.90 0.90
assign ( resid 103 and name hn ) ( resid 103 and name hb2 ) 2.70 0.90 0.90
assign ( resid 104 and name hn ) ( resid 104 and name hb* ) 2.70 0.90 1.40
assign ( resid 1 and name ha1 ) ( resid 1 and name ha2 ) 2.30 0.53 0.50 
assign ( resid 2 and name ha ) ( resid 2 and name hb1 ) 2.70 0.90 0.90 
assign ( resid 2 and name ha ) ( resid 2 and name hb2 ) 2.70 0.90 0.90 
assign ( resid 3 and name ha ) ( resid 3 and name hb ) 3.40 1.60 1.60
assign ( resid 4 and name ha ) ( resid 4 and name hb* ) 2.30 0.50 1.00
assign ( resid 5 and name ha ) ( resid 5 and name hb* ) 2.30 0.50 1.00
assign ( resid 6 and name ha1 ) ( resid 6 and name ha2 ) 2.30 0.53 0.50
assign ( resid 7 and name ha ) ( resid 7 and name hb1 ) 3.40 1.60 1.60
assign ( resid 7 and name ha ) ( resid 7 and name hb2 ) 3.40 1.60 1.60
assign ( resid 8 and name ha ) ( resid 8 and name hb* ) 2.30 0.50 1.00
assign ( resid 9 and name ha ) ( resid 9 and name hb ) 4.10 1.80 1.90
assign ( resid 10 and name ha ) ( resid 10 and name hb1 ) 4.10 1.80 1.90
assign ( resid 10 and name ha ) ( resid 10 and name hb2 ) 4.10 1.80 1.90
assign ( resid 11 and name ha ) ( resid 11 and name hb ) 3.40 1.60 1.60
assign ( resid 12 and name ha ) ( resid 12 and name hb* ) 4.10 1.80 2.40
assign ( resid 13 and name ha ) ( resid 13 and name hb1 ) 3.40 1.60 1.60
assign ( resid 13 and name ha ) ( resid 13 and name hb2 ) 3.40 1.60 1.60
assign ( resid 14 and name ha ) ( resid 14 and name hb1 ) 4.10 1.80 1.90
assign ( resid 14 and name ha ) ( resid 14 and name hb2 ) 4.10 1.80 1.90
assign ( resid 16 and name ha ) ( resid 16 and name hb1 ) 2.70 0.90 0.90
assign ( resid 16 and name ha ) ( resid 16 and name hb2 ) 3.40 1.60 1.60
assign ( resid 17 and name ha ) ( resid 17 and name hb1 ) 3.40 1.60 1.60
assign ( resid 17 and name ha ) ( resid 17 and name hb2 ) 3.40 1.60 1.60
assign ( resid 18 and name ha ) ( resid 18 and name hb1 ) 4.10 1.80 1.90
assign ( resid 18 and name ha ) ( resid 18 and name hb2 ) 3.40 1.60 1.60
assign ( resid 20 and name ha ) ( resid 20 and name hb ) 2.30 0.50 0.50
assign ( resid 21 and name ha ) ( resid 21 and name hb* ) 2.70 0.90 1.40
assign ( resid 22 and name ha ) ( resid 22 and name hb1 ) 3.40 1.60 1.60
assign ( resid 22 and name ha ) ( resid 22 and name hb2 ) 3.40 1.60 1.60
assign ( resid 23 and name ha1 ) ( resid 23 and name ha2 ) 2.30 0.53 0.50
assign ( resid 24 and name ha1 ) ( resid 24 and name ha2 ) 2.30 0.53 0.50
assign ( resid 25 and name ha ) ( resid 25 and name hb1 ) 4.10 1.80 1.90
assign ( resid 25 and name ha ) ( resid 25 and name hb2 ) 4.10 1.80 1.90
assign ( resid 26 and name ha ) ( resid 26 and name hb1 ) 4.10 1.80 1.90
assign ( resid 26 and name ha ) ( resid 26 and name hb2 ) 4.10 1.80 1.90
assign ( resid 27 and name ha ) ( resid 27 and name hb1 ) 3.40 1.60 1.60
assign ( resid 27 and name ha ) ( resid 27 and name hb2 ) 4.10 1.80 1.90
assign ( resid 29 and name ha1 ) ( resid 29 and name ha2 ) 2.70 0.93 0.90
assign ( resid 31 and name ha ) ( resid 31 and name hb1 ) 4.10 1.80 1.90
assign ( resid 31 and name ha ) ( resid 31 and name hb2 ) 4.10 1.80 1.90
assign ( resid 32 and name ha ) ( resid 32 and name hb1 ) 4.10 1.80 1.90
assign ( resid 32 and name ha ) ( resid 32 and name hb2 ) 4.10 1.80 1.90
assign ( resid 35 and name ha ) ( resid 35 and name hb1 ) 4.10 1.80 1.90
assign ( resid 35 and name ha ) ( resid 35 and name hb2 ) 4.10 1.80 1.90
assign ( resid 36 and name ha ) ( resid 36 and name hb1 ) 4.10 1.80 1.90
assign ( resid 36 and name ha ) ( resid 36 and name hb2 ) 4.10 1.80 1.90
assign ( resid 37 and name ha1 ) ( resid 37 and name ha2 ) 2.30 0.53 0.50
assign ( resid 38 and name ha ) ( resid 38 and name hb1 ) 4.10 1.80 1.90
assign ( resid 38 and name ha ) ( resid 38 and name hb2 ) 4.10 1.80 1.90
assign ( resid 39 and name ha ) ( resid 39 and name hb* ) 4.10 1.80 2.40
assign ( resid 41 and name ha1 ) ( resid 41 and name ha2 ) 2.30 0.53 0.50
assign ( resid 42 and name ha ) ( resid 42 and name hb1 ) 3.40 1.60 1.60
assign ( resid 42 and name ha ) ( resid 42 and name hb2 ) 2.70 0.90 0.90
assign ( resid 43 and name ha ) ( resid 43 and name hb* ) 2.30 0.50 1.00
assign ( resid 45 and name ha1 ) ( resid 45 and name ha2 ) 2.30 0.53 0.50
assign ( resid 47 and name ha ) ( resid 47 and name hb1 ) 3.40 1.60 1.60
assign ( resid 47 and name ha ) ( resid 47 and name hb2 ) 3.40 1.60 1.60
assign ( resid 48 and name ha ) ( resid 48 and name hb1 ) 4.10 1.80 1.90
assign ( resid 48 and name ha ) ( resid 48 and name hb2 ) 4.10 1.80 1.90
assign ( resid 49 and name ha ) ( resid 49 and name hb ) 2.70 0.90 0.90
assign ( resid 50 and name ha ) ( resid 50 and name hb* ) 2.30 0.50 1.00
assign ( resid 51 and name ha ) ( resid 51 and name hb* ) 2.30 0.50 1.00
assign ( resid 53 and name ha ) ( resid 53 and name hb* ) 2.70 0.90 1.40
assign ( resid 54 and name ha ) ( resid 54 and name hb* ) 2.30 0.50 1.00
assign ( resid 57 and name ha ) ( resid 57 and name hb ) 3.40 1.60 1.60
assign ( resid 59 and name ha ) ( resid 59 and name hb1 ) 4.10 1.80 1.90
assign ( resid 59 and name ha ) ( resid 59 and name hb2 ) 4.10 1.80 1.90
assign ( resid 61 and name ha ) ( resid 61 and name hb* ) 2.30 0.50 1.00
assign ( resid 62 and name ha ) ( resid 62 and name hb* ) 2.30 0.50 1.00
assign ( resid 64 and name ha ) ( resid 64 and name hb1 ) 4.10 1.80 1.90
assign ( resid 64 and name ha ) ( resid 64 and name hb2 ) 4.10 1.80 1.90
assign ( resid 68 and name ha ) ( resid 68 and name hb1 ) 4.10 1.80 1.90
assign ( resid 68 and name ha ) ( resid 68 and name hb2 ) 4.10 1.80 1.90
assign ( resid 70 and name ha ) ( resid 70 and name hb* ) 2.30 0.50 1.00
assign ( resid 72 and name ha ) ( resid 72 and name hb1 ) 4.10 1.80 1.90
assign ( resid 72 and name ha ) ( resid 72 and name hb2 ) 4.10 1.80 1.90
assign ( resid 73 and name ha ) ( resid 73 and name hb* ) 2.70 0.90 1.40
assign ( resid 74 and name ha ) ( resid 74 and name hb1 ) 4.10 1.80 1.90
assign ( resid 74 and name ha ) ( resid 74 and name hb2 ) 4.10 1.80 1.90
assign ( resid 77 and name ha1 ) ( resid 77 and name ha2 ) 2.30 0.53 0.50
assign ( resid 78 and name ha ) ( resid 78 and name hb ) 2.70 0.90 0.90
assign ( resid 79 and name ha ) ( resid 79 and name hb1 ) 2.70 0.90 0.90
assign ( resid 79 and name ha ) ( resid 79 and name hb2 ) 2.70 0.90 0.90
assign ( resid 80 and name ha ) ( resid 80 and name hb1 ) 4.10 1.80 1.90
assign ( resid 80 and name ha ) ( resid 80 and name hb2 ) 4.10 1.80 1.90
assign ( resid 80 and name hb1 ) ( resid 80 and name hg1 ) 4.10 1.80 1.90
assign ( resid 80 and name hb1 ) ( resid 80 and name hg2 ) 4.10 1.80 1.90
assign ( resid 80 and name hb1 ) ( resid 80 and name he* ) 4.10 1.80 2.40
assign ( resid 80 and name hb2 ) ( resid 80 and name hg1 ) 4.10 1.80 1.90
assign ( resid 80 and name hb2 ) ( resid 80 and name hg2 ) 4.10 1.80 1.90
assign ( resid 80 and name hb2 ) ( resid 80 and name he* ) 4.10 1.80 2.40
assign ( resid 81 and name ha ) ( resid 81 and name hb ) 4.10 1.80 1.90
assign ( resid 82 and name ha ) ( resid 82 and name hb1 ) 4.10 1.80 1.90
assign ( resid 82 and name ha ) ( resid 82 and name hb2 ) 4.10 1.80 1.90
assign ( resid 83 and name ha ) ( resid 83 and name hb ) 2.30 0.50 0.50
assign ( resid 84 and name ha1 ) ( resid 84 and name ha2 ) 2.30 0.53 0.50
assign ( resid 85 and name ha ) ( resid 85 and name hb ) 4.10 1.80 1.90
assign ( resid 87 and name ha ) ( resid 87 and name hb1 ) 2.70 0.90 0.90
assign ( resid 87 and name ha ) ( resid 87 and name hb2 ) 2.70 0.90 0.90
assign ( resid 88 and name ha ) ( resid 88 and name hb1 ) 2.70 0.90 0.90
assign ( resid 88 and name ha ) ( resid 88 and name hb2 ) 2.70 0.90 0.90
assign ( resid 89 and name ha ) ( resid 89 and name hb* ) 2.30 0.50 1.00
assign ( resid 91 and name ha ) ( resid 91 and name hb1 ) 4.10 1.80 1.90
assign ( resid 91 and name ha ) ( resid 91 and name hb2 ) 4.10 1.80 1.90
assign ( resid 92 and name ha ) ( resid 92 and name hb* ) 2.30 0.50 1.00
assign ( resid 93 and name ha ) ( resid 93 and name hb* ) 2.70 0.90 1.40
assign ( resid 94 and name ha ) ( resid 94 and name hb1 ) 4.10 1.80 1.90
assign ( resid 94 and name ha ) ( resid 94 and name hb2 ) 4.10 1.80 1.90
assign ( resid 95 and name ha ) ( resid 95 and name hb* ) 3.40 1.60 2.10
assign ( resid 96 and name ha ) ( resid 96 and name hb* ) 2.30 0.50 1.00
assign ( resid 97 and name ha ) ( resid 97 and name hb1 ) 4.10 1.80 1.90
assign ( resid 97 and name ha ) ( resid 97 and name hb2 ) 4.10 1.80 1.90
assign ( resid 98 and name ha ) ( resid 98 and name hb* ) 4.10 1.80 2.40
assign ( resid 99 and name ha ) ( resid 99 and name hb1 ) 4.10 1.80 1.90
assign ( resid 99 and name ha ) ( resid 99 and name hb2 ) 4.10 1.80 1.90
assign ( resid 101 and name ha ) ( resid 101 and name hb* ) 2.70 0.90 1.40
assign ( resid 102 and name ha ) ( resid 102 and name hb ) 3.40 1.60 1.60
assign ( resid 103 and name ha ) ( resid 103 and name hb1 ) 2.70 0.90 0.90
assign ( resid 103 and name ha ) ( resid 103 and name hb2 ) 2.70 0.90 0.90
assign ( resid 104 and name ha ) ( resid 104 and name hb* ) 2.30 0.50 1.00
assign ( resid 105 and name hha ) ( resid 105 and name haa1 ) 2.70 0.90 0.90
assign ( resid 105 and name hha ) ( resid 105 and name haa2 ) 2.70 0.90 0.90
assign ( resid 105 and name hha ) ( resid 105 and name hba1 ) 3.40 1.60 1.60
assign ( resid 105 and name hha ) ( resid 105 and name hba2 ) 3.40 1.60 1.60
assign ( resid 105 and name hha ) ( resid 105 and name had1 ) 3.40 1.60 1.60
assign ( resid 105 and name hha ) ( resid 105 and name hbd2 ) 3.40 1.60 1.60
assign ( resid 105 and name hhb ) ( resid 105 and name hma* ) 2.30 0.50 1.00
assign ( resid 105 and name hhb ) ( resid 105 and name hmb* ) 2.30 0.50 1.00
assign ( resid 105 and name hhb ) ( resid 105 and name hbb* ) 4.10 1.80 2.40
assign ( resid 105 and name hhc ) ( resid 105 and name hab ) 2.30 0.50 0.50
assign ( resid 105 and name hhc ) ( resid 105 and name hbb* ) 3.40 1.60 2.10
assign ( resid 105 and name hhc ) ( resid 105 and name hmc* ) 2.30 0.50 1.00
assign ( resid 105 and name hhc ) ( resid 105 and name hbc* ) 4.10 1.80 2.40
assign ( resid 105 and name hhd ) ( resid 105 and name hmd* ) 2.30 0.50 1.00
assign ( resid 105 and name hhd ) ( resid 105 and name hmc* ) 3.40 1.60 2.10
assign ( resid 105 and name hhd ) ( resid 105 and name hac ) 2.30 0.50 0.50
assign ( resid 105 and name hhd ) ( resid 105 and name hbc* ) 3.40 1.60 2.10
assign ( resid 105 and name hab ) ( resid 105 and name hbb* ) 3.40 1.60 2.10
assign ( resid 105 and name hab ) ( resid 105 and name hmc* ) 3.40 1.60 1.60
assign ( resid 105 and name hac ) ( resid 105 and name hbc* ) 2.30 0.50 1.00
assign ( resid 105 and name hac ) ( resid 105 and name hmc* ) 4.10 1.80 2.40
assign ( resid 105 and name hac ) ( resid 105 and name hmd* ) 3.40 1.60 1.60
assign ( resid 2 and name hn ) ( resid 1 and name ha1 ) 3.40 1.60 1.60
assign ( resid 2 and name hn ) ( resid 1 and name ha2 ) 3.40 1.60 1.60
assign ( resid 2 and name hn ) ( resid 5 and name hg1 ) 4.10 1.80 2.40
assign ( resid 2 and name ha ) ( resid 1 and name ha1 ) 4.10 1.80 1.90
assign ( resid 2 and name ha ) ( resid 1 and name ha2 ) 4.10 1.80 1.90
assign ( resid 3 and name hn ) ( resid 2 and name hb1 ) 4.10 1.80 1.90
assign ( resid 3 and name hn ) ( resid 2 and name hb2 ) 4.10 1.80 1.90
assign ( resid 3 and name hn ) ( resid 6 and name hn ) 4.10 1.80 1.90
assign ( resid 4 and name hn ) ( resid 3 and name hg* ) 2.30 0.50 1.70
assign ( resid 4 and name hn ) ( resid 2 and name ha ) 4.10 1.80 1.90
assign ( resid 4 and name ha ) ( resid 7 and name hb1 ) 4.10 1.80 1.90
assign ( resid 4 and name ha ) ( resid 7 and name hb2 ) 3.40 1.60 1.60
assign ( resid 5 and name hn ) ( resid 2 and name ha ) 4.10 1.80 1.90
assign ( resid 5 and name hn ) ( resid 2 and name hb1 ) 4.10 1.80 1.90
assign ( resid 6 and name hn ) ( resid 2 and name hb1 ) 4.10 1.80 1.90
assign ( resid 6 and name hn ) ( resid 2 and name hb2 ) 4.10 1.80 1.90
assign ( resid 6 and name hn ) ( resid 3 and name ha ) 3.40 1.60 1.60
assign ( resid 6 and name hn ) ( resid 8 and name hn ) 4.10 1.80 1.90
assign ( resid 7 and name hn ) ( resid 3 and name ha ) 3.40 1.60 1.60
assign ( resid 7 and name hn ) ( resid 3 and name hg* ) 3.40 1.60 2.80
assign ( resid 8 and name hn ) ( resid 10 and name hn ) 3.40 1.60 1.60
assign ( resid 9 and name hn ) ( resid 11 and name hn ) 4.10 1.80 1.90
assign ( resid 9 and name hn ) ( resid 6 and name ha1 ) 4.10 1.80 1.90
assign ( resid 10 and name hn ) ( resid 9 and name hb ) 2.30 0.50 0.50
assign ( resid 10 and name hn ) ( resid 9 and name hg2* ) 3.40 1.60 2.10
assign ( resid 10 and name hn ) ( resid 7 and name ha ) 3.40 1.60 1.60
assign ( resid 10 and name hn ) ( resid 12 and name hn ) 4.10 1.80 1.90
assign ( resid 10 and name hn ) ( resid 13 and name hn ) 3.40 1.60 1.60
assign ( resid 10 and name hz ) ( resid 14 and name hn ) 4.10 1.80 1.90
assign ( resid 10 and name hz ) ( resid 14 and name hb1 ) 4.10 1.80 1.90
assign ( resid 10 and name hz ) ( resid 14 and name hb2 ) 4.10 1.80 1.90
assign ( resid 11 and name hn ) ( resid 9 and name hn ) 4.10 1.80 1.90
assign ( resid 11 and name hn ) ( resid 7 and name ha ) 4.10 1.80 1.90
assign ( resid 11 and name hn ) ( resid 8 and name ha ) 3.40 1.60 1.60
assign ( resid 11 and name hn ) ( resid 8 and name hn ) 4.10 1.80 1.90
assign ( resid 11 and name hn ) ( resid 13 and name hn ) 4.10 1.80 1.90
assign ( resid 11 and name hn ) ( resid 15 and name hn ) 4.10 1.80 1.90
assign ( resid 11 and name hn ) ( resid 10 and name hb1 ) 2.70 0.90 0.90
assign ( resid 11 and name hn ) ( resid 10 and name hb2 ) 3.40 1.60 1.60
assign ( resid 11 and name hn ) ( resid 10 and name hd* ) 4.10 1.80 2.40
assign ( resid 12 and name hn ) ( resid 8 and name hn ) 4.10 1.80 1.90
assign ( resid 12 and name hn ) ( resid 8 and name ha ) 4.10 1.80 1.90
assign ( resid 12 and name hn ) ( resid 9 and name ha ) 3.40 1.60 1.60
assign ( resid 12 and name hn ) ( resid 11 and name hb ) 2.70 0.90 0.90 
assign ( resid 12 and name hn ) ( resid 11 and name hg2* ) 3.40 1.60 2.10
assign ( resid 12 and name hn ) ( resid 15 and name hn ) 4.10 1.80 1.90
assign ( resid 13 and name hn ) ( resid 10 and name ha ) 4.10 1.80 1.90
assign ( resid 13 and name ha ) ( resid 12 and name hg1 ) 4.10 1.80 1.90 
assign ( resid 14 and name hn ) ( resid 13 and name hb1 ) 3.40 1.60 1.60 
assign ( resid 14 and name ha ) ( resid 13 and name ha ) 4.10 1.80 1.90
assign ( resid 14 and name ha ) ( resid 13 and name hb2 ) 4.10 1.80 1.90
assign ( resid 14 and name ha ) ( resid 16 and name hg1 ) 4.10 1.80 2.40
assign ( resid 14 and name ha ) ( resid 18 and name hb1 ) 4.10 1.80 2.40
assign ( resid 14 and name ha ) ( resid 18 and name hd2 ) 4.10 1.80 1.90
assign ( resid 15 and name hn ) ( resid 11 and name ha ) 3.40 1.60 1.60 
assign ( resid 15 and name hn ) ( resid 13 and name hn ) 4.10 1.80 1.90 
assign ( resid 15 and name hn ) ( resid 14 and name hb1 ) 3.40 1.60 1.60 
assign ( resid 15 and name hn ) ( resid 14 and name hb2 ) 3.40 1.60 1.60 
assign ( resid 16 and name hn ) ( resid 14 and name hn ) 4.10 1.80 1.90
assign ( resid 16 and name hn ) ( resid 18 and name hn ) 4.10 1.80 1.90
assign ( resid 17 and name hn ) ( resid 16 and name hb1 ) 3.40 1.60 1.60 
assign ( resid 17 and name hn ) ( resid 14 and name ha ) 4.10 1.80 1.90 
assign ( resid 17 and name hn ) ( resid 15 and name ha ) 3.40 1.60 1.60
assign ( resid 17 and name hn ) ( resid 18 and name ha ) 4.10 1.80 1.90 
assign ( resid 17 and name hn ) ( resid 18 and name hd2 ) 4.10 1.80 1.90
assign ( resid 17 and name hn ) ( resid 19 and name hg2* ) 4.10 1.80 2.40
assign ( resid 17 and name hb1 ) ( resid 18 and name hd2 ) 4.10 1.80 1.90
assign ( resid 18 and name hn ) ( resid 15 and name hn ) 4.10 1.80 1.90 
assign ( resid 18 and name hn ) ( resid 15 and name ha ) 3.40 1.60 1.60
assign ( resid 18 and name hn ) ( resid 16 and name hn ) 4.10 1.80 1.90 
assign ( resid 18 and name hn ) ( resid 16 and name ha ) 4.10 1.80 1.90 
assign ( resid 18 and name hn ) ( resid 17 and name hb1 ) 4.10 1.80 1.90 
assign ( resid 18 and name hn ) ( resid 17 and name hb2 ) 4.10 1.80 1.90 
assign ( resid 18 and name hd1 ) ( resid 19 and name hn ) 4.10 1.80 1.90
assign ( resid 18 and name hd1 ) ( resid 20 and name hg1* ) 4.10 1.80 2.40
assign ( resid 18 and name hd2 ) ( resid 14 and name ha ) 3.40 1.60 1.60 
assign ( resid 18 and name hd2 ) ( resid 14 and name hb1 ) 3.40 1.60 1.60 
assign ( resid 18 and name hd2 ) ( resid 14 and name hb2 ) 3.40 1.60 1.60 
assign ( resid 19 and name hn ) ( resid 16 and name hn ) 4.10 1.80 1.90
assign ( resid 19 and name hn ) ( resid 18 and name hb1 ) 4.10 1.80 1.90
assign ( resid 19 and name hn ) ( resid 18 and name hb2 ) 4.10 1.80 1.90
assign ( resid 19 and name hn ) ( resid 20 and name hg1* ) 4.10 1.80 2.40
assign ( resid 20 and name hn ) ( resid 19 and name hg2* ) 3.40 1.60 2.10 
assign ( resid 20 and name hg1* ) ( resid 21 and name hg* ) 4.10 1.80 2.90
assign ( resid 20 and name hg2* ) ( resid 21 and name hg* ) 4.10 1.80 2.90
assign ( resid 22 and name hn ) ( resid 20 and name hg2* ) 4.10 1.80 3.10 
assign ( resid 22 and name hn ) ( resid 21 and name hg* ) 3.40 1.60 2.10 
assign ( resid 22 and name hn ) ( resid 25 and name hn ) 3.40 1.60 1.60
assign ( resid 23 and name hn ) ( resid 25 and name hn ) 4.10 1.80 1.90 
assign ( resid 24 and name hn ) ( resid 21 and name ha ) 4.10 1.80 1.90
assign ( resid 26 and name hd2 ) ( resid 30 and name ha ) 4.10 1.80 1.90
assign ( resid 26 and name hd2 ) ( resid 30 and name hb1 ) 4.10 1.80 1.90
assign ( resid 26 and name hd2 ) ( resid 30 and name hb2 ) 4.10 1.80 1.90
assign ( resid 27 and name hn ) ( resid 26 and name hb1 ) 3.40 1.60 1.60
assign ( resid 27 and name hn ) ( resid 26 and name hb2 ) 4.10 1.80 1.90
assign ( resid 27 and name hn ) ( resid 31 and name hn ) 4.10 1.80 1.90
assign ( resid 29 and name hn ) ( resid 30 and name hd1 ) 4.10 1.80 1.90
assign ( resid 29 and name hn ) ( resid 30 and name hd2 ) 4.10 1.80 1.90
assign ( resid 29 and name hn ) ( resid 28 and name hb ) 2.70 0.90 0.90
assign ( resid 29 and name hn ) ( resid 28 and name hg2* ) 4.10 1.80 2.40
assign ( resid 29 and name ha1 ) ( resid 30 and name hd1 ) 4.10 1.80 1.90 
assign ( resid 29 and name ha1 ) ( resid 30 and name hd2 ) 4.10 1.80 1.90 
assign ( resid 29 and name ha2 ) ( resid 30 and name hd1 ) 4.10 1.80 1.90 
assign ( resid 29 and name ha2 ) ( resid 30 and name hd2 ) 4.10 1.80 1.90 
assign ( resid 29 and name ha2 ) ( resid 32 and name hd1* ) 4.10 1.80 3.10 
assign ( resid 29 and name ha2 ) ( resid 32 and name hd2* ) 4.10 1.80 3.10 
assign ( resid 31 and name hn ) ( resid 30 and name hb1 ) 4.10 1.80 1.90
assign ( resid 31 and name hn ) ( resid 30 and name hb2 ) 4.10 1.80 1.90
assign ( resid 31 and name hd21 ) ( resid 32 and name hn ) 4.10 1.80 2.40
assign ( resid 31 and name hd21 ) ( resid 32 and name hb1 ) 4.10 1.80 2.40
assign ( resid 31 and name hd21 ) ( resid 32 and name hb2 ) 4.10 1.80 2.40
assign ( resid 31 and name hd22 ) ( resid 33 and name hb* ) 3.40 1.60 2.10
assign ( resid 32 and name hd2* ) ( resid 30 and name hd1 ) 4.10 1.80 3.10
assign ( resid 32 and name hd2* ) ( resid 35 and name ha ) 4.10 1.80 3.10
assign ( resid 32 and name hd2* ) ( resid 35 and name hb1 ) 4.10 1.80 3.10
assign ( resid 32 and name hd2* ) ( resid 35 and name hb2 ) 4.10 1.80 3.10
assign ( resid 32 and name hd2* ) ( resid 35 and name hd* ) 2.70 0.90 3.30
assign ( resid 32 and name hd1* ) ( resid 35 and name ha ) 4.10 1.80 3.10
assign ( resid 32 and name hd1* ) ( resid 35 and name hd* ) 2.70 0.90 3.30
assign ( resid 32 and name hd1* ) ( resid 30 and name hd1 ) 4.10 1.80 3.10
assign ( resid 32 and name hd1* ) ( resid 30 and name hb2 ) 3.40 1.60 2.80
assign ( resid 33 and name hn ) ( resid 32 and name hb1 ) 4.10 1.80 1.90 
assign ( resid 33 and name hn ) ( resid 32 and name hb2 ) 3.40 1.60 1.60
assign ( resid 33 and name hn ) ( resid 32 and name hg ) 4.10 1.80 1.90 
assign ( resid 33 and name hn ) ( resid 32 and name hd1* ) 4.10 1.80 3.10
assign ( resid 33 and name hn ) ( resid 32 and name hd2* ) 4.10 1.80 3.10
assign ( resid 34 and name hn ) ( resid 32 and name ha ) 4.10 1.80 1.90
assign ( resid 35 and name hn ) ( resid 32 and name hd1* ) 4.10 1.80 3.10
assign ( resid 35 and name hn ) ( resid 32 and name hd2* ) 4.10 1.80 3.10
assign ( resid 36 and name hn ) ( resid 35 and name hb1 ) 4.10 1.80 1.90 
assign ( resid 36 and name hn ) ( resid 35 and name hb2 ) 4.10 1.80 1.90 
assign ( resid 36 and name hn ) ( resid 38 and name hn ) 4.10 1.80 1.90
assign ( resid 36 and name hd* ) ( resid 35 and name ha ) 4.10 1.80 2.90
assign ( resid 36 and name he* ) ( resid 32 and name hd2* ) 4.10 1.80 4.10
assign ( resid 37 and name hn ) ( resid 36 and name hb1 ) 3.40 1.60 1.60 
assign ( resid 37 and name hn ) ( resid 36 and name hb2 ) 4.10 1.80 1.90
assign ( resid 37 and name hn ) ( resid 36 and name hd* ) 3.40 1.60 2.60
assign ( resid 37 and name hn ) ( resid 36 and name he* ) 4.10 1.80 2.90
assign ( resid 38 and name hh* ) ( resid 40 and name hn ) 3.40 1.60 2.10 
assign ( resid 38 and name hh* ) ( resid 42 and name hn ) 3.40 1.60 2.10 
assign ( resid 38 and name hh* ) ( resid 42 and name he21 ) 4.10 1.80 2.40
assign ( resid 38 and name hh* ) ( resid 35 and name hb1 ) 4.10 1.80 2.40
assign ( resid 39 and name hn ) ( resid 38 and name hb1 ) 3.40 1.60 1.60 
assign ( resid 39 and name hn ) ( resid 38 and name hb2 ) 3.40 1.60 1.60 
assign ( resid 39 and name hn ) ( resid 37 and name ha2 ) 4.10 1.80 2.40 
assign ( resid 39 and name ha ) ( resid 40 and name hg2* ) 4.10 1.80 2.40
assign ( resid 40 and name hn ) ( resid 39 and name hb2 ) 2.70 0.90 0.90
assign ( resid 40 and name hn ) ( resid 39 and name hg* ) 2.70 0.90 1.40 
assign ( resid 41 and name hn ) ( resid 40 and name hg2* ) 4.10 1.80 2.40 
assign ( resid 42 and name he21 ) ( resid 41 and name ha2 ) 4.10 1.80 2.40
assign ( resid 42 and name he21 ) ( resid 40 and name ha ) 4.10 1.80 2.40
assign ( resid 42 and name he21 ) ( resid 40 and name hg2* ) 4.10 1.80 2.90
assign ( resid 42 and name he22 ) ( resid 41 and name hn ) 4.10 1.80 2.40
assign ( resid 42 and name he22 ) ( resid 41 and name ha1 ) 3.40 1.60 2.10
assign ( resid 42 and name he22 ) ( resid 41 and name ha2 ) 3.40 1.60 2.10
assign ( resid 43 and name hn ) ( resid 42 and name hb1 ) 3.40 1.60 1.60 
assign ( resid 43 and name hn ) ( resid 42 and name hb2 ) 4.10 1.80 1.90 
assign ( resid 43 and name hn ) ( resid 42 and name hg* ) 4.10 1.80 2.40 
assign ( resid 43 and name ha ) ( resid 44 and name ha ) 4.10 1.80 1.90 
assign ( resid 43 and name ha ) ( resid 44 and name hg1 ) 4.10 1.80 1.90 
assign ( resid 43 and name ha ) ( resid 44 and name hg2 ) 4.10 1.80 1.90 
assign ( resid 43 and name ha ) ( resid 44 and name hd1 ) 2.30 0.50 0.50 
assign ( resid 43 and name ha ) ( resid 44 and name hd2 ) 2.30 0.50 0.50 
assign ( resid 46 and name hn ) ( resid 48 and name hn ) 4.10 1.80 1.90
assign ( resid 46 and name hd2 ) ( resid 43 and name hb* ) 4.10 1.80 2.90
assign ( resid 46 and name hd2 ) ( resid 48 and name hn ) 4.10 1.80 2.90
assign ( resid 46 and name hd2 ) ( resid 48 and name ha ) 4.10 1.80 2.90
assign ( resid 46 and name hd2 ) ( resid 48 and name hd1 ) 4.10 1.80 2.90
assign ( resid 46 and name hd2 ) ( resid 48 and name hd2 ) 4.10 1.80 2.90
assign ( resid 46 and name hd2 ) ( resid 48 and name he1 ) 4.10 1.80 2.90
assign ( resid 46 and name hd2 ) ( resid 48 and name he2 ) 4.10 1.80 2.90
assign ( resid 46 and name hd1 ) ( resid 43 and name hb* ) 4.10 1.80 2.90
assign ( resid 46 and name hd1 ) ( resid 48 and name ha ) 4.10 1.80 2.90
assign ( resid 46 and name hd1 ) ( resid 48 and name hd1 ) 4.10 1.80 2.90
assign ( resid 46 and name hd1 ) ( resid 48 and name hd2 ) 4.10 1.80 2.90
assign ( resid 46 and name hd1 ) ( resid 48 and name he1 ) 4.10 1.80 2.90
assign ( resid 46 and name he2 ) ( resid 49 and name hn ) 4.10 1.80 2.90
assign ( resid 46 and name he2 ) ( resid 48 and name ha )  3.40 1.60 2.60
assign ( resid 46 and name he2 ) ( resid 48 and name hb1 ) 4.10 1.80 2.90
assign ( resid 46 and name he2 ) ( resid 48 and name hb2 ) 4.10 1.80 2.90
assign ( resid 46 and name he2 ) ( resid 48 and name hd2 ) 4.10 1.80 2.90
assign ( resid 46 and name hd2 ) ( resid 48 and name ha ) 3.40 1.60 2.60
assign ( resid 48 and name hn ) ( resid 47 and name hb1 ) 3.40 1.60 1.60 
assign ( resid 48 and name hd2 ) ( resid 49 and name hn ) 4.10 1.80 2.90
assign ( resid 48 and name hd2 ) ( resid 50 and name ha ) 4.10 1.80 2.90
assign ( resid 48 and name hd2 ) ( resid 52 and name hb1 ) 4.10 1.80 2.90
assign ( resid 48 and name hd2 ) ( resid 52 and name hb2 ) 4.10 1.80 2.90
assign ( resid 48 and name hd1 ) ( resid 49 and name hn ) 4.10 1.80 2.90
assign ( resid 48 and name he1 ) ( resid 46 and name ha ) 4.10 1.80 2.90
assign ( resid 48 and name he1 ) ( resid 46 and name hb1 ) 4.10 1.80 2.90
assign ( resid 48 and name ha ) ( resid 47 and name ha ) 4.10 1.80 1.90
assign ( resid 49 and name hn ) ( resid 48 and name hb1 ) 4.10 1.80 1.90
assign ( resid 49 and name hn ) ( resid 48 and name hb2 ) 3.40 1.60 1.60 
assign ( resid 49 and name hn ) ( resid 52 and name hb1 ) 4.10 1.80 1.90
assign ( resid 49 and name hn ) ( resid 52 and name hb2 ) 4.10 1.80 1.90
assign ( resid 49 and name hn ) ( resid 52 and name hn ) 4.10 1.80 1.90
assign ( resid 49 and name hb ) ( resid 51 and name hb* ) 3.40 1.60 2.10
assign ( resid 49 and name hb ) ( resid 51 and name hn ) 3.40 1.60 1.60
assign ( resid 50 and name hn ) ( resid 48 and name ha ) 4.10 1.80 1.90
assign ( resid 50 and name hn ) ( resid 48 and name hd1 ) 4.10 1.80 2.90
assign ( resid 50 and name hn ) ( resid 48 and name hd2 ) 4.10 1.80 2.90
assign ( resid 50 and name hn ) ( resid 52 and name hn ) 3.40 1.60 1.60
assign ( resid 51 and name hn ) ( resid 49 and name hn ) 4.10 1.80 1.90
assign ( resid 51 and name hn ) ( resid 49 and name ha ) 2.70 0.90 0.90
assign ( resid 51 and name hn ) ( resid 49 and name hg2* ) 3.40 1.60 2.10
assign ( resid 51 and name hn ) ( resid 50 and name hb* ) 2.30 0.50 1.00
assign ( resid 52 and name hn ) ( resid 51 and name hb* ) 2.30 0.50 1.00 
assign ( resid 53 and name hn ) ( resid 50 and name ha ) 2.70 0.90 0.90 
assign ( resid 53 and name hn ) ( resid 50 and name hb* ) 4.10 1.80 2.40
assign ( resid 53 and name hn ) ( resid 51 and name ha ) 4.10 1.80 1.90
assign ( resid 53 and name hn ) ( resid 51 and name hb* ) 4.10 1.80 2.40
assign ( resid 53 and name hn ) ( resid 52 and name hb1 ) 3.40 1.60 1.60 
assign ( resid 53 and name hn ) ( resid 52 and name hb2 ) 2.70 0.90 0.90
assign ( resid 54 and name hn ) ( resid 51 and name ha ) 3.40 1.60 1.60 
assign ( resid 54 and name hn ) ( resid 53 and name hb* ) 2.30 0.50 1.00 
assign ( resid 54 and name hd21 ) ( resid 51 and name hb* ) 4.10 1.80 2.40
assign ( resid 55 and name hn ) ( resid 51 and name hb* ) 4.10 1.80 2.40 
assign ( resid 55 and name hn ) ( resid 52 and name ha ) 2.70 0.90 0.90 
assign ( resid 55 and name hn ) ( resid 53 and name ha ) 4.10 1.80 1.90
assign ( resid 56 and name hn ) ( resid 54 and name hn ) 4.10 1.80 1.90 
assign ( resid 56 and name hn ) ( resid 55 and name hb2 ) 3.40 1.60 1.60 
assign ( resid 57 and name hn ) ( resid 54 and name ha ) 4.10 1.80 1.90 
assign ( resid 57 and name hn ) ( resid 55 and name ha ) 4.10 1.80 1.90
assign ( resid 57 and name hn ) ( resid 55 and name hb2 ) 4.10 1.80 1.90
assign ( resid 57 and name hg11 ) ( resid 59 and name hz2 ) 4.10 1.80 1.90 
assign ( resid 57 and name hd* ) ( resid 59 and name ha ) 3.40 1.60 2.10
assign ( resid 57 and name hd* ) ( resid 59 and name hb1 ) 4.10 1.80 2.40
assign ( resid 57 and name hd* ) ( resid 59 and name hb2 ) 4.10 1.80 2.40
assign ( resid 57 and name hd* ) ( resid 59 and name hz2 ) 4.10 1.80 2.40
assign ( resid 57 and name hd* ) ( resid 59 and name hz3 ) 4.10 1.80 2.40
assign ( resid 57 and name hd* ) ( resid 59 and name hh2 ) 4.10 1.80 2.40
assign ( resid 57 and name hd* ) ( resid 59 and name he3 ) 3.40 1.60 2.10
assign ( resid 58 and name hn ) ( resid 57 and name hg11 ) 4.10 1.80 1.90
assign ( resid 58 and name hn ) ( resid 57 and name hd* ) 3.40 1.60 2.10 
assign ( resid 58 and name hd* ) ( resid 57 and name hd* ) 3.40 1.60 2.60 
assign ( resid 59 and name hn ) ( resid 57 and name hd* ) 3.40 1.60 2.10 
assign ( resid 59 and name hn ) ( resid 58 and name hg* ) 4.10 1.80 2.40 
assign ( resid 59 and name he3 ) ( resid 60 and name hn ) 2.70 0.90 0.90 
assign ( resid 59 and name he3 ) ( resid 63 and name hn ) 4.10 1.80 1.90 
assign ( resid 59 and name he3 ) ( resid 63 and name ha ) 4.10 1.80 1.90 
assign ( resid 59 and name he3 ) ( resid 63 and name hb ) 3.40 1.60 1.60 
assign ( resid 59 and name he3 ) ( resid 63 and name hg2* ) 4.10 1.80 2.40 
assign ( resid 59 and name he3 ) ( resid 57 and name hg2* ) 3.40 1.60 2.10 
assign ( resid 60 and name hn ) ( resid 59 and name hb1 ) 3.40 1.60 1.60 
assign ( resid 60 and name hn ) ( resid 59 and name hb2 ) 3.40 1.60 1.60 
assign ( resid 60 and name hn ) ( resid 59 and name he3 ) 2.70 0.90 0.90 
assign ( resid 60 and name hn ) ( resid 59 and name hz3 ) 4.10 1.80 1.90 
assign ( resid 60 and name hn ) ( resid 57 and name hd* ) 4.10 1.80 2.40 
assign ( resid 60 and name hn ) ( resid 57 and name hg2* ) 4.10 1.80 2.40 
assign ( resid 60 and name hn ) ( resid 58 and name hg1* ) 4.10 1.80 2.40 
assign ( resid 60 and name hn ) ( resid 63 and name hg2* ) 3.40 1.60 2.10 
assign ( resid 61 and name hn ) ( resid 63 and name hn ) 4.10 1.80 1.90 
assign ( resid 61 and name hn ) ( resid 64 and name hd1* ) 4.10 1.80 3.10 
assign ( resid 62 and name hn ) ( resid 64 and name hn ) 4.10 1.80 1.90 
assign ( resid 62 and name hn ) ( resid 65 and name hn ) 4.10 1.80 1.90
assign ( resid 62 and name hn ) ( resid 61 and name hb* ) 2.30 0.50 1.00 
assign ( resid 62 and name hn ) ( resid 61 and name hg* ) 4.10 1.80 2.40 
assign ( resid 62 and name hn ) ( resid 63 and name hg2* ) 4.10 1.80 2.40
assign ( resid 63 and name hn ) ( resid 60 and name hn ) 3.40 1.60 1.60 
assign ( resid 63 and name hn ) ( resid 66 and name hn ) 4.10 1.80 1.90
assign ( resid 63 and name hn ) ( resid 59 and name ha ) 4.10 1.80 1.90 
assign ( resid 63 and name hn ) ( resid 62 and name hb* ) 2.70 0.90 1.40 
assign ( resid 63 and name hn ) ( resid 61 and name hg* ) 4.10 1.80 2.40
assign ( resid 64 and name hn ) ( resid 60 and name hn ) 3.40 1.60 1.60 
assign ( resid 64 and name hn ) ( resid 66 and name hn ) 4.10 1.80 1.90 
assign ( resid 64 and name hd1* ) ( resid 61 and name ha ) 4.10 1.80 3.10
assign ( resid 64 and name hd1* ) ( resid 68 and name hd1* ) 2.30 0.50 2.90
assign ( resid 65 and name hn ) ( resid 62 and name hn ) 4.10 1.80 1.90 
assign ( resid 65 and name hn ) ( resid 62 and name ha ) 4.10 1.80 1.90
assign ( resid 65 and name hn ) ( resid 63 and name ha ) 4.10 1.80 1.90
assign ( resid 65 and name hn ) ( resid 64 and name hd1* ) 4.10 1.80 3.10
assign ( resid 66 and name hn ) ( resid 62 and name ha ) 4.10 1.80 1.90 
assign ( resid 66 and name hn ) ( resid 63 and name hb ) 4.10 1.80 1.90 
assign ( resid 66 and name hn ) ( resid 63 and name ha ) 3.40 1.60 1.60 
assign ( resid 66 and name hn ) ( resid 65 and name hb1 ) 2.70 0.90 0.90 
assign ( resid 66 and name hn ) ( resid 65 and name hb2 ) 3.40 1.60 1.60 
assign ( resid 66 and name hn ) ( resid 67 and name hb2 ) 4.10 1.80 1.90 
assign ( resid 67 and name hn ) ( resid 63 and name ha ) 4.10 1.80 1.90 
assign ( resid 67 and name hn ) ( resid 64 and name hn ) 4.10 1.80 1.90 
assign ( resid 67 and name hn ) ( resid 64 and name ha ) 2.70 0.90 0.90 
assign ( resid 67 and name hn ) ( resid 64 and name hd2* ) 4.10 1.80 3.10 
assign ( resid 67 and name hn ) ( resid 66 and name hb1 ) 2.30 0.50 0.50 
assign ( resid 67 and name hn ) ( resid 66 and name hb2 ) 2.70 0.90 0.90 
assign ( resid 67 and name hn ) ( resid 66 and name hg1 ) 3.40 1.60 1.60 
assign ( resid 67 and name hn ) ( resid 66 and name hg2 ) 4.10 1.80 1.90 
assign ( resid 67 and name hd* ) ( resid 70 and name hn ) 4.10 1.80 2.90
assign ( resid 68 and name hn ) ( resid 65 and name hn ) 3.40 1.60 1.60 
assign ( resid 68 and name hn ) ( resid 67 and name hb1 ) 3.40 1.60 1.60 
assign ( resid 68 and name hn ) ( resid 67 and name hb2 ) 3.40 1.60 1.60 
assign ( resid 68 and name hn ) ( resid 67 and name hd* ) 4.10 1.80 2.90 
assign ( resid 68 and name hd1* ) ( resid 64 and name ha ) 4.10 1.80 3.10 
assign ( resid 69 and name hn ) ( resid 71 and name ha ) 4.10 1.80 1.90 
assign ( resid 70 and name hn ) ( resid 68 and name hn ) 4.10 1.80 1.90 
assign ( resid 70 and name hn ) ( resid 68 and name ha ) 2.70 0.90 0.90 
assign ( resid 70 and name hn ) ( resid 69 and name hb1 ) 3.40 1.60 1.60 
assign ( resid 70 and name hn ) ( resid 69 and name hb2 ) 2.70 0.90 0.90 
assign ( resid 70 and name hn ) ( resid 69 and name hg1 ) 4.10 1.80 1.90 
assign ( resid 70 and name hn ) ( resid 71 and name hg1 ) 4.10 1.80 1.90 
assign ( resid 70 and name hn ) ( resid 71 and name hg2 ) 4.10 1.80 1.90 
assign ( resid 70 and name hn ) ( resid 73 and name hg* ) 4.10 1.80 2.40 
assign ( resid 70 and name ha ) ( resid 71 and name hd1 ) 2.30 0.50 0.50 
assign ( resid 70 and name ha ) ( resid 71 and name hd2 ) 2.30 0.50 0.50 
assign ( resid 70 and name ha ) ( resid 71 and name hg1 ) 4.10 1.80 1.90 
assign ( resid 70 and name ha ) ( resid 71 and name hb1 ) 4.10 1.80 1.90
assign ( resid 72 and name hn ) ( resid 71 and name hd1 ) 3.40 1.60 1.60 
assign ( resid 72 and name hn ) ( resid 70 and name ha ) 4.10 1.80 1.90 
assign ( resid 72 and name hn ) ( resid 71 and name hb1 ) 3.40 1.60 1.60 
assign ( resid 72 and name hn ) ( resid 71 and name hb2 ) 2.70 0.90 0.90 
assign ( resid 72 and name hn ) ( resid 71 and name hg1 ) 4.10 1.80 1.90 
assign ( resid 73 and name hn ) ( resid 75 and name hn ) 4.10 1.80 1.90 
assign ( resid 73 and name hn ) ( resid 71 and name hd1 ) 3.40 1.60 1.60 
assign ( resid 73 and name hn ) ( resid 74 and name ha ) 4.10 1.80 1.90 
assign ( resid 74 and name hn ) ( resid 70 and name hn ) 4.10 1.80 1.90 
assign ( resid 74 and name hn ) ( resid 72 and name hn ) 3.40 1.60 1.60 
assign ( resid 74 and name hn ) ( resid 72 and name ha ) 4.10 1.80 1.90 
assign ( resid 74 and name hn ) ( resid 71 and name ha ) 3.40 1.60 1.60 
assign ( resid 74 and name hn ) ( resid 73 and name hb* ) 2.70 0.90 1.40 
assign ( resid 74 and name hn ) ( resid 73 and name hg* ) 4.10 1.80 1.90 
assign ( resid 74 and name hn ) ( resid 75 and name hd* ) 4.10 1.80 2.40 
assign ( resid 75 and name hn ) ( resid 72 and name ha ) 4.10 1.80 1.90 
assign ( resid 75 and name hn ) ( resid 74 and name hb2 ) 4.10 1.80 1.90 
assign ( resid 75 and name ha ) ( resid 76 and name hd1 ) 2.70 0.90 0.90 
assign ( resid 75 and name ha ) ( resid 76 and name hd2 ) 2.70 0.90 0.90 
assign ( resid 77 and name hn ) ( resid 76 and name hb1 ) 4.10 1.80 1.90 
assign ( resid 77 and name hn ) ( resid 76 and name hb2 ) 3.40 1.60 1.60 
assign ( resid 78 and name hn ) ( resid 75 and name hg2* ) 3.40 1.60 2.10 
assign ( resid 78 and name hn ) ( resid 75 and name hd* ) 4.10 1.80 2.40 
assign ( resid 79 and name hn ) ( resid 78 and name hb ) 3.40 1.60 1.60 
assign ( resid 79 and name hn ) ( resid 78 and name hg2* ) 4.10 1.80 2.40 
assign ( resid 79 and name hn ) ( resid 80 and name hb1 ) 4.10 1.80 1.90 
assign ( resid 79 and name hn ) ( resid 80 and name hg1 ) 4.10 1.80 1.90 
assign ( resid 80 and name hn ) ( resid 78 and name hg2* ) 2.70 0.90 1.40
assign ( resid 80 and name hn ) ( resid 79 and name hb2 ) 4.10 1.80 1.90 
assign ( resid 80 and name hb1 ) ( resid 78 and name hg2* ) 3.40 1.60 2.10 
assign ( resid 80 and name hb2 ) ( resid 78 and name hg2* ) 4.10 1.80 2.40 
assign ( resid 80 and name hb2 ) ( resid 82 and name hb1 ) 4.10 1.80 2.40 
assign ( resid 80 and name hb2 ) ( resid 82 and name hb2 ) 4.10 1.80 2.40 
assign ( resid 80 and name hb2 ) ( resid 82 and name hd* ) 4.10 1.80 2.90 
assign ( resid 80 and name hg1 ) ( resid 78 and name hg2* ) 2.70 0.90 1.40 
assign ( resid 80 and name hg2 ) ( resid 78 and name hg2* ) 4.10 1.80 2.40 
assign ( resid 80 and name hg2 ) ( resid 82 and name hb1 ) 4.10 1.80 2.40 
assign ( resid 80 and name hg2 ) ( resid 82 and name hb2 ) 4.10 1.80 2.40 
assign ( resid 80 and name hg2 ) ( resid 82 and name hd* ) 4.10 1.80 2.90 
assign ( resid 80 and name he* ) ( resid 82 and name ha ) 4.10 1.80 2.40 
assign ( resid 80 and name he* ) ( resid 82 and name hb1 ) 3.40 1.60 2.10 
assign ( resid 80 and name he* ) ( resid 82 and name hb2 ) 3.40 1.60 2.10 
assign ( resid 80 and name he* ) ( resid 82 and name hd* ) 2.70 0.90 2.40 
assign ( resid 80 and name he* ) ( resid 82 and name he* ) 4.10 1.80 3.40 
assign ( resid 80 and name he* ) ( resid 82 and name hz ) 4.10 1.80 2.40 
assign ( resid 81 and name hn ) ( resid 80 and name hb1 ) 4.10 1.80 1.90 
assign ( resid 81 and name hn ) ( resid 80 and name hb2 ) 4.10 1.80 1.90 
assign ( resid 81 and name hn ) ( resid 80 and name hg1 ) 4.10 1.80 1.90 
assign ( resid 81 and name hn ) ( resid 80 and name hg2 ) 3.40 1.60 1.60 
assign ( resid 82 and name hn ) ( resid 80 and name hb2 ) 4.10 1.80 1.90
assign ( resid 82 and name hn ) ( resid 80 and name hg2 ) 4.10 1.80 1.90
assign ( resid 82 and name hn ) ( resid 80 and name he* ) 4.10 1.80 2.40
assign ( resid 82 and name hd* ) ( resid 81 and name hn ) 4.10 1.80 2.90
assign ( resid 82 and name hd* ) ( resid 83 and name ha ) 4.10 1.80 2.90
assign ( resid 82 and name hd* ) ( resid 83 and name hg* ) 2.70 0.90 3.10
assign ( resid 82 and name hd* ) ( resid 84 and name ha1 ) 4.10 1.80 2.90
assign ( resid 82 and name hd* ) ( resid 84 and name ha2 ) 4.10 1.80 2.90
assign ( resid 82 and name hd* ) ( resid 85 and name hg11 ) 4.10 1.80 2.90
assign ( resid 82 and name he* ) ( resid 85 and name hn ) 3.40 1.60 2.60 
assign ( resid 82 and name hz ) ( resid 85 and name hg11 ) 2.70 0.90 0.90 
assign ( resid 82 and name hb1 ) ( resid 80 and name hb1 ) 4.10 1.80 1.90
assign ( resid 83 and name hn ) ( resid 82 and name hb1 ) 4.10 1.80 1.90
assign ( resid 83 and name hn ) ( resid 82 and name hb2 ) 2.70 0.90 1.40
assign ( resid 85 and name hn ) ( resid 82 and name hd* ) 4.10 1.80 2.40
assign ( resid 85 and name hn ) ( resid 82 and name hz ) 4.10 1.80 1.90
assign ( resid 86 and name hn ) ( resid 85 and name hg11 ) 4.10 1.80 1.90
assign ( resid 86 and name hn ) ( resid 85 and name hg2* ) 3.40 1.60 2.10
assign ( resid 87 and name hn ) ( resid 90 and name hn ) 4.10 1.80 1.90
assign ( resid 87 and name hn ) ( resid 85 and name hg2* ) 2.30 0.50 1.00
assign ( resid 89 and name hn ) ( resid 91 and name hn ) 4.10 1.80 1.90
assign ( resid 89 and name hn ) ( resid 92 and name hn ) 4.10 1.80 1.90
assign ( resid 89 and name hn ) ( resid 88 and name hb1 ) 2.70 0.90 0.90
assign ( resid 89 and name hn ) ( resid 88 and name hb2 ) 3.40 1.60 1.60
assign ( resid 89 and name hn ) ( resid 88 and name hg1 ) 4.10 1.80 1.90
assign ( resid 89 and name hn ) ( resid 88 and name hg2 ) 4.10 1.80 1.90
assign ( resid 89 and name hn ) ( resid 87 and name hg1 ) 3.40 1.60 1.60
assign ( resid 90 and name hn ) ( resid 87 and name hb1 ) 3.40 1.60 1.60
assign ( resid 90 and name hn ) ( resid 87 and name hb2 ) 3.40 1.60 1.60
assign ( resid 90 and name hn ) ( resid 87 and name hg1 ) 4.10 1.80 1.90
assign ( resid 90 and name hn ) ( resid 87 and name hg2 ) 4.10 1.80 1.90
assign ( resid 90 and name hn ) ( resid 88 and name ha ) 4.10 1.80 1.90
assign ( resid 90 and name hn ) ( resid 92 and name hn ) 4.10 1.80 1.90
assign ( resid 91 and name hn ) ( resid 88 and name ha ) 3.40 1.60 1.60
assign ( resid 91 and name hn ) ( resid 89 and name ha ) 4.10 1.80 1.90
assign ( resid 91 and name hn ) ( resid 90 and name hb1 ) 3.40 1.60 1.60
assign ( resid 91 and name hn ) ( resid 90 and name hb2 ) 2.70 0.90 0.90
assign ( resid 91 and name hn ) ( resid 94 and name hn ) 4.10 1.80 1.90
assign ( resid 92 and name hn ) ( resid 88 and name ha ) 3.40 1.60 1.60
assign ( resid 93 and name hn ) ( resid 90 and name hn ) 4.10 1.80 1.90
assign ( resid 93 and name hn ) ( resid 91 and name hn ) 4.10 1.80 1.90
assign ( resid 93 and name hn ) ( resid 92 and name hb* ) 2.30 0.50 1.00
assign ( resid 94 and name hn ) ( resid 91 and name ha ) 2.70 0.90 0.90
assign ( resid 95 and name hn ) ( resid 92 and name ha ) 3.40 1.60 1.60
assign ( resid 95 and name hn ) ( resid 94 and name hb2 ) 2.70 0.90 0.90
assign ( resid 96 and name hn ) ( resid 95 and name hb ) 2.30 0.50 0.50
assign ( resid 96 and name hn ) ( resid 95 and name hg2* ) 3.40 1.60 1.60
assign ( resid 96 and name hn ) ( resid 95 and name hd* ) 3.40 1.60 1.60
assign ( resid 97 and name hn ) ( resid 96 and name hb* ) 2.30 0.50 1.00
assign ( resid 97 and name hn ) ( resid 95 and name hg2* ) 4.10 1.80 2.40
assign ( resid 97 and name hd1 ) ( resid 98 and name hn ) 3.40 1.60 2.60
assign ( resid 97 and name hd1 ) ( resid 98 and name ha ) 4.10 1.80 2.90
assign ( resid 97 and name hd1 ) ( resid 98 and name hg ) 3.40 1.60 2.60
assign ( resid 97 and name hd1 ) ( resid 98 and name hd1* ) 3.40 1.60 2.80
assign ( resid 97 and name hd1 ) ( resid 98 and name hd2* ) 2.70 0.90 2.10
assign ( resid 97 and name hd1 ) ( resid 99 and name hn ) 3.40 1.60 2.60
assign ( resid 97 and name hd2 ) ( resid 98 and name hn ) 4.10 1.80 2.90
assign ( resid 97 and name hd2 ) ( resid 98 and name ha ) 4.10 1.80 2.90
assign ( resid 97 and name hd2 ) ( resid 98 and name hd1* ) 4.10 1.80 3.10
assign ( resid 97 and name hd2 ) ( resid 98 and name hd2* ) 4.10 1.80 3.10
assign ( resid 97 and name hd2 ) ( resid 100 and name hb* ) 4.10 1.80 2.90 
assign ( resid 97 and name hd2 ) ( resid 100 and name he* ) 4.10 1.80 2.90
assign ( resid 97 and name hd2 ) ( resid 101 and name hb* ) 4.10 1.80 2.90
assign ( resid 97 and name he1 ) ( resid 101 and name hn ) 4.10 1.80 2.90
assign ( resid 97 and name he2 ) ( resid 98 and name ha ) 4.10 1.80 2.90
assign ( resid 97 and name he2 ) ( resid 98 and name hd1* ) 4.10 1.80 3.10
assign ( resid 97 and name he2 ) ( resid 98 and name hd2* ) 4.10 1.80 3.10
assign ( resid 97 and name he2 ) ( resid 100 and name he* ) 4.10 1.80 2.90
assign ( resid 97 and name he2 ) ( resid 101 and name ha ) 4.10 1.80 2.90
assign ( resid 97 and name he2 ) ( resid 101 and name hb* ) 4.10 1.80 2.90
assign ( resid 98 and name hn ) ( resid 95 and name ha ) 2.70 0.90 0.90
assign ( resid 98 and name hn ) ( resid 95 and name hg2* ) 4.10 1.80 2.40
assign ( resid 98 and name hn ) ( resid 95 and name hd* ) 4.10 1.80 2.40
assign ( resid 98 and name hn ) ( resid 97 and name hb1 ) 2.70 0.90 0.90
assign ( resid 98 and name hd1* ) ( resid 97 and name hn ) 4.10 1.80 3.10
assign ( resid 98 and name hd1* ) ( resid 97 and name hb1 ) 4.10 1.80 3.10
assign ( resid 98 and name hd1* ) ( resid 97 and name he1 ) 4.10 1.80 3.10
assign ( resid 99 and name hn ) ( resid 95 and name ha ) 3.40 1.60 1.60
assign ( resid 99 and name hn ) ( resid 95 and name hd* ) 4.00 1.70 3.00
assign ( resid 99 and name hn ) ( resid 97 and name hn ) 4.10 1.80 1.90
assign ( resid 99 and name hn ) ( resid 97 and name ha ) 4.10 1.80 1.90
assign ( resid 99 and name hn ) ( resid 97 and name hb1 ) 4.10 1.80 1.90
assign ( resid 99 and name hn ) ( resid 97 and name hd1 ) 3.40 1.60 2.60
assign ( resid 99 and name hn ) ( resid 96 and name ha ) 3.40 1.60 1.60
assign ( resid 99 and name hn ) ( resid 96 and name hb* ) 3.40 1.60 2.10
assign ( resid 99 and name hn ) ( resid 102 and name hn ) 4.10 1.80 1.90
assign ( resid 100 and name hn ) ( resid 97 and name ha ) 4.10 1.80 1.90
assign ( resid 100 and name hn ) ( resid 97 and name he2 ) 4.10 1.80 2.90
assign ( resid 100 and name hn ) ( resid 98 and name hn ) 4.10 1.80 1.90
assign ( resid 100 and name hn ) ( resid 98 and name hd1* ) 4.10 1.80 3.10
assign ( resid 100 and name hn ) ( resid 99 and name hb1 ) 3.40 1.60 1.60
assign ( resid 100 and name hn ) ( resid 99 and name hb2 ) 2.70 0.90 1.40
assign ( resid 100 and name hn ) ( resid 99 and name hg2 ) 4.10 1.80 1.90
assign ( resid 100 and name hn ) ( resid 101 and name hb* ) 4.10 1.80 2.40
assign ( resid 100 and name hn ) ( resid 102 and name hn ) 4.10 1.80 1.90
assign ( resid 101 and name hn ) ( resid 97 and name ha ) 3.40 1.60 1.60
assign ( resid 101 and name hn ) ( resid 97 and name hd1 ) 4.10 1.80 2.90
assign ( resid 101 and name hn ) ( resid 98 and name ha ) 3.40 1.60 1.60
assign ( resid 101 and name hn ) ( resid 99 and name hn ) 4.10 1.80 1.90
assign ( resid 101 and name hn ) ( resid 99 and name hb2 ) 4.10 1.80 1.90
assign ( resid 101 and name hn ) ( resid 100 and name hb* ) 2.30 0.50 1.00
assign ( resid 101 and name hn ) ( resid 100 and name hg1 ) 3.40 1.60 1.60
assign ( resid 101 and name hn ) ( resid 100 and name hg2 ) 4.10 1.80 1.90
assign ( resid 101 and name hn ) ( resid 103 and name hn ) 4.10 1.80 1.90
assign ( resid 101 and name hb* ) ( resid 97 and name hd1 ) 4.10 1.80 3.40
assign ( resid 101 and name hb* ) ( resid 98 and name hn ) 4.10 1.80 2.40
assign ( resid 101 and name hb* ) ( resid 102 and name hg2* ) 3.40 1.60 2.60
assign ( resid 102 and name hn ) ( resid 98 and name ha ) 3.40 1.60 1.60
assign ( resid 102 and name hn ) ( resid 100 and name ha ) 4.10 1.80 1.90
assign ( resid 102 and name hn ) ( resid 101 and name hb* ) 2.70 0.90 1.40
assign ( resid 102 and name hn ) ( resid 104 and name hn ) 4.10 1.80 1.90
assign ( resid 104 and name hn ) ( resid 101 and name ha ) 4.10 1.80 1.90
assign ( resid 104 and name hn ) ( resid 103 and name hb1 ) 4.10 1.80 1.90
assign ( resid 104 and name hn ) ( resid 103 and name hb2 ) 4.10 1.80 1.90
assign ( resid 2 and name ha ) ( resid 5 and name hb* ) 4.10 1.80 2.40
assign ( resid 4 and name ha ) ( resid 7 and name hb1 ) 3.40 1.60 1.60
assign ( resid 4 and name ha ) ( resid 7 and name hb2 ) 3.40 1.60 1.60
assign ( resid 5 and name ha ) ( resid 8 and name hb* ) 2.70 0.90 1.40
assign ( resid 6 and name ha1 ) ( resid 9 and name hb ) 4.10 1.80 1.90
assign ( resid 6 and name ha2 ) ( resid 9 and name hb ) 4.10 1.80 1.90
assign ( resid 7 and name ha ) ( resid 10 and name hb1 ) 3.40 1.60 1.60
assign ( resid 7 and name ha ) ( resid 10 and name hb2 ) 3.40 1.60 1.60
assign ( resid 8 and name ha ) ( resid 11 and name hb ) 3.40 1.60 1.60
assign ( resid 9 and name ha ) ( resid 12 and name hb* ) 3.40 1.60 2.10
assign ( resid 50 and name ha ) ( resid 53 and name hb* ) 2.70 0.90 1.40
assign ( resid 51 and name ha ) ( resid 54 and name hb* ) 3.40 1.60 2.10
assign ( resid 52 and name ha ) ( resid 55 and name hb1 ) 2.70 0.90 0.90
assign ( resid 52 and name ha ) ( resid 55 and name hb2 ) 2.70 0.90 0.90
assign ( resid 61 and name ha ) ( resid 64 and name hb1 ) 4.10 1.80 1.90
assign ( resid 61 and name ha ) ( resid 64 and name hb2 ) 4.10 1.80 1.90
assign ( resid 62 and name ha ) ( resid 65 and name hb1 ) 2.70 0.90 0.90
assign ( resid 62 and name ha ) ( resid 65 and name hb2 ) 2.70 0.90 0.90
assign ( resid 63 and name ha ) ( resid 66 and name hb1 ) 3.40 1.60 1.60
assign ( resid 63 and name ha ) ( resid 66 and name hb2 ) 3.40 1.60 1.60
assign ( resid 64 and name ha ) ( resid 67 and name hb1 ) 3.40 1.60 1.60
assign ( resid 64 and name ha ) ( resid 67 and name hb2 ) 3.40 1.60 1.60
assign ( resid 65 and name ha ) ( resid 68 and name hb1 ) 4.10 1.80 1.90
assign ( resid 65 and name ha ) ( resid 68 and name hb2 ) 4.10 1.80 1.90
assign ( resid 66 and name ha ) ( resid 69 and name hb1 ) 2.70 0.90 0.90
assign ( resid 66 and name ha ) ( resid 69 and name hb2 ) 2.70 0.90 0.90
assign ( resid 88 and name ha ) ( resid 91 and name hb1 ) 3.40 1.60 1.60
assign ( resid 88 and name ha ) ( resid 91 and name hb2 ) 3.40 1.60 1.60
assign ( resid 89 and name ha ) ( resid 92 and name hb* ) 2.70 0.90 1.40
assign ( resid 90 and name ha ) ( resid 93 and name hb* ) 2.70 0.90 1.40
assign ( resid 91 and name ha ) ( resid 94 and name hb1 ) 3.40 1.60 1.60
assign ( resid 91 and name ha ) ( resid 94 and name hb2 ) 3.40 1.60 1.60
assign ( resid 92 and name ha ) ( resid 95 and name hb ) 2.70 0.90 0.90
assign ( resid 93 and name ha ) ( resid 96 and name hb* ) 2.70 0.90 1.40
assign ( resid 94 and name ha ) ( resid 97 and name hb1 ) 3.40 1.60 1.60
assign ( resid 94 and name ha ) ( resid 97 and name hb2 ) 3.40 1.60 1.60
assign ( resid 95 and name ha ) ( resid 98 and name hb* ) 3.40 1.60 2.10
assign ( resid 96 and name ha ) ( resid 99 and name hb1 ) 4.10 1.80 1.90
assign ( resid 96 and name ha ) ( resid 99 and name hb2 ) 4.10 1.80 1.90
assign ( resid 97 and name ha ) ( resid 100 and name hb* ) 3.40 1.60 2.10
assign ( resid 98 and name ha ) ( resid 101 and name hb* ) 3.40 1.60 2.10
assign ( resid 99 and name ha ) ( resid 102 and name hb ) 4.10 1.80 1.90
assign ( resid 100 and name ha ) ( resid 103 and name hb1 ) 4.10 1.80 1.90
assign ( resid 100 and name ha ) ( resid 103 and name hb2 ) 4.10 1.80 1.90
assign ( resid 101 and name ha ) ( resid 104 and name hb* ) 4.10 1.80 2.40
assign ( resid 2 and name hn ) ( resid 93 and name ha ) 4.10 1.80 1.90
assign ( resid 7 and name hn ) ( resid 97 and name hb1 ) 4.10 1.80 1.90
assign ( resid 7 and name hn ) ( resid 97 and name hb2 ) 4.10 1.80 1.90
assign ( resid 7 and name hn ) ( resid 97 and name hd1 ) 4.10 1.80 2.90
assign ( resid 7 and name hn ) ( resid 97 and name hd2 ) 4.10 1.80 2.90
assign ( resid 7 and name hn ) ( resid 97 and name he1 ) 4.10 1.80 2.90
assign ( resid 10 and name hn ) ( resid 97 and name hd1 ) 4.10 1.80 2.90
assign ( resid 10 and name hn ) ( resid 97 and name hd2 ) 4.10 1.80 2.90
assign ( resid 10 and name hd* ) ( resid 105 and name hmb* ) 4.10 1.80 2.90
assign ( resid 10 and name hd* ) ( resid 20 and name hg1* ) 4.10 1.80 3.40
assign ( resid 10 and name he1 ) ( resid 20 and name hg1* ) 4.10 1.80 3.10
assign ( resid 10 and name he1 ) ( resid 32 and name hd2* ) 4.10 1.80 3.10
assign ( resid 10 and name he1 ) ( resid 98 and name hd1* ) 4.10 1.80 3.10
assign ( resid 10 and name he2 ) ( resid 20 and name hg1* ) 4.10 1.80 3.10
assign ( resid 10 and name he2 ) ( resid 20 and name hg2* ) 4.10 1.80 3.10
assign ( resid 10 and name he2 ) ( resid 32 and name hd1* ) 4.10 1.80 3.10
assign ( resid 10 and name he2 ) ( resid 32 and name hd2* ) 4.10 1.80 3.10
assign ( resid 10 and name hz ) ( resid 18 and name ha ) 4.10 1.80 1.90
assign ( resid 10 and name hz ) ( resid 18 and name hb1 ) 3.40 1.60 1.60
assign ( resid 10 and name hz ) ( resid 18 and name hb2 ) 3.40 1.60 1.60
assign ( resid 10 and name hz ) ( resid 18 and name hd1 ) 4.10 1.80 1.90
assign ( resid 10 and name hz ) ( resid 19 and name ha ) 3.40 1.60 1.60
assign ( resid 10 and name hz ) ( resid 20 and name hn ) 4.10 1.80 1.90
assign ( resid 10 and name hz ) ( resid 20 and name hg1* ) 3.40 1.60 2.80
assign ( resid 10 and name hz ) ( resid 20 and name hg2* ) 4.10 1.80 3.10
assign ( resid 10 and name hz ) ( resid 32 and name hd2* ) 3.40 1.60 2.80
assign ( resid 10 and name hz ) ( resid 98 and name hd1* ) 4.10 1.80 3.10
assign ( resid 10 and name hz ) ( resid 105 and name hmb* ) 4.10 1.80 2.40
assign ( resid 10 and name hz ) ( resid 20 and name hb ) 4.10 1.80 1.90
assign ( resid 10 and name hz ) ( resid 15 and name ha ) 4.10 1.80 1.90
assign ( resid 11 and name hn ) ( resid 20 and name hg2* ) 4.10 1.80 3.10
assign ( resid 13 and name ha ) ( resid 105 and name hhc ) 4.10 1.80 1.90
assign ( resid 13 and name ha ) ( resid 105 and name hmc* ) 4.10 1.80 2.40
assign ( resid 13 and name ha ) ( resid 9 and name hg2* ) 4.10 1.80 2.40
assign ( resid 14 and name hn ) ( resid 105 and name hab ) 4.10 1.80 1.90
assign ( resid 14 and name ha ) ( resid 105 and name hhc ) 3.40 1.60 1.60
assign ( resid 14 and name ha ) ( resid 105 and name hab ) 3.40 1.60 1.60
assign ( resid 14 and name ha ) ( resid 105 and name hmc* ) 3.40 1.60 2.10
assign ( resid 14 and name sg ) ( resid 105 and name cab ) 1.81 0.01 0.29
assign ( resid 17 and name hb1 ) ( resid 105 and name hhc ) 4.10 1.80 1.90
assign ( resid 17 and name hb1 ) ( resid 105 and name hhd ) 4.10 1.80 1.90
assign ( resid 17 and name hb1 ) ( resid 105 and name hac ) 4.10 1.80 1.90
assign ( resid 17 and name hb1 ) ( resid 105 and name hbc* ) 4.10 1.80 2.40
assign ( resid 17 and name hb1 ) ( resid 29 and name ha2 ) 4.10 1.80 1.90
assign ( resid 17 and name sg ) ( resid 105 and name cac ) 1.81 0.01 0.29
assign ( resid 18 and name ne2 ) ( resid 105 and name fe ) 2.02 0.22 0.18
assign ( resid 18 and name hd1 ) ( resid 30 and name hd1 ) 4.10 1.80 1.90
assign ( resid 18 and name hd1 ) ( resid 30 and name hd2 ) 4.10 1.80 1.90
assign ( resid 18 and name hd1 ) ( resid 32 and name hn ) 4.10 1.80 1.90
assign ( resid 18 and name hd1 ) ( resid 32 and name ha ) 4.10 1.80 1.90
assign ( resid 18 and name hd1 ) ( resid 32 and name hd1* ) 2.70 0.90 2.10
assign ( resid 18 and name hd1 ) ( resid 32 and name hd2* ) 3.40 1.60 2.80
assign ( resid 18 and name hd2 ) ( resid 10 and name he1 ) 4.10 1.80 1.90
assign ( resid 18 and name hd2 ) ( resid 10 and name he2 ) 4.10 1.80 1.90
assign ( resid 18 and name hd2 ) ( resid 10 and name hz ) 4.10 1.80 1.90
assign ( resid 18 and name hd2 ) ( resid 29 and name ha2 ) 3.40 1.60 1.60
assign ( resid 18 and name hd2 ) ( resid 32 and name hd1* ) 4.10 1.80 3.10
assign ( resid 18 and name hd2 ) ( resid 32 and name hd2* ) 4.10 1.80 3.10
assign ( resid 18 and name hd2 ) ( resid 105 and name hhc ) 3.40 1.60 1.60
assign ( resid 18 and name hd2 ) ( resid 105 and name hhb ) 4.10 1.80 1.90
assign ( resid 18 and name hd2 ) ( resid 105 and name hmb* ) 4.10 1.80 2.40
assign ( resid 18 and name hd2 ) ( resid 105 and name hmc* ) 4.10 1.80 2.40
assign ( resid 18 and name hd2 ) ( resid 105 and name hab ) 4.10 1.80 1.90
assign ( resid 18 and name hd2 ) ( resid 105 and name hac ) 4.10 1.80 1.90
assign ( resid 18 and name he1 ) ( resid 29 and name ha1 ) 3.40 1.60 1.60
assign ( resid 18 and name he1 ) ( resid 29 and name ha2 ) 3.40 1.60 1.60
assign ( resid 18 and name he1 ) ( resid 30 and name hd1 ) 2.70 0.90 0.90
assign ( resid 18 and name he1 ) ( resid 30 and name hd2 ) 2.70 0.90 0.90
assign ( resid 18 and name he1 ) ( resid 32 and name hd1* ) 3.40 1.60 2.80
assign ( resid 18 and name he1 ) ( resid 32 and name hd2* ) 3.40 1.60 2.80
assign ( resid 18 and name he1 ) ( resid 105 and name hha ) 4.10 1.80 1.90
assign ( resid 18 and name he1 ) ( resid 105 and name hhd ) 4.10 1.80 1.90
assign ( resid 18 and name he1 ) ( resid 105 and name hmd* ) 4.10 1.80 2.40
assign ( resid 18 and name he1 ) ( resid 105 and name hbd1 ) 4.10 1.80 2.40
assign ( resid 18 and name he1 ) ( resid 105 and name hbd2 ) 4.10 1.80 2.40
assign ( resid 19 and name hn ) ( resid 10 and name hz ) 4.10 1.80 1.90
assign ( resid 19 and name hn ) ( resid 31 and name ha ) 3.40 1.60 1.60
assign ( resid 19 and name hn ) ( resid 31 and name hb2 ) 4.10 1.80 1.90
assign ( resid 20 and name hn ) ( resid 32 and name hb1 ) 3.40 1.60 2.10
assign ( resid 20 and name hg1* ) ( resid 31 and name ha ) 4.10 1.80 3.10
assign ( resid 20 and name hg1* ) ( resid 32 and name hd1* ) 4.10 1.80 3.60
assign ( resid 20 and name hg1* ) ( resid 32 and name hd2* ) 3.40 1.60 3.30
assign ( resid 20 and name hg1* ) ( resid 97 and name he1 ) 4.10 1.80 3.10
assign ( resid 20 and name hg1* ) ( resid 98 and name ha ) 4.10 1.80 3.10
assign ( resid 20 and name hg1* ) ( resid 98 and name hd1* ) 2.70 0.90 2.60
assign ( resid 20 and name hg1* ) ( resid 98 and name hd2* ) 2.70 0.90 2.60
assign ( resid 20 and name hg1* ) ( resid 101 and name hb* ) 4.10 1.80 3.60
assign ( resid 20 and name hg2* ) ( resid 97 and name he1 ) 4.10 1.80 3.10
assign ( resid 20 and name hg2* ) ( resid 97 and name he2 ) 4.10 1.80 3.10
assign ( resid 20 and name hg2* ) ( resid 98 and name ha ) 4.10 1.80 3.10
assign ( resid 20 and name hg2* ) ( resid 98 and name hd2* ) 4.10 1.80 3.60
assign ( resid 20 and name hg2* ) ( resid 101 and name hb* ) 3.40 1.60 3.30
assign ( resid 26 and name hd2 ) ( resid 30 and name ha ) 3.40 1.60 1.60
assign ( resid 26 and name hd2 ) ( resid 30 and name hb1 ) 4.10 1.80 1.90
assign ( resid 26 and name hd2 ) ( resid 30 and name hb2 ) 3.40 1.60 1.60
assign ( resid 26 and name hd2 ) ( resid 31 and name hn ) 2.30 0.50 0.50
assign ( resid 26 and name hd2 ) ( resid 31 and name hb1 ) 2.30 0.50 0.50
assign ( resid 26 and name hd2 ) ( resid 31 and name hb2 ) 2.70 0.90 0.90
assign ( resid 26 and name hd2 ) ( resid 43 and name ha ) 4.10 1.80 1.90
assign ( resid 26 and name hd2 ) ( resid 43 and name hb* ) 2.30 0.50 1.00
assign ( resid 26 and name hd2 ) ( resid 31 and name ha ) 3.40 1.60 1.60
assign ( resid 26 and name hd2 ) ( resid 46 and name hb1 ) 3.40 1.60 1.60
assign ( resid 26 and name hd2 ) ( resid 46 and name hb2 ) 4.10 1.80 1.90
assign ( resid 26 and name hd2 ) ( resid 46 and name hd2 ) 4.10 1.80 2.90
assign ( resid 26 and name hd2 ) ( resid 46 and name hd1 ) 4.10 1.80 2.90
assign ( resid 26 and name hd2 ) ( resid 48 and name hd2 ) 4.10 1.80 2.90
assign ( resid 26 and name hd2 ) ( resid 48 and name he2 ) 4.10 1.80 2.90
assign ( resid 26 and name hd1 ) ( resid 43 and name hb* ) 4.10 1.80 2.40
assign ( resid 26 and name hd1 ) ( resid 46 and name ha ) 4.10 1.80 1.90
assign ( resid 26 and name hd1 ) ( resid 46 and name hb1 ) 4.10 1.80 1.90
assign ( resid 26 and name hd1 ) ( resid 46 and name hb2 ) 4.10 1.80 1.90
assign ( resid 26 and name hd1 ) ( resid 46 and name hd2 ) 4.10 1.80 2.90
assign ( resid 26 and name hd1 ) ( resid 46 and name hd1 ) 4.10 1.80 2.90
assign ( resid 29 and name hn ) ( resid 105 and name hhd ) 4.10 1.80 1.90
assign ( resid 29 and name ha1 ) ( resid 105 and name hhd ) 4.10 1.80 1.90
assign ( resid 29 and name ha1 ) ( resid 105 and name hmd* ) 4.10 1.80 2.40
assign ( resid 31 and name hd21 ) ( resid 19 and name hb ) 4.10 1.80 2.40
assign ( resid 31 and name hd21 ) ( resid 19 and name hg2* ) 4.10 1.80 2.40
assign ( resid 31 and name hd21 ) ( resid 21 and name ha ) 4.10 1.80 2.40
assign ( resid 31 and name hd21 ) ( resid 24 and name ha1 ) 3.40 1.60 2.10
assign ( resid 31 and name hd21 ) ( resid 25 and name hn ) 4.10 1.80 2.40
assign ( resid 31 and name hd21 ) ( resid 25 and name ha ) 4.10 1.80 2.40
assign ( resid 32 and name hn ) ( resid 20 and name hg1* ) 3.40 1.60 2.80
assign ( resid 32 and name hn ) ( resid 20 and name hg2* ) 4.10 1.80 3.10
assign ( resid 32 and name hd2* ) ( resid 18 and name hb1 ) 3.40 1.60 2.80
assign ( resid 32 and name hd2* ) ( resid 20 and name hb ) 4.10 1.80 3.10
assign ( resid 32 and name hd2* ) ( resid 105 and name hhb ) 3.40 1.60 2.70
assign ( resid 32 and name hd2* ) ( resid 105 and name hmb* ) 4.10 1.80 3.60
assign ( resid 32 and name hd2* ) ( resid 105 and name hma* ) 3.40 1.60 3.30
assign ( resid 32 and name hd2* ) ( resid 105 and name hba2 ) 4.10 1.80 3.60
assign ( resid 32 and name hd2* ) ( resid 105 and name haa1 ) 4.10 1.80 3.60
assign ( resid 32 and name hd1* ) ( resid 20 and name hb ) 4.10 1.80 3.10
assign ( resid 32 and name hd1* ) ( resid 105 and name hhb ) 3.40 1.60 2.70
assign ( resid 32 and name hd1* ) ( resid 105 and name hha ) 4.10 1.80 3.10
assign ( resid 32 and name hd1* ) ( resid 105 and name hmb* ) 4.10 1.80 3.60
assign ( resid 32 and name hd1* ) ( resid 105 and name hma* ) 3.40 1.60 3.30
assign ( resid 32 and name hd1* ) ( resid 105 and name hba1 ) 4.10 1.80 3.60
assign ( resid 32 and name hd1* ) ( resid 105 and name hba2 ) 4.10 1.80 3.60
assign ( resid 33 and name hn ) ( resid 20 and name hg1* ) 4.10 1.80 3.10
assign ( resid 35 and name hd* ) ( resid 59 and name hb1 ) 4.10 1.80 2.40 
assign ( resid 35 and name hd* ) ( resid 59 and name hb2 ) 3.40 1.60 2.10 
assign ( resid 35 and name hd* ) ( resid 59 and name hd1 ) 2.70 0.90 1.40 
assign ( resid 35 and name hd* ) ( resid 59 and name he1 ) 4.10 1.80 2.40 
assign ( resid 35 and name hd* ) ( resid 59 and name he3 ) 4.10 1.80 2.40 
assign ( resid 36 and name hd* ) ( resid 61 and name hn ) 4.10 1.80 2.90
assign ( resid 36 and name hd* ) ( resid 60 and name ha1 ) 3.40 1.60 2.60
assign ( resid 36 and name hd* ) ( resid 103 and name ha ) 3.40 1.60 2.60
assign ( resid 36 and name hd* ) ( resid 103 and name hb1 ) 3.40 1.60 2.60
assign ( resid 36 and name he* ) ( resid 61 and name hn ) 4.10 1.80 2.90
assign ( resid 36 and name he* ) ( resid 95 and name hg2* ) 3.40 1.60 3.10
assign ( resid 36 and name he* ) ( resid 98 and name ha ) 4.10 1.80 2.90
assign ( resid 36 and name he* ) ( resid 98 and name hb* ) 3.40 1.60 3.10
assign ( resid 36 and name he* ) ( resid 98 and name hd2* ) 4.10 1.80 3.60
assign ( resid 36 and name he* ) ( resid 99 and name hg1 ) 4.10 1.80 2.90
assign ( resid 36 and name he* ) ( resid 103 and name hb1 ) 3.40 1.60 2.60
assign ( resid 36 and name hz ) ( resid 95 and name hg2* ) 2.70 0.90 1.40
assign ( resid 36 and name hz ) ( resid 98 and name hb* ) 3.40 1.60 2.10
assign ( resid 36 and name hz ) ( resid 99 and name hg1 ) 4.10 1.80 1.90
assign ( resid 36 and name hz ) ( resid 99 and name hg2 ) 4.10 1.80 1.90
assign ( resid 36 and name hz ) ( resid 103 and name hb1 ) 4.10 1.80 2.40
assign ( resid 38 and name hn ) ( resid 58 and name hd* ) 3.40 1.60 2.10
assign ( resid 39 and name ha ) ( resid 57 and name hg2* ) 3.40 1.60 2.10
assign ( resid 39 and name ha ) ( resid 57 and name hd* ) 4.10 1.80 2.40
assign ( resid 39 and name ha ) ( resid 58 and name ha ) 2.30 0.50 0.50
assign ( resid 39 and name ha ) ( resid 59 and name hn ) 4.10 1.80 1.90
assign ( resid 39 and name ha ) ( resid 59 and name hd1 ) 4.10 1.80 1.90
assign ( resid 40 and name hn ) ( resid 57 and name hn ) 4.10 1.80 1.90
assign ( resid 40 and name hn ) ( resid 57 and name hd* ) 4.10 1.80 2.40
assign ( resid 40 and name hn ) ( resid 58 and name ha ) 3.40 1.60 1.60
assign ( resid 40 and name hn ) ( resid 59 and name he1 ) 4.10 1.80 1.90
assign ( resid 41 and name hn ) ( resid 48 and name hn ) 4.10 1.80 1.90
assign ( resid 41 and name hn ) ( resid 48 and name hd1 ) 4.10 1.80 2.90
assign ( resid 41 and name hn ) ( resid 48 and name hd2 ) 3.40 1.60 2.60
assign ( resid 41 and name hn ) ( resid 48 and name he1 ) 4.10 1.80 2.90
assign ( resid 41 and name hn ) ( resid 48 and name he2 ) 4.10 1.80 2.90
assign ( resid 41 and name hn ) ( resid 59 and name he1 ) 4.10 1.80 1.90
assign ( resid 42 and name hn ) ( resid 48 and name ha ) 4.10 1.80 1.90
assign ( resid 42 and name hn ) ( resid 48 and name hd1 ) 4.10 1.80 2.90
assign ( resid 42 and name hn ) ( resid 48 and name hd2 ) 3.40 1.60 2.60
assign ( resid 43 and name hn ) ( resid 48 and name hd2 ) 4.10 1.80 2.90
assign ( resid 43 and name hn ) ( resid 48 and name he1 ) 3.40 1.60 2.60
assign ( resid 43 and name hn ) ( resid 48 and name he2 ) 3.40 1.60 2.60
assign ( resid 46 and name hd1 ) ( resid 30 and name ha ) 4.10 1.80 2.90
assign ( resid 46 and name hd1 ) ( resid 30 and name hb1 ) 4.10 1.80 2.90
assign ( resid 46 and name hd1 ) ( resid 30 and name hb2 ) 4.10 1.80 2.90
assign ( resid 46 and name hd1 ) ( resid 105 and name had1 ) 4.10 1.80 2.90
assign ( resid 46 and name hd1 ) ( resid 105 and name hmd* ) 4.10 1.80 3.40
assign ( resid 46 and name he2 ) ( resid 29 and name ha1 ) 4.10 1.80 2.90
assign ( resid 46 and name he2 ) ( resid 30 and name hd2 ) 4.10 1.80 2.90
assign ( resid 46 and name he2 ) ( resid 105 and name had1 ) 4.10 1.80 2.90
assign ( resid 46 and name he2 ) ( resid 105 and name had2 ) 4.10 1.80 2.90
assign ( resid 46 and name he2 ) ( resid 105 and name hmd* ) 4.10 1.80 3.40
assign ( resid 46 and name he2 ) ( resid 105 and name hha ) 4.10 1.80 2.90
assign ( resid 46 and name he1 ) ( resid 29 and name ha1 ) 4.10 1.80 2.90
assign ( resid 46 and name he1 ) ( resid 30 and name ha ) 3.40 1.60 2.60
assign ( resid 46 and name he1 ) ( resid 30 and name hb1 ) 4.10 1.80 2.90
assign ( resid 46 and name he1 ) ( resid 30 and name hd2 ) 4.10 1.80 2.90
assign ( resid 46 and name he1 ) ( resid 31 and name hn ) 4.10 1.80 2.90
assign ( resid 46 and name he1 ) ( resid 105 and name had1 ) 4.10 1.80 2.90
assign ( resid 46 and name he1 ) ( resid 105 and name had2 ) 4.10 1.80 2.90
assign ( resid 46 and name he1 ) ( resid 105 and name hmd* ) 4.10 1.80 3.40
assign ( resid 46 and name he1 ) ( resid 105 and name hha ) 4.10 1.80 2.90
assign ( resid 48 and name ha ) ( resid 105 and name hmd* ) 4.10 1.80 2.40
assign ( resid 48 and name ha ) ( resid 105 and name had1 ) 4.10 1.80 1.90
assign ( resid 48 and name ha ) ( resid 105 and name had2 ) 4.10 1.80 1.90
assign ( resid 48 and name hd1 ) ( resid 105 and name hha ) 4.10 1.80 2.90
assign ( resid 48 and name hd2 ) ( resid 53 and name ha ) 4.10 1.80 2.90
assign ( resid 48 and name hd2 ) ( resid 105 and name hha ) 4.10 1.80 2.90
assign ( resid 48 and name hd2 ) ( resid 105 and name had2 ) 4.10 1.80 2.90
assign ( resid 48 and name hd2 ) ( resid 105 and name hbd2 ) 4.10 1.80 2.90
assign ( resid 48 and name he1 ) ( resid 30 and name hb1 ) 4.10 1.80 2.90
assign ( resid 48 and name he1 ) ( resid 30 and name hb2 ) 4.10 1.80 2.90
assign ( resid 48 and name he1 ) ( resid 30 and name hd2 ) 4.10 1.80 2.90
assign ( resid 48 and name he1 ) ( resid 105 and name hba1 ) 4.10 1.80 2.90
assign ( resid 48 and name he1 ) ( resid 105 and name had2 ) 4.10 1.80 2.90
assign ( resid 48 and name he1 ) ( resid 43 and name hb* ) 3.40 1.60 2.60
assign ( resid 48 and name he2 ) ( resid 105 and name haa1 ) 4.10 1.80 2.90
assign ( resid 48 and name he2 ) ( resid 105 and name haa2 ) 4.10 1.80 2.90
assign ( resid 48 and name he2 ) ( resid 105 and name hba1 ) 4.10 1.80 2.90
assign ( resid 48 and name he2 ) ( resid 105 and name hba2 ) 4.10 1.80 2.90
assign ( resid 49 and name hb ) ( resid 105 and name hbd2 ) 4.10 1.80 2.40
assign ( resid 52 and name hn ) ( resid 105 and name haa2 ) 4.10 1.80 2.40
assign ( resid 53 and name hn ) ( resid 41 and name hn ) 3.40 1.60 1.60
assign ( resid 55 and name hn ) ( resid 75 and name hg2* ) 3.40 1.60 2.10
assign ( resid 55 and name hn ) ( resid 75 and name hd* ) 3.40 1.60 2.10
assign ( resid 57 and name hg11 ) ( resid 63 and name hb ) 4.10 1.80 1.90
assign ( resid 57 and name hg11 ) ( resid 74 and name he* ) 4.10 1.80 2.90
assign ( resid 57 and name hd* ) ( resid 63 and name hb ) 2.30 0.50 1.00
assign ( resid 57 and name hd* ) ( resid 63 and name hg2* ) 2.30 0.50 1.50
assign ( resid 57 and name hd* ) ( resid 74 and name hd* ) 4.10 1.80 3.40
assign ( resid 57 and name hd* ) ( resid 74 and name he* ) 2.70 0.90 2.90
assign ( resid 58 and name hd* ) ( resid 37 and name ha1 ) 3.40 1.60 1.60
assign ( resid 58 and name hd* ) ( resid 37 and name ha2 ) 3.40 1.60 2.10
assign ( resid 58 and name hd* ) ( resid 39 and name ha ) 3.40 1.60 2.10
assign ( resid 59 and name ha ) ( resid 63 and name ha ) 4.10 1.80 1.90
assign ( resid 59 and name ha ) ( resid 63 and name hb ) 4.10 1.80 1.90
assign ( resid 59 and name ha ) ( resid 63 and name hg2* ) 4.10 1.80 2.40
assign ( resid 59 and name ha ) ( resid 64 and name hg ) 4.10 1.80 1.90
assign ( resid 59 and name ha ) ( resid 64 and name hd1* ) 4.10 1.80 2.40
assign ( resid 59 and name hd1 ) ( resid 35 and name hb1 ) 4.10 1.80 1.90
assign ( resid 59 and name hd1 ) ( resid 40 and name ha ) 3.40 1.60 1.60
assign ( resid 59 and name hd1 ) ( resid 40 and name hg2* ) 3.40 1.60 2.10
assign ( resid 59 and name he1 ) ( resid 105 and name haa1 ) 3.40 1.60 1.60
assign ( resid 59 and name he1 ) ( resid 105 and name haa2 ) 3.40 1.60 1.60
assign ( resid 59 and name he1 ) ( resid 105 and name hba1 ) 4.10 1.80 1.90
assign ( resid 59 and name he1 ) ( resid 105 and name hba2 ) 4.10 1.80 1.90
assign ( resid 59 and name he1 ) ( resid 105 and name hma* ) 4.10 1.80 2.40
assign ( resid 59 and name he3 ) ( resid 64 and name hn ) 3.40 1.60 1.60
assign ( resid 59 and name he3 ) ( resid 64 and name hg ) 2.30 0.50 0.50
assign ( resid 59 and name he3 ) ( resid 64 and name hd1* ) 3.40 1.60 2.80
assign ( resid 59 and name he3 ) ( resid 64 and name hd2* ) 2.70 0.90 2.10
assign ( resid 59 and name he3 ) ( resid 67 and name hb1 ) 4.10 1.80 1.90
assign ( resid 59 and name he3 ) ( resid 67 and name hb2 ) 4.10 1.80 1.90
assign ( resid 59 and name hz3 ) ( resid 63 and name ha ) 4.10 1.80 1.90
assign ( resid 59 and name hz3 ) ( resid 63 and name hg2* ) 4.10 1.80 2.40
assign ( resid 59 and name hz3 ) ( resid 64 and name hn ) 4.10 1.80 1.90
assign ( resid 59 and name hz3 ) ( resid 64 and name ha ) 2.70 0.90 0.90
assign ( resid 59 and name hz3 ) ( resid 64 and name hg ) 4.10 1.80 1.90
assign ( resid 59 and name hz3 ) ( resid 67 and name hn ) 3.40 1.60 1.60
assign ( resid 59 and name hz3 ) ( resid 67 and name ha ) 4.10 1.80 1.90
assign ( resid 59 and name hz3 ) ( resid 67 and name hb1 ) 3.40 1.60 1.60
assign ( resid 59 and name hz3 ) ( resid 67 and name hb2 ) 2.70 0.90 0.90
assign ( resid 59 and name hz3 ) ( resid 67 and name hd* ) 4.10 1.80 2.90
assign ( resid 59 and name hz3 ) ( resid 67 and name he* ) 4.10 1.80 2.90
assign ( resid 59 and name hz3 ) ( resid 68 and name hd1* ) 4.10 1.80 3.10
assign ( resid 59 and name hz3 ) ( resid 75 and name hd* ) 4.10 1.80 2.40
assign ( resid 59 and name hz2 ) ( resid 75 and name hd* ) 4.10 1.80 2.40
assign ( resid 59 and name hh2 ) ( resid 67 and name hn ) 4.10 1.80 1.90
assign ( resid 59 and name hh2 ) ( resid 67 and name ha ) 4.10 1.80 1.90
assign ( resid 59 and name hh2 ) ( resid 67 and name hb1 ) 4.10 1.80 1.90
assign ( resid 59 and name hh2 ) ( resid 67 and name hb2 ) 3.40 1.60 1.60
assign ( resid 59 and name hh2 ) ( resid 67 and name hd* ) 4.10 1.80 2.90
assign ( resid 59 and name hh2 ) ( resid 67 and name he* ) 3.40 1.60 2.60
assign ( resid 59 and name hh2 ) ( resid 75 and name hd* ) 3.40 1.60 2.10
assign ( resid 59 and name hh2 ) ( resid 75 and name hg2* ) 4.10 1.80 2.40
assign ( resid 63 and name hn ) ( resid 57 and name hd* ) 4.10 1.80 2.40
assign ( resid 64 and name hn ) ( resid 95 and name hd* ) 4.10 1.80 2.40
assign ( resid 64 and name hd1* ) ( resid 36 and name ha ) 4.10 1.80 3.10
assign ( resid 64 and name hd1* ) ( resid 36 and name hd* ) 4.10 1.80 3.10
assign ( resid 64 and name hd1* ) ( resid 36 and name he* ) 3.40 1.60 2.80
assign ( resid 64 and name hd1* ) ( resid 36 and name hz ) 2.70 0.90 2.10
assign ( resid 64 and name hd1* ) ( resid 59 and name hb1 ) 4.10 1.80 3.10
assign ( resid 64 and name hd1* ) ( resid 59 and name hz3 ) 4.10 1.80 3.10
assign ( resid 64 and name hd1* ) ( resid 59 and name hh2 ) 4.10 1.80 3.10
assign ( resid 64 and name hd1* ) ( resid 105 and name hhb ) 4.10 1.80 3.10
assign ( resid 65 and name hn ) ( resid 59 and name hz3 ) 4.10 1.80 1.90
assign ( resid 65 and name hn ) ( resid 59 and name he3 ) 4.10 1.80 1.90
assign ( resid 67 and name hd* ) ( resid 80 and name he* ) 4.10 1.80 2.90
assign ( resid 67 and name hd* ) ( resid 75 and name hg2* ) 3.40 1.60 3.10
assign ( resid 68 and name hn ) ( resid 59 and name hz3 ) 4.10 1.80 1.90
assign ( resid 68 and name hd1* ) ( resid 71 and name hg1 ) 4.10 1.80 3.10 
assign ( resid 68 and name hd1* ) ( resid 80 and name hg1 ) 4.10 1.80 3.10 
assign ( resid 68 and name hd1* ) ( resid 80 and name hg2 ) 4.10 1.80 3.10 
assign ( resid 68 and name hd1* ) ( resid 80 and name he* ) 2.70 0.90 2.60 
assign ( resid 68 and name hd1* ) ( resid 82 and name hd* ) 4.10 1.80 3.10 
assign ( resid 68 and name hd1* ) ( resid 82 and name he* ) 4.10 1.80 3.10 
assign ( resid 68 and name hd1* ) ( resid 82 and name hz ) 4.10 1.80 3.10 
assign ( resid 68 and name hd1* ) ( resid 105 and name hhb ) 3.40 1.60 2.80 
assign ( resid 68 and name hd1* ) ( resid 105 and name hmb* ) 2.70 0.90 2.60 
assign ( resid 68 and name hd1* ) ( resid 105 and name hma* ) 4.10 1.80 3.10 
assign ( resid 71 and name hb1 ) ( resid 80 and name hb1 ) 4.10 1.80 1.90 
assign ( resid 71 and name hb1 ) ( resid 80 and name hb2 ) 4.10 1.80 1.90 
assign ( resid 71 and name hb1 ) ( resid 80 and name hg2 ) 4.10 1.80 1.90 
assign ( resid 71 and name hb1 ) ( resid 80 and name he* ) 3.40 1.60 2.10 
assign ( resid 71 and name hg1 ) ( resid 80 and name hb2 ) 4.10 1.80 1.90 
assign ( resid 71 and name hg1 ) ( resid 80 and name he* ) 3.40 1.60 2.10 
assign ( resid 71 and name hg1 ) ( resid 82 and name hb2 ) 4.10 1.80 1.90 
assign ( resid 71 and name hg1 ) ( resid 82 and name hd* ) 4.10 1.80 2.90 
assign ( resid 71 and name hg1 ) ( resid 82 and name he* ) 4.10 1.80 2.90 
assign ( resid 75 and name hn ) ( resid 52 and name hn ) 4.10 1.80 1.90 
assign ( resid 75 and name hg2* ) ( resid 51 and name ha ) 4.10 1.80 2.40 
assign ( resid 75 and name hg2* ) ( resid 51 and name hb* ) 2.30 0.50 1.50 
assign ( resid 75 and name hg2* ) ( resid 52 and name hn ) 4.10 1.80 2.40 
assign ( resid 75 and name hg2* ) ( resid 52 and name ha ) 2.30 0.50 1.00 
assign ( resid 75 and name hg2* ) ( resid 52 and name hb1 ) 4.10 1.80 2.40 
assign ( resid 75 and name hg2* ) ( resid 59 and name hz2 ) 4.10 1.80 2.40 
assign ( resid 79 and name hn ) ( resid 49 and name hg2* ) 2.70 0.90 1.40 
assign ( resid 79 and name ha ) ( resid 105 and name hmd* ) 4.10 1.80 2.40 
assign ( resid 80 and name hb1 ) ( resid 105 and name hmd* ) 4.10 1.80 2.40 
assign ( resid 80 and name hb2 ) ( resid 105 and name hmd* ) 4.10 1.80 2.40 
assign ( resid 80 and name sd ) ( resid 105 and name fe ) 2.36 0.16 0.14
assign ( resid 80 and name hg1 ) ( resid 105 and name hmd* ) 4.10 1.80 2.40 
assign ( resid 80 and name hg2 ) ( resid 105 and name hmd* ) 4.10 1.80 2.40 
assign ( resid 80 and name hg2 ) ( resid 71 and name hg2 ) 4.10 1.80 2.40 
assign ( resid 80 and name he* ) ( resid 68 and name hd2* ) 4.10 1.80 3.10 
assign ( resid 80 and name he* ) ( resid 71 and name ha ) 4.10 1.80 2.40 
assign ( resid 80 and name he* ) ( resid 71 and name hb2 ) 4.10 1.80 2.40 
assign ( resid 80 and name he* ) ( resid 71 and name hg2 ) 2.70 0.90 1.40 
assign ( resid 80 and name he* ) ( resid 71 and name hd1 ) 4.10 1.80 2.40 
assign ( resid 80 and name he* ) ( resid 71 and name hd2 ) 4.10 1.80 2.40 
assign ( resid 80 and name he* ) ( resid 105 and name hhb ) 4.10 1.80 2.40 
assign ( resid 80 and name he* ) ( resid 105 and name hhc ) 4.10 1.80 2.40 
assign ( resid 80 and name he* ) ( resid 105 and name hmb* ) 4.10 1.80 3.40 
assign ( resid 80 and name he* ) ( resid 105 and name hmc* ) 4.10 1.80 3.40 
assign ( resid 81 and name hn ) ( resid 105 and name hhd ) 4.10 1.80 1.90 
assign ( resid 82 and name hd* ) ( resid 68 and name hd2* ) 3.40 1.60 3.10 
assign ( resid 82 and name hd* ) ( resid 71 and name hg1 ) 3.40 1.60 2.60 
assign ( resid 82 and name hd* ) ( resid 71 and name hd1 ) 4.10 1.80 2.90 
assign ( resid 82 and name hd* ) ( resid 105 and name hhc ) 4.10 1.80 2.90 
assign ( resid 82 and name hd* ) ( resid 105 and name hmc* ) 3.40 1.60 2.60 
assign ( resid 82 and name he* ) ( resid 13 and name ha ) 4.10 1.80 2.90 
assign ( resid 82 and name he* ) ( resid 71 and name hg1 ) 4.10 1.80 2.90 
assign ( resid 82 and name he* ) ( resid 105 and name hhc ) 4.10 1.80 2.90 
assign ( resid 82 and name he* ) ( resid 105 and name hab ) 4.10 1.80 2.90 
assign ( resid 82 and name hz ) ( resid 13 and name ha ) 4.10 1.80 1.90 
assign ( resid 82 and name hz ) ( resid 13 and name hb1 ) 3.40 1.60 1.60 
assign ( resid 82 and name hz ) ( resid 13 and name hb2 ) 4.10 1.80 1.90
assign ( resid 82 and name hz ) ( resid 13 and name hg1 ) 2.70 0.90 0.90 
assign ( resid 82 and name hz ) ( resid 13 and name hg2 ) 2.70 0.90 0.90 
assign ( resid 82 and name hz ) ( resid 13 and name hd* ) 3.40 1.60 1.60 
assign ( resid 82 and name hz ) ( resid 105 and name hhc ) 4.10 1.80 1.90 
assign ( resid 91 and name hn ) ( resid 85 and name hg2* ) 3.40 1.60 2.10
assign ( resid 91 and name hn ) ( resid 94 and name hg ) 3.40 1.60 1.60 
assign ( resid 97 and name hd1 ) ( resid 10 and name hb1 ) 4.10 1.80 2.90 
assign ( resid 97 and name hd1 ) ( resid 10 and name he1 ) 4.10 1.80 2.90 
assign ( resid 97 and name hd1 ) ( resid 10 and name hz ) 4.10 1.80 2.90 
assign ( resid 97 and name hd2 ) ( resid 7 and name ha ) 4.10 1.80 2.90 
assign ( resid 97 and name hd1 ) ( resid 7 and name hb1 ) 4.10 1.80 2.90
assign ( resid 97 and name hd2 ) ( resid 7 and name hb1 ) 4.10 1.80 2.90
assign ( resid 97 and name he1 ) ( resid 7 and name ha ) 4.10 1.80 2.90 
assign ( resid 97 and name he2 ) ( resid 7 and name hb1 ) 4.10 1.80 2.90 
assign ( resid 97 and name he2 ) ( resid 7 and name he* ) 4.10 1.80 2.90 
assign ( resid 98 and name hd1* ) ( resid 36 and name hd* ) 4.10 1.80 3.10
assign ( resid 98 and name hd1* ) ( resid 36 and name he* ) 4.10 1.80 3.10
assign ( resid 102 and name hn ) ( resid 97 and name he1 ) 4.10 1.80 2.90
assign ( resid 105 and name hha ) ( resid 30 and name hd1 ) 4.10 1.80 1.90
assign ( resid 105 and name hha ) ( resid 30 and name hd2 ) 4.10 1.80 1.90
assign ( resid 105 and name hha ) ( resid 48 and name hd2 ) 4.10 1.80 2.40
assign ( resid 105 and name hha ) ( resid 48 and name he2 ) 4.10 1.80 2.40
assign ( resid 105 and name hhb ) ( resid 64 and name hd2* ) 2.70 0.90 2.10
assign ( resid 105 and name hhb ) ( resid 68 and name hd2* ) 3.40 1.60 2.80
assign ( resid 105 and name hhb ) ( resid 67 and name hd* ) 4.10 1.80 2.90
assign ( resid 105 and name hhb ) ( resid 67 and name he* ) 4.10 1.80 2.90
assign ( resid 105 and name hhc ) ( resid 14 and name hb1 ) 3.40 1.60 1.60
assign ( resid 105 and name hhc ) ( resid 14 and name hb2 ) 3.40 1.60 1.60
assign ( resid 105 and name hhc ) ( resid 82 and name hb1 ) 4.10 1.80 1.90
assign ( resid 105 and name hhc ) ( resid 82 and name hb2 ) 4.10 1.80 1.90
assign ( resid 105 and name hhd ) ( resid 28 and name hg2* ) 2.30 0.50 1.00
assign ( resid 105 and name hhd ) ( resid 80 and name hb1 ) 4.10 1.80 1.90
assign ( resid 105 and name hhd ) ( resid 80 and name hb2 ) 4.10 1.80 1.90
assign ( resid 105 and name hhd ) ( resid 80 and name hg1 ) 4.10 1.80 1.90
assign ( resid 105 and name hhd ) ( resid 80 and name hg2 ) 4.10 1.80 1.90
assign ( resid 105 and name hab ) ( resid 14 and name hb1 ) 4.10 1.80 1.90
assign ( resid 105 and name hab ) ( resid 14 and name hb2 ) 4.10 1.80 1.90
assign ( resid 105 and name hac ) ( resid 17 and name hb2 ) 3.40 1.60 1.60
assign ( resid 105 and name hac ) ( resid 28 and name hb ) 4.10 1.80 1.90
assign ( resid 105 and name hac ) ( resid 80 and name hg2 ) 4.10 1.80 1.90
assign ( resid 105 and name hmd* ) ( resid 28 and name hb ) 4.10 1.80 2.40
assign ( resid 105 and name hmd* ) ( resid 28 and name hg2* ) 2.70 0.90 1.90

!Hbond restraints 

assign (resid   3 and name o) (resid   7 and name hn) 2.0 0.25 0.4
assign (resid   5 and name o) (resid   9 and name hn) 2.0 0.25 0.4
assign (resid   6 and name o) (resid  10 and name hn) 2.0 0.25 0.4
assign (resid   7 and name o) (resid  11 and name hn) 2.0 0.25 0.4
assign (resid   8 and name o) (resid  12 and name hn) 2.0 0.25 0.4
assign (resid   9 and name o) (resid  13 and name hn) 2.0 0.25 0.4
assign (resid  10 and name o) (resid  14 and name hn) 2.0 0.25 0.4
assign (resid  14 and name o) (resid  18 and name hn) 2.0 0.25 0.4
assign (resid  17 and name o) (resid  29 and name hn) 2.0 0.25 0.4
assign (resid  30 and name o) (resid  18 and name hd1) 2.0 0.25 0.4
assign (resid  30 and name o) (resid  32 and name hn) 2.0 0.25 0.4
assign (resid  35 and name o) (resid  38 and name hn) 2.0 0.25 0.4
assign (resid  60 and name o) (resid  64 and name hn) 2.0 0.25 0.4
assign (resid  61 and name o) (resid  65 and name hn) 2.0 0.25 0.4
assign (resid  62 and name o) (resid  66 and name hn) 2.0 0.25 0.4
assign (resid  63 and name o) (resid  67 and name hn) 2.0 0.25 0.4
assign (resid  64 and name o) (resid  68 and name hn) 2.0 0.25 0.4
assign (resid  65 and name o) (resid  69 and name hn) 2.0 0.25 0.4
assign (resid  66 and name o) (resid  70 and name hn) 2.0 0.25 0.4
assign (resid  70 and name o) (resid  74 and name hn) 2.0 0.25 0.4
assign (resid  71 and name o) (resid  75 and name hn) 2.0 0.25 0.4
assign (resid  78 and name og1) (resid  80 and name hn) 2.0 0.25 0.4
assign (resid  87 and name o) (resid  91 and name hn) 2.0 0.25 0.4
assign (resid  88 and name o) (resid  92 and name hn) 2.0 0.25 0.4
assign (resid  89 and name o) (resid  93 and name hn) 2.0 0.25 0.4
assign (resid  90 and name o) (resid  94 and name hn) 2.0 0.25 0.4
assign (resid  91 and name o) (resid  95 and name hn) 2.0 0.25 0.4
assign (resid  92 and name o) (resid  96 and name hn) 2.0 0.25 0.4
assign (resid  93 and name o) (resid  97 and name hn) 2.0 0.25 0.4
assign (resid  94 and name o) (resid  98 and name hn) 2.0 0.25 0.4
assign (resid  95 and name o) (resid  99 and name hn) 2.0 0.25 0.4
assign (resid  96 and name o) (resid 100 and name hn) 2.0 0.25 0.4
assign (resid  97 and name o) (resid 101 and name hn) 2.0 0.25 0.4

!dihedral restraints 

assign (resid 1 and name c) (resid 2 and name n) (resid 2 and name ca) (resid 2 and name c) 1.0 -120.0 40.0 2 
assign (resid 2 and name c) (resid 3 and name n) (resid 3 and name ca) (resid 3 and name c) 1.0 -60.0 40.0 2 
assign (resid 3 and name c) (resid 4 and name n) (resid 4 and name ca) (resid 4 and name c) 1.0 -60.0 40.0 2 
assign (resid 4 and name c) (resid 5 and name n) (resid 5 and name ca) (resid 5 and name c) 1.0 -60.0 40.0 2 
assign (resid 6 and name c) (resid 7 and name n) (resid 7 and name ca) (resid 7 and name c) 1.0 -60.0 40.0 2 
assign (resid 7 and name c) (resid 8 and name n) (resid 8 and name ca) (resid 8 and name c) 1.0 -60.0 40.0 2 
assign (resid 8 and name c) (resid 9 and name n) (resid 9 and name ca) (resid 9 and name c) 1.0 -60.0 40.0 2 
assign (resid 9 and name c) (resid 10 and name n) (resid 10 and name ca) (resid 10 and name c) 1.0 -60.0 40.0 2 
assign (resid 10 and name c) (resid 11 and name n) (resid 11 and name ca) (resid 11 and name c) 1.0 -60.0 40.0 2 
assign (resid 11 and name c) (resid 12 and name n) (resid 12 and name ca) (resid 12 and name c) 1.0 -120.0 60.0 2 
assign (resid 12 and name c) (resid 13 and name n) (resid 13 and name ca) (resid 13 and name c) 1.0 -120.0 40.0 2 
assign (resid 13 and name c) (resid 14 and name n) (resid 14 and name ca) (resid 14 and name c) 1.0 -120.0 40.0 2 
assign (resid 14 and name c) (resid 15 and name n) (resid 15 and name ca) (resid 15 and name c) 1.0 -60.0 40.0 2 
assign (resid 15 and name c) (resid 16 and name n) (resid 16 and name ca) (resid 16 and name c) 1.0 -60.0 40.0 2 
assign (resid 16 and name c) (resid 17 and name n) (resid 17 and name ca) (resid 17 and name c) 1.0 -120.0 40.0 2 
assign (resid 17 and name c) (resid 18 and name n) (resid 18 and name ca) (resid 18 and name c) 1.0 -120.0 40.0 2 
assign (resid 18 and name c) (resid 19 and name n) (resid 19 and name ca) (resid 19 and name c) 1.0 -120.0 40.0 2 
assign (resid 19 and name c) (resid 20 and name n) (resid 20 and name ca) (resid 20 and name c) 1.0 -120.0 40.0 2 
assign (resid 20 and name c) (resid 21 and name n) (resid 21 and name ca) (resid 21 and name c) 1.0 -120.0 55.0 2 
assign (resid 21 and name c) (resid 22 and name n) (resid 22 and name ca) (resid 22 and name c) 1.0 -60.0 40.0 2 
assign (resid 24 and name c) (resid 25 and name n) (resid 25 and name ca) (resid 25 and name c) 1.0 -60.0 40.0 2 
assign (resid 25 and name c) (resid 26 and name n) (resid 26 and name ca) (resid 26 and name c) 1.0 -120.0 40.0 2 
assign (resid 26 and name c) (resid 27 and name n) (resid 27 and name ca) (resid 27 and name c) 1.0 -120.0 55.0 2 
assign (resid 27 and name c) (resid 28 and name n) (resid 28 and name ca) (resid 28 and name c) 1.0 -120.0 60.0 2 
assign (resid 30 and name c) (resid 31 and name n) (resid 31 and name ca) (resid 31 and name c) 1.0 -60.0 40.0 2 
assign (resid 31 and name c) (resid 32 and name n) (resid 32 and name ca) (resid 32 and name c) 1.0 -120.0 40.0 2 
assign (resid 32 and name c) (resid 33 and name n) (resid 33 and name ca) (resid 33 and name c) 1.0 -60.0 40.0 2 
assign (resid 35 and name c) (resid 36 and name n) (resid 36 and name ca) (resid 36 and name c) 1.0 -120.0 60.0 2 
assign (resid 37 and name c) (resid 38 and name n) (resid 38 and name ca) (resid 38 and name c) 1.0 -120.0 40.0 2 
assign (resid 38 and name c) (resid 39 and name n) (resid 39 and name ca) (resid 39 and name c) 1.0 -120.0 60.0 2 
assign (resid 39 and name c) (resid 40 and name n) (resid 40 and name ca) (resid 40 and name c) 1.0 -60.0 40.0 2 
assign (resid 41 and name c) (resid 42 and name n) (resid 42 and name ca) (resid 42 and name c) 1.0 -120.0 40.0 2 
assign (resid 42 and name c) (resid 43 and name n) (resid 43 and name ca) (resid 43 and name c) 1.0 -60.0 40.0 2 
assign (resid 45 and name c) (resid 46 and name n) (resid 46 and name ca) (resid 46 and name c) 1.0 -120.0 40.0 2 
assign (resid 46 and name c) (resid 47 and name n) (resid 47 and name ca) (resid 47 and name c) 1.0 -120.0 60.0 2 
assign (resid 47 and name c) (resid 48 and name n) (resid 48 and name ca) (resid 48 and name c) 1.0 -60.0 40.0 2 
assign (resid 48 and name c) (resid 49 and name n) (resid 49 and name ca) (resid 49 and name c) 1.0 -120.0 60.0 2 
assign (resid 49 and name c) (resid 50 and name n) (resid 50 and name ca) (resid 50 and name c) 1.0 -60.0 40.0 2 
assign (resid 50 and name c) (resid 51 and name n) (resid 51 and name ca) (resid 51 and name c) 1.0 -60.0 40.0 2 
assign (resid 51 and name c) (resid 52 and name n) (resid 52 and name ca) (resid 52 and name c) 1.0 -60.0 40.0 2 
assign (resid 52 and name c) (resid 53 and name n) (resid 53 and name ca) (resid 53 and name c) 1.0 -60.0 40.0 2 
assign (resid 53 and name c) (resid 54 and name n) (resid 54 and name ca) (resid 54 and name c) 1.0 -60.0 40.0 2 
assign (resid 54 and name c) (resid 55 and name n) (resid 55 and name ca) (resid 55 and name c) 1.0 -60.0 40.0 2 
assign (resid 56 and name c) (resid 57 and name n) (resid 57 and name ca) (resid 57 and name c) 1.0 -120.0 40.0 2 
assign (resid 57 and name c) (resid 58 and name n) (resid 58 and name ca) (resid 58 and name c) 1.0 -120.0 60.0 2 
assign (resid 58 and name c) (resid 59 and name n) (resid 59 and name ca) (resid 59 and name c) 1.0 -60.0 40.0 2 
assign (resid 60 and name c) (resid 61 and name n) (resid 61 and name ca) (resid 61 and name c) 1.0 -60.0 40.0 2 
assign (resid 61 and name c) (resid 62 and name n) (resid 62 and name ca) (resid 62 and name c) 1.0 -120.0 60.0 2 
assign (resid 62 and name c) (resid 63 and name n) (resid 63 and name ca) (resid 63 and name c) 1.0 -120.0 60.0 2 
assign (resid 65 and name c) (resid 66 and name n) (resid 66 and name ca) (resid 66 and name c) 1.0 -120.0 60.0 2 
assign (resid 66 and name c) (resid 67 and name n) (resid 67 and name ca) (resid 67 and name c) 1.0 -60.0 40.0 2 
assign (resid 67 and name c) (resid 68 and name n) (resid 68 and name ca) (resid 68 and name c) 1.0 -60.0 40.0 2 
assign (resid 68 and name c) (resid 69 and name n) (resid 69 and name ca) (resid 69 and name c) 1.0 -120.0 60.0 2 
assign (resid 69 and name c) (resid 70 and name n) (resid 70 and name ca) (resid 70 and name c) 1.0 -120.0 60.0 2 
assign (resid 71 and name c) (resid 72 and name n) (resid 72 and name ca) (resid 72 and name c) 1.0 -120.0 60.0 2 
assign (resid 72 and name c) (resid 73 and name n) (resid 73 and name ca) (resid 73 and name c) 1.0 -120.0 60.0 2 
assign (resid 73 and name c) (resid 74 and name n) (resid 74 and name ca) (resid 74 and name c) 1.0 -120.0 60.0 2 
assign (resid 74 and name c) (resid 75 and name n) (resid 75 and name ca) (resid 75 and name c) 1.0 -120.0 40.0 2 
assign (resid 77 and name c) (resid 78 and name n) (resid 78 and name ca) (resid 78 and name c) 1.0 -60.0 40.0 2 
assign (resid 78 and name c) (resid 79 and name n) (resid 79 and name ca) (resid 79 and name c) 1.0 -120.0 40.0 2 
assign (resid 79 and name c) (resid 80 and name n) (resid 80 and name ca) (resid 80 and name c) 1.0 -120.0 60.0 2 
assign (resid 80 and name c) (resid 81 and name n) (resid 81 and name ca) (resid 81 and name c) 1.0 -120.0 40.0 2 
assign (resid 81 and name c) (resid 82 and name n) (resid 82 and name ca) (resid 82 and name c) 1.0 -120.0 60.0 2 
assign (resid 82 and name c) (resid 83 and name n) (resid 83 and name ca) (resid 83 and name c) 1.0 -60.0 40.0 2 
assign (resid 84 and name c) (resid 85 and name n) (resid 85 and name ca) (resid 85 and name c) 1.0 -120.0 60.0 2 
assign (resid 85 and name c) (resid 86 and name n) (resid 86 and name ca) (resid 86 and name c) 1.0 -120.0 60.0 2 
assign (resid 86 and name c) (resid 87 and name n) (resid 87 and name ca) (resid 87 and name c) 1.0 -120.0 60.0 2 
assign (resid 87 and name c) (resid 88 and name n) (resid 88 and name ca) (resid 88 and name c) 1.0 -60.0 40.0 2 
assign (resid 88 and name c) (resid 89 and name n) (resid 89 and name ca) (resid 89 and name c) 1.0 -60.0 40.0 2 
assign (resid 89 and name c) (resid 90 and name n) (resid 90 and name ca) (resid 90 and name c) 1.0 -120.0 60.0 2 
assign (resid 90 and name c) (resid 91 and name n) (resid 91 and name ca) (resid 91 and name c) 1.0 -60.0 40.0 2 
assign (resid 91 and name c) (resid 92 and name n) (resid 92 and name ca) (resid 92 and name c) 1.0 -60.0 40.0 2 
assign (resid 94 and name c) (resid 95 and name n) (resid 95 and name ca) (resid 95 and name c) 1.0 -60.0 40.0 2 
assign (resid 95 and name c) (resid 96 and name n) (resid 96 and name ca) (resid 96 and name c) 1.0 -60.0 40.0 2 
assign (resid 97 and name c) (resid 98 and name n) (resid 98 and name ca) (resid 98 and name c) 1.0 -60.0 40.0 2 
assign (resid 98 and name c) (resid 99 and name n) (resid 99 and name ca) (resid 99 and name c) 1.0 -60.0 40.0 2 
assign (resid 99 and name c) (resid 100 and name n) (resid 100 and name ca) (resid 100 and name c) 1.0 -120.0 60.0 2 
assign (resid 100 and name c) (resid 101 and name n) (resid 101 and name ca) (resid 101 and name c) 1.0 -60.0 40.0 2 
assign (resid 101 and name c) (resid 102 and name n) (resid 102 and name ca) (resid 102 and name c) 1.0 -120.0 40.0 2 
assign (resid 103 and name c) (resid 104 and name n) (resid 104 and name ca) (resid 104 and name c) 1.0 -120.0 40.0 2 


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLY   1          1HT       GLY   1  -8.908  11.289   7.675
    2   2H    GLY   1          2HT       GLY   1 -10.244  10.848   8.627
    3   3H    GLY   1          3HT       GLY   1 -10.452  11.197   6.978
    4   1HA   GLY   1          1HA       GLY   1  -9.200   9.264   6.344
    5   2HA   GLY   1          2HA       GLY   1  -8.859   8.930   8.043
    6    H    ASP   2           H        ASP   2 -10.532   7.551   5.803
    7    HA   ASP   2           HA       ASP   2 -12.655   6.676   7.626
    8   1HB   ASP   2          2HB       ASP   2 -13.175   8.672   5.604
    9   2HB   ASP   2          1HB       ASP   2 -14.065   7.195   5.232
   10    H    VAL   3           H        VAL   3 -14.053   4.968   6.382
   11    HA   VAL   3           HA       VAL   3 -12.141   3.275   4.860
   12    HB   VAL   3           HB       VAL   3 -14.806   2.581   6.134
   13   1HG1  VAL   3          1HG1      VAL   3 -12.720   0.582   5.338
   14   2HG1  VAL   3          2HG1      VAL   3 -13.771   1.245   4.086
   15   3HG1  VAL   3          3HG1      VAL   3 -14.469   0.386   5.460
   16   1HG2  VAL   3          1HG2      VAL   3 -12.109   1.635   7.070
   17   2HG2  VAL   3          2HG2      VAL   3 -13.613   1.779   7.980
   18   3HG2  VAL   3          3HG2      VAL   3 -12.692   3.225   7.565
   19    H    GLU   4           H        GLU   4 -15.548   4.358   4.708
   20    HA   GLU   4           HA       GLU   4 -15.977   3.317   2.054
   21   1HB   GLU   4          2HB       GLU   4 -17.468   5.657   3.249
   22   2HB   GLU   4          1HB       GLU   4 -18.069   4.433   2.130
   23   1HG   GLU   4          2HG       GLU   4 -17.047   3.173   4.525
   24   2HG   GLU   4          1HG       GLU   4 -18.250   4.393   4.943
   25    H    LYS   5           H        LYS   5 -14.199   5.980   3.192
   26    HA   LYS   5           HA       LYS   5 -14.593   7.600   0.757
   27   1HB   LYS   5          2HB       LYS   5 -12.932   7.930   3.259
   28   2HB   LYS   5          1HB       LYS   5 -12.752   9.010   1.876
   29   1HG   LYS   5          2HG       LYS   5 -15.552   8.580   2.619
   30   2HG   LYS   5          1HG       LYS   5 -14.606   9.310   3.916
   31   1HD   LYS   5          2HD       LYS   5 -15.261  11.195   2.713
   32   2HD   LYS   5          1HD       LYS   5 -13.689  10.852   1.991
   33   1HE   LYS   5          2HE       LYS   5 -14.599  10.130   0.011
   34   2HE   LYS   5          1HE       LYS   5 -16.040   9.476   0.790
   35   1HZ   LYS   5          1HZ       LYS   5 -15.673  12.000  -0.420
   36   2HZ   LYS   5          2HZ       LYS   5 -16.083  12.210   1.215
   37   3HZ   LYS   5          3HZ       LYS   5 -17.096  11.309   0.190
   38    H    GLY   6           H        GLY   6 -11.846   5.941   2.355
   39   1HA   GLY   6          1HA       GLY   6  -9.951   6.326   0.292
   40   2HA   GLY   6          2HA       GLY   6  -9.929   4.965   1.414
   41    H    LYS   7           H        LYS   7 -12.532   3.937   0.610
   42    HA   LYS   7           HA       LYS   7 -11.822   2.103  -1.385
   43   1HB   LYS   7          2HB       LYS   7 -13.886   2.082   0.131
   44   2HB   LYS   7          1HB       LYS   7 -14.637   3.156  -1.050
   45   1HG   LYS   7          2HG       LYS   7 -14.903   1.493  -2.578
   46   2HG   LYS   7          1HG       LYS   7 -13.331   0.779  -2.213
   47   1HD   LYS   7          2HD       LYS   7 -15.259  -0.696  -1.578
   48   2HD   LYS   7          1HD       LYS   7 -14.219  -0.283  -0.215
   49   1HE   LYS   7          2HE       LYS   7 -16.103   1.787  -0.316
   50   2HE   LYS   7          1HE       LYS   7 -17.033   0.321  -0.623
   51   1HZ   LYS   7          1HZ       LYS   7 -15.426  -0.463   1.368
   52   2HZ   LYS   7          2HZ       LYS   7 -16.997   0.141   1.594
   53   3HZ   LYS   7          3HZ       LYS   7 -15.655   1.168   1.774
   54    H    LYS   8           H        LYS   8 -13.409   5.269  -1.768
   55    HA   LYS   8           HA       LYS   8 -13.599   4.991  -4.663
   56   1HB   LYS   8          2HB       LYS   8 -14.878   6.576  -2.873
   57   2HB   LYS   8          1HB       LYS   8 -13.650   7.702  -3.454
   58   1HG   LYS   8          2HG       LYS   8 -14.326   7.176  -5.796
   59   2HG   LYS   8          1HG       LYS   8 -15.617   6.153  -5.166
   60   1HD   LYS   8          2HD       LYS   8 -16.635   8.266  -5.608
   61   2HD   LYS   8          1HD       LYS   8 -16.410   8.204  -3.859
   62   1HE   LYS   8          2HE       LYS   8 -14.070   9.272  -5.252
   63   2HE   LYS   8          1HE       LYS   8 -15.521  10.235  -5.531
   64   1HZ   LYS   8          1HZ       LYS   8 -15.667  10.816  -3.369
   65   2HZ   LYS   8          2HZ       LYS   8 -13.991  10.539  -3.402
   66   3HZ   LYS   8          3HZ       LYS   8 -15.041   9.346  -2.800
   67    H    ILE   9           H        ILE   9 -11.216   6.175  -2.403
   68    HA   ILE   9           HA       ILE   9  -9.743   7.821  -4.242
   69    HB   ILE   9           HB       ILE   9  -8.549   6.288  -1.923
   70   1HG1  ILE   9          2HG1      ILE   9 -10.142   8.873  -1.911
   71   2HG1  ILE   9          1HG1      ILE   9 -10.592   7.363  -1.116
   72   1HG2  ILE   9          1HG2      ILE   9  -6.756   7.612  -2.281
   73   2HG2  ILE   9          2HG2      ILE   9  -7.765   9.057  -2.310
   74   3HG2  ILE   9          3HG2      ILE   9  -7.518   8.124  -3.786
   75   1HD1  ILE   9          1HD1      ILE   9  -8.495   9.355  -0.355
   76   2HD1  ILE   9          2HD1      ILE   9  -8.196   7.655   0.010
   77   3HD1  ILE   9          3HD1      ILE   9  -9.619   8.462   0.670
   78    H    PHE  10           H        PHE  10  -8.897   4.537  -3.031
   79    HA   PHE  10           HA       PHE  10  -6.923   4.078  -5.055
   80   1HB   PHE  10          2HB       PHE  10  -7.150   2.748  -2.932
   81   2HB   PHE  10          1HB       PHE  10  -8.587   1.988  -3.616
   82    HD1  PHE  10           HD1      PHE  10  -4.925   2.237  -3.782
   83    HD2  PHE  10           HD2      PHE  10  -8.416   0.460  -5.547
   84    HE1  PHE  10           HE1      PHE  10  -3.493   0.604  -4.980
   85    HE2  PHE  10           HE2      PHE  10  -6.967  -1.172  -6.743
   86    HZ   PHE  10           HZ       PHE  10  -4.529  -1.099  -6.460
   87    H    ILE  11           H        ILE  11 -10.387   3.329  -4.882
   88    HA   ILE  11           HA       ILE  11 -10.510   1.868  -7.352
   89    HB   ILE  11           HB       ILE  11 -12.619   3.423  -5.830
   90   1HG1  ILE  11          2HG1      ILE  11 -12.116   0.441  -6.090
   91   2HG1  ILE  11          1HG1      ILE  11 -11.603   1.420  -4.713
   92   1HG2  ILE  11          1HG2      ILE  11 -12.662   2.216  -8.483
   93   2HG2  ILE  11          2HG2      ILE  11 -13.878   3.219  -7.692
   94   3HG2  ILE  11          3HG2      ILE  11 -13.853   1.478  -7.411
   95   1HD1  ILE  11          1HD1      ILE  11 -14.063   2.142  -4.525
   96   2HD1  ILE  11          2HD1      ILE  11 -13.686   0.485  -4.051
   97   3HD1  ILE  11          3HD1      ILE  11 -14.419   0.809  -5.623
   98    H    MET  12           H        MET  12 -10.070   5.187  -6.675
   99    HA   MET  12           HA       MET  12 -10.825   5.877  -9.487
  100   1HB   MET  12          2HB       MET  12 -12.071   6.964  -7.458
  101   2HB   MET  12          1HB       MET  12 -10.601   7.922  -7.290
  102   1HG   MET  12          2HG       MET  12 -10.858   8.907  -9.421
  103   2HG   MET  12          1HG       MET  12 -11.996   7.669  -9.952
  104   1HE   MET  12          1HE       MET  12 -11.587  11.146  -8.921
  105   2HE   MET  12          2HE       MET  12 -13.276  11.600  -9.137
  106   3HE   MET  12          3HE       MET  12 -12.451  10.683 -10.394
  107    H    LYS  13           H        LYS  13  -8.193   5.188  -7.688
  108    HA   LYS  13           HA       LYS  13  -6.537   7.260  -9.081
  109   1HB   LYS  13          2HB       LYS  13  -6.684   6.753  -6.330
  110   2HB   LYS  13          1HB       LYS  13  -5.193   5.971  -6.846
  111   1HG   LYS  13          2HG       LYS  13  -4.314   8.061  -6.617
  112   2HG   LYS  13          1HG       LYS  13  -5.022   8.323  -8.211
  113   1HD   LYS  13          2HD       LYS  13  -6.798   8.720  -5.845
  114   2HD   LYS  13          1HD       LYS  13  -5.565   9.944  -6.148
  115   1HE   LYS  13          2HE       LYS  13  -6.389  10.275  -8.418
  116   2HE   LYS  13          1HE       LYS  13  -7.550   8.964  -8.220
  117   1HZ   LYS  13          1HZ       LYS  13  -7.741  10.918  -6.142
  118   2HZ   LYS  13          2HZ       LYS  13  -8.953  10.294  -7.155
  119   3HZ   LYS  13          3HZ       LYS  13  -7.995  11.596  -7.676
  120    H    CYS  14           H        CYS  14  -6.034   4.065  -7.526
  121    HA   CYS  14           HA       CYS  14  -4.479   3.298  -9.966
  122   1HB   CYS  14          2HB       CYS  14  -3.974   1.617  -7.633
  123   2HB   CYS  14          1HB       CYS  14  -2.823   2.479  -8.646
  124    H    SER  15           H        SER  15  -7.320   3.029  -9.760
  125    HA   SER  15           HA       SER  15  -7.817   0.176  -9.166
  126   1HB   SER  15          2HB       SER  15  -9.378   2.286  -8.736
  127   2HB   SER  15          1HB       SER  15  -9.870   1.970 -10.396
  128    HG   SER  15           HG       SER  15  -9.769  -0.018  -8.375
  129    H    GLN  16           H        GLN  16  -6.477   1.731 -11.696
  130    HA   GLN  16           HA       GLN  16  -7.940   0.191 -13.780
  131   1HB   GLN  16          2HB       GLN  16  -6.259   2.642 -13.763
  132   2HB   GLN  16          1HB       GLN  16  -6.095   1.598 -15.176
  133   1HG   GLN  16          2HG       GLN  16  -8.758   1.590 -15.021
  134   2HG   GLN  16          1HG       GLN  16  -8.472   3.135 -14.219
  135   1HE2  GLN  16          1HE2      GLN  16  -6.960   4.680 -15.479
  136   2HE2  GLN  16          2HE2      GLN  16  -7.078   4.672 -17.172
  137    H    CYS  17           H        CYS  17  -4.638   0.774 -12.567
  138    HA   CYS  17           HA       CYS  17  -3.673  -1.565 -14.090
  139   1HB   CYS  17          2HB       CYS  17  -2.364   0.628 -12.499
  140   2HB   CYS  17          1HB       CYS  17  -1.473  -0.856 -12.836
  141    H    HIS  18           H        HIS  18  -4.510  -0.626 -10.805
  142    HA   HIS  18           HA       HIS  18  -3.728  -3.373  -9.892
  143   1HB   HIS  18          2HB       HIS  18  -4.102  -0.846  -8.261
  144   2HB   HIS  18          1HB       HIS  18  -3.706  -2.433  -7.604
  145    HD1  HIS  18           HD1      HIS  18  -1.289  -3.155  -7.688
  146    HD2  HIS  18           HD2      HIS  18  -2.008   0.286  -9.900
  147    HE1  HIS  18           HE1      HIS  18   0.980  -2.249  -8.352
  148    H    THR  19           H        THR  19  -5.822  -4.205 -10.659
  149    HA   THR  19           HA       THR  19  -8.228  -3.075  -9.405
  150    HB   THR  19           HB       THR  19  -9.453  -4.755 -10.669
  151    HG1  THR  19           HG1      THR  19  -6.885  -5.810 -11.251
  152   1HG2  THR  19          1HG2      THR  19  -7.205  -3.939 -12.501
  153   2HG2  THR  19          2HG2      THR  19  -8.306  -2.735 -11.830
  154   3HG2  THR  19          3HG2      THR  19  -8.932  -4.033 -12.848
  155    H    VAL  20           H        VAL  20  -8.099  -3.449  -7.196
  156    HA   VAL  20           HA       VAL  20  -7.333  -6.100  -6.189
  157    HB   VAL  20           HB       VAL  20  -7.370  -5.114  -4.037
  158   1HG1  VAL  20          1HG1      VAL  20  -6.713  -2.526  -5.070
  159   2HG1  VAL  20          2HG1      VAL  20  -6.138  -3.742  -6.211
  160   3HG1  VAL  20          3HG1      VAL  20  -5.617  -3.795  -4.527
  161   1HG2  VAL  20          1HG2      VAL  20  -9.668  -4.182  -4.201
  162   2HG2  VAL  20          2HG2      VAL  20  -9.053  -2.880  -5.219
  163   3HG2  VAL  20          3HG2      VAL  20  -8.535  -3.004  -3.538
  164    H    GLU  21           H        GLU  21  -9.939  -5.435  -7.773
  165    HA   GLU  21           HA       GLU  21 -11.660  -7.116  -6.055
  166   1HB   GLU  21          2HB       GLU  21 -13.586  -5.564  -6.350
  167   2HB   GLU  21          1HB       GLU  21 -12.285  -4.842  -5.403
  168   1HG   GLU  21          2HG       GLU  21 -11.425  -3.877  -7.626
  169   2HG   GLU  21          1HG       GLU  21 -12.996  -4.322  -8.293
  170    H    LYS  22           H        LYS  22 -10.246  -7.451  -8.635
  171    HA   LYS  22           HA       LYS  22 -12.506  -7.544 -10.562
  172   1HB   LYS  22          2HB       LYS  22 -10.318  -6.610 -11.312
  173   2HB   LYS  22          1HB       LYS  22  -9.571  -8.176 -10.999
  174   1HG   LYS  22          2HG       LYS  22 -10.730  -9.226 -12.743
  175   2HG   LYS  22          1HG       LYS  22 -11.998  -8.000 -12.767
  176   1HD   LYS  22          2HD       LYS  22  -9.584  -6.629 -13.294
  177   2HD   LYS  22          1HD       LYS  22  -9.542  -8.089 -14.284
  178   1HE   LYS  22          2HE       LYS  22 -11.545  -7.535 -15.401
  179   2HE   LYS  22          1HE       LYS  22 -12.017  -6.372 -14.162
  180   1HZ   LYS  22          1HZ       LYS  22  -9.573  -5.516 -15.090
  181   2HZ   LYS  22          2HZ       LYS  22 -11.090  -4.824 -15.422
  182   3HZ   LYS  22          3HZ       LYS  22 -10.429  -5.975 -16.482
  183    H    GLY  23           H        GLY  23  -9.784  -9.808 -10.135
  184   1HA   GLY  23          2HA       GLY  23 -11.287 -11.973  -9.066
  185   2HA   GLY  23          1HA       GLY  23 -11.323 -12.101 -10.826
  186    H    GLY  24           H        GLY  24  -8.783 -11.131  -8.494
  187   1HA   GLY  24          2HA       GLY  24  -6.573 -11.878  -8.278
  188   2HA   GLY  24          1HA       GLY  24  -7.181 -13.451  -8.793
  189    H    LYS  25           H        LYS  25  -7.789 -10.876 -10.983
  190    HA   LYS  25           HA       LYS  25  -5.722 -11.990 -12.810
  191   1HB   LYS  25          2HB       LYS  25  -8.283 -11.653 -13.370
  192   2HB   LYS  25          1HB       LYS  25  -7.786  -9.987 -13.664
  193   1HG   LYS  25          2HG       LYS  25  -5.854 -11.134 -15.056
  194   2HG   LYS  25          1HG       LYS  25  -6.985 -12.486 -15.116
  195   1HD   LYS  25          2HD       LYS  25  -8.295  -9.935 -15.665
  196   2HD   LYS  25          1HD       LYS  25  -6.997 -10.276 -16.809
  197   1HE   LYS  25          2HE       LYS  25  -8.075 -12.680 -16.864
  198   2HE   LYS  25          1HE       LYS  25  -9.505 -11.833 -16.276
  199   1HZ   LYS  25          1HZ       LYS  25  -7.978 -11.207 -18.743
  200   2HZ   LYS  25          2HZ       LYS  25  -9.285 -10.294 -18.155
  201   3HZ   LYS  25          3HZ       LYS  25  -9.525 -11.898 -18.663
  202    H    HIS  26           H        HIS  26  -3.891 -10.834 -13.120
  203    HA   HIS  26           HA       HIS  26  -3.988  -7.895 -12.621
  204   1HB   HIS  26          2HB       HIS  26  -1.483  -8.272 -11.998
  205   2HB   HIS  26          1HB       HIS  26  -2.723  -8.634 -10.807
  206    HD1  HIS  26           HD1      HIS  26  -2.139 -10.995 -13.678
  207    HD2  HIS  26           HD2      HIS  26  -1.115 -10.693  -9.648
  208    HE1  HIS  26           HE1      HIS  26  -1.162 -13.232 -13.019
  209    H    LYS  27           H        LYS  27  -4.124  -7.307 -14.802
  210    HA   LYS  27           HA       LYS  27  -2.341  -8.497 -16.769
  211   1HB   LYS  27          2HB       LYS  27  -4.748  -7.568 -17.126
  212   2HB   LYS  27          1HB       LYS  27  -3.946  -6.002 -17.241
  213   1HG   LYS  27          2HG       LYS  27  -2.598  -6.737 -19.092
  214   2HG   LYS  27          1HG       LYS  27  -3.116  -8.409 -18.876
  215   1HD   LYS  27          2HD       LYS  27  -5.174  -8.044 -19.841
  216   2HD   LYS  27          1HD       LYS  27  -5.246  -6.368 -19.298
  217   1HE   LYS  27          2HE       LYS  27  -3.725  -5.655 -21.010
  218   2HE   LYS  27          1HE       LYS  27  -3.324  -7.320 -21.433
  219   1HZ   LYS  27          1HZ       LYS  27  -5.394  -5.726 -22.437
  220   2HZ   LYS  27          2HZ       LYS  27  -6.096  -7.024 -21.595
  221   3HZ   LYS  27          3HZ       LYS  27  -4.998  -7.321 -22.857
  222    H    THR  28           H        THR  28  -2.845  -5.011 -16.131
  223    HA   THR  28           HA       THR  28  -0.039  -4.519 -16.849
  224    HB   THR  28           HB       THR  28  -2.148  -2.562 -15.892
  225    HG1  THR  28           HG1      THR  28  -2.816  -2.487 -17.896
  226   1HG2  THR  28          1HG2      THR  28   0.056  -1.615 -15.699
  227   2HG2  THR  28          2HG2      THR  28  -0.666  -0.956 -17.168
  228   3HG2  THR  28          3HG2      THR  28   0.526  -2.251 -17.276
  229    H    GLY  29           H        GLY  29  -2.014  -3.506 -14.028
  230   1HA   GLY  29          2HA       GLY  29   0.455  -3.271 -12.439
  231   2HA   GLY  29          1HA       GLY  29  -1.156  -2.805 -11.912
  232    HA   PRO  30           HA       PRO  30   0.171  -7.206 -10.499
  233   1HB   PRO  30          2HB       PRO  30   1.178  -6.552  -8.019
  234   2HB   PRO  30          1HB       PRO  30   2.173  -6.774  -9.469
  235   1HG   PRO  30          2HG       PRO  30   1.280  -4.215  -8.171
  236   2HG   PRO  30          1HG       PRO  30   2.811  -4.587  -8.989
  237   1HD   PRO  30          2HD       PRO  30   0.781  -3.162 -10.194
  238   2HD   PRO  30          1HD       PRO  30   1.958  -4.139 -11.088
  239    H    ASN  31           H        ASN  31  -1.459  -8.287  -9.498
  240    HA   ASN  31           HA       ASN  31  -3.822  -7.051  -8.615
  241   1HB   ASN  31          2HB       ASN  31  -3.767  -9.421  -9.173
  242   2HB   ASN  31          1HB       ASN  31  -2.677  -9.747  -7.826
  243   1HD2  ASN  31          1HD2      ASN  31  -5.882  -8.136  -8.331
  244   2HD2  ASN  31          2HD2      ASN  31  -6.584  -8.785  -6.928
  245    H    LEU  32           H        LEU  32  -3.692  -5.477  -7.063
  246    HA   LEU  32           HA       LEU  32  -2.041  -5.809  -4.680
  247   1HB   LEU  32          2HB       LEU  32  -3.550  -3.653  -5.977
  248   2HB   LEU  32          1HB       LEU  32  -3.690  -3.633  -4.221
  249    HG   LEU  32           HG       LEU  32  -1.391  -3.309  -3.909
  250   1HD1  LEU  32          1HD1      LEU  32  -1.212  -4.820  -6.442
  251   2HD1  LEU  32          2HD1      LEU  32  -0.154  -4.858  -5.033
  252   3HD1  LEU  32          3HD1      LEU  32   0.017  -3.575  -6.230
  253   1HD2  LEU  32          1HD2      LEU  32  -2.430  -1.911  -6.342
  254   2HD2  LEU  32          2HD2      LEU  32  -0.721  -1.724  -5.946
  255   3HD2  LEU  32          3HD2      LEU  32  -1.955  -1.238  -4.782
  256    H    HIS  33           H        HIS  33  -3.758  -7.929  -4.659
  257    HA   HIS  33           HA       HIS  33  -6.099  -7.211  -2.996
  258   1HB   HIS  33          2HB       HIS  33  -6.013  -8.991  -4.933
  259   2HB   HIS  33          1HB       HIS  33  -5.320 -10.030  -3.688
  260    HD1  HIS  33           HD1      HIS  33  -8.510  -8.675  -4.897
  261    HD2  HIS  33           HD2      HIS  33  -7.089 -10.324  -1.341
  262    HE1  HIS  33           HE1      HIS  33 -10.550  -9.291  -3.530
  263    H    GLY  34           H        GLY  34  -2.854  -8.016  -2.559
  264   1HA   GLY  34          2HA       GLY  34  -3.229  -8.315   0.318
  265   2HA   GLY  34          1HA       GLY  34  -2.656  -9.790  -0.461
  266    H    LEU  35           H        LEU  35  -1.821  -6.583  -1.605
  267    HA   LEU  35           HA       LEU  35   0.948  -7.069  -1.776
  268   1HB   LEU  35          2HB       LEU  35  -0.155  -5.204  -2.928
  269   2HB   LEU  35          1HB       LEU  35  -0.491  -4.431  -1.379
  270    HG   LEU  35           HG       LEU  35   2.279  -5.016  -1.394
  271   1HD1  LEU  35          1HD1      LEU  35   1.893  -5.195  -3.912
  272   2HD1  LEU  35          2HD1      LEU  35   3.098  -4.010  -3.405
  273   3HD1  LEU  35          3HD1      LEU  35   1.483  -3.480  -3.877
  274   1HD2  LEU  35          1HD2      LEU  35   2.426  -2.499  -1.434
  275   2HD2  LEU  35          2HD2      LEU  35   1.286  -3.126  -0.243
  276   3HD2  LEU  35          3HD2      LEU  35   0.694  -2.456  -1.763
  277    H    PHE  36           H        PHE  36  -0.995  -6.053   0.956
  278    HA   PHE  36           HA       PHE  36   1.216  -5.113   2.572
  279   1HB   PHE  36          2HB       PHE  36  -1.605  -5.986   3.225
  280   2HB   PHE  36          1HB       PHE  36  -0.472  -5.442   4.462
  281    HD1  PHE  36           HD1      PHE  36  -0.311  -3.160   4.944
  282    HD2  PHE  36           HD2      PHE  36  -1.862  -4.405   1.137
  283    HE1  PHE  36           HE1      PHE  36  -0.829  -0.801   4.382
  284    HE2  PHE  36           HE2      PHE  36  -2.380  -2.047   0.576
  285    HZ   PHE  36           HZ       PHE  36  -1.865  -0.245   2.199
  286    H    GLY  37           H        GLY  37   2.821  -6.457   3.242
  287   1HA   GLY  37          2HA       GLY  37   3.546  -8.223   4.744
  288   2HA   GLY  37          1HA       GLY  37   2.038  -9.075   4.419
  289    H    ARG  38           H        ARG  38   2.526  -8.377   1.433
  290    HA   ARG  38           HA       ARG  38   4.274 -10.732   0.958
  291   1HB   ARG  38          2HB       ARG  38   3.187 -10.922  -1.171
  292   2HB   ARG  38          1HB       ARG  38   1.923 -10.634   0.019
  293   1HG   ARG  38          2HG       ARG  38   1.819  -8.286  -0.577
  294   2HG   ARG  38          1HG       ARG  38   3.208  -8.456  -1.651
  295   1HD   ARG  38          2HD       ARG  38   1.539 -10.410  -2.607
  296   2HD   ARG  38          1HD       ARG  38   0.384  -9.178  -2.102
  297    HE   ARG  38           HE       ARG  38   1.008  -8.152  -4.130
  298   1HH1  ARG  38          1HH2      ARG  38   3.137 -10.255  -4.734
  299   2HH1  ARG  38          2HH2      ARG  38   4.556  -9.269  -4.847
  300   1HH2  ARG  38          1HH1      ARG  38   3.097  -6.525  -3.311
  301   2HH2  ARG  38          2HH1      ARG  38   4.534  -7.159  -4.041
  302    H    LYS  39           H        LYS  39   6.186 -10.532  -0.160
  303    HA   LYS  39           HA       LYS  39   7.198  -7.819  -0.646
  304   1HB   LYS  39          2HB       LYS  39   8.798  -9.312   0.277
  305   2HB   LYS  39          1HB       LYS  39   8.392 -10.591  -0.865
  306   1HG   LYS  39          2HG       LYS  39   9.343  -9.296  -2.706
  307   2HG   LYS  39          1HG       LYS  39   9.654  -7.937  -1.623
  308   1HD   LYS  39          2HD       LYS  39  10.909 -10.693  -1.468
  309   2HD   LYS  39          1HD       LYS  39  11.721  -9.189  -1.905
  310   1HE   LYS  39          2HE       LYS  39  11.096  -8.288   0.367
  311   2HE   LYS  39          1HE       LYS  39  10.522  -9.903   0.783
  312   1HZ   LYS  39          1HZ       LYS  39  12.962 -10.409  -0.220
  313   2HZ   LYS  39          2HZ       LYS  39  12.620 -10.224   1.434
  314   3HZ   LYS  39          3HZ       LYS  39  13.220  -8.912   0.536
  315    H    THR  40           H        THR  40   8.322  -7.408  -2.812
  316    HA   THR  40           HA       THR  40   6.436  -7.621  -4.941
  317    HB   THR  40           HB       THR  40   9.295  -7.292  -5.670
  318    HG1  THR  40           HG1      THR  40   7.930  -5.396  -4.069
  319   1HG2  THR  40          1HG2      THR  40   7.261  -5.181  -6.093
  320   2HG2  THR  40          2HG2      THR  40   6.919  -6.733  -6.861
  321   3HG2  THR  40          3HG2      THR  40   8.417  -5.876  -7.230
  322    H    GLY  41           H        GLY  41   6.898  -8.718  -7.074
  323   1HA   GLY  41          2HA       GLY  41   7.335 -10.647  -8.327
  324   2HA   GLY  41          1HA       GLY  41   8.709 -10.919  -7.261
  325    H    GLN  42           H        GLN  42   5.360 -11.702  -7.868
  326    HA   GLN  42           HA       GLN  42   5.615 -13.991  -6.018
  327   1HB   GLN  42          2HB       GLN  42   4.349 -11.700  -5.126
  328   2HB   GLN  42          1HB       GLN  42   3.008 -12.671  -5.736
  329   1HG   GLN  42          2HG       GLN  42   3.399 -13.223  -3.390
  330   2HG   GLN  42          1HG       GLN  42   3.843 -14.602  -4.397
  331   1HE2  GLN  42          1HE2      GLN  42   5.745 -11.602  -3.853
  332   2HE2  GLN  42          2HE2      GLN  42   7.074 -12.391  -3.155
  333    H    ALA  43           H        ALA  43   3.408 -12.249  -8.234
  334    HA   ALA  43           HA       ALA  43   1.825 -14.522  -8.918
  335   1HB   ALA  43          1HB       ALA  43   2.451 -11.952 -10.387
  336   2HB   ALA  43          2HB       ALA  43   0.973 -12.380  -9.527
  337   3HB   ALA  43          3HB       ALA  43   1.365 -13.171 -11.053
  338    HA   PRO  44           HA       PRO  44   4.615 -16.780 -11.463
  339   1HB   PRO  44          2HB       PRO  44   2.751 -18.344 -12.739
  340   2HB   PRO  44          1HB       PRO  44   3.262 -18.600 -11.061
  341   1HG   PRO  44          2HG       PRO  44   0.712 -17.445 -12.090
  342   2HG   PRO  44          1HG       PRO  44   1.029 -18.277 -10.559
  343   1HD   PRO  44          2HD       PRO  44   0.786 -15.477 -10.913
  344   2HD   PRO  44          1HD       PRO  44   1.409 -16.300  -9.466
  345    H    GLY  45           H        GLY  45   1.612 -16.044 -13.297
  346   1HA   GLY  45          2HA       GLY  45   3.209 -15.584 -15.728
  347   2HA   GLY  45          1HA       GLY  45   1.447 -15.562 -15.626
  348    H    TYR  46           H        TYR  46   4.031 -13.739 -13.960
  349    HA   TYR  46           HA       TYR  46   3.179 -11.221 -15.190
  350   1HB   TYR  46          2HB       TYR  46   1.516 -11.642 -13.321
  351   2HB   TYR  46          1HB       TYR  46   2.862 -11.579 -12.194
  352    HD1  TYR  46           HD1      TYR  46   4.390  -9.229 -13.668
  353    HD2  TYR  46           HD2      TYR  46   0.309  -9.775 -12.466
  354    HE1  TYR  46           HE1      TYR  46   4.127  -6.801 -13.515
  355    HE2  TYR  46           HE2      TYR  46   0.073  -7.321 -12.304
  356    HH   TYR  46           HH       TYR  46   2.655  -5.130 -13.295
  357    H    SER  47           H        SER  47   5.112 -10.258 -15.539
  358    HA   SER  47           HA       SER  47   7.420 -10.880 -13.816
  359   1HB   SER  47          2HB       SER  47   8.053 -10.641 -16.085
  360   2HB   SER  47          1HB       SER  47   6.995  -9.253 -16.326
  361    HG   SER  47           HG       SER  47   9.117  -9.174 -14.469
  362    H    TYR  48           H        TYR  48   6.072  -9.949 -11.951
  363    HA   TYR  48           HA       TYR  48   5.182  -7.364 -11.580
  364   1HB   TYR  48          2HB       TYR  48   6.455  -9.385  -9.829
  365   2HB   TYR  48          1HB       TYR  48   6.458  -7.742  -9.213
  366    HD1  TYR  48           HD1      TYR  48   3.947  -9.595 -11.265
  367    HD2  TYR  48           HD2      TYR  48   4.827  -7.612  -7.573
  368    HE1  TYR  48           HE1      TYR  48   1.593  -9.913 -10.542
  369    HE2  TYR  48           HE2      TYR  48   2.475  -7.919  -6.842
  370    HH   TYR  48           HH       TYR  48   0.392  -8.483  -7.539
  371    H    THR  49           H        THR  49   6.455  -5.671 -10.112
  372    HA   THR  49           HA       THR  49   8.532  -4.534 -11.685
  373    HB   THR  49           HB       THR  49   8.639  -3.898  -8.809
  374    HG1  THR  49           HG1      THR  49   6.519  -2.864  -9.017
  375   1HG2  THR  49          1HG2      THR  49   9.280  -1.957  -9.740
  376   2HG2  THR  49          2HG2      THR  49   7.692  -1.782 -10.486
  377   3HG2  THR  49          3HG2      THR  49   8.978  -2.635 -11.339
  378    H    ALA  50           H        ALA  50  10.058  -6.216 -12.077
  379    HA   ALA  50           HA       ALA  50  11.309  -7.883 -10.212
  380   1HB   ALA  50          1HB       ALA  50  11.648  -7.940 -12.708
  381   2HB   ALA  50          2HB       ALA  50  13.144  -8.074 -11.783
  382   3HB   ALA  50          3HB       ALA  50  12.711  -6.542 -12.542
  383    H    ALA  51           H        ALA  51  12.089  -4.520 -11.055
  384    HA   ALA  51           HA       ALA  51  14.465  -4.232  -9.581
  385   1HB   ALA  51          1HB       ALA  51  13.600  -1.821  -9.217
  386   2HB   ALA  51          2HB       ALA  51  12.196  -2.326 -10.156
  387   3HB   ALA  51          3HB       ALA  51  13.803  -2.366 -10.880
  388    H    ASN  52           H        ASN  52  11.318  -3.059  -8.324
  389    HA   ASN  52           HA       ASN  52  11.855  -2.805  -5.658
  390   1HB   ASN  52          2HB       ASN  52   9.497  -3.543  -7.209
  391   2HB   ASN  52          1HB       ASN  52   9.455  -4.215  -5.582
  392   1HD2  ASN  52          1HD2      ASN  52  10.738  -2.202  -4.099
  393   2HD2  ASN  52          2HD2      ASN  52   9.839  -0.765  -4.194
  394    H    LYS  53           H        LYS  53  11.036  -5.958  -7.159
  395    HA   LYS  53           HA       LYS  53  11.182  -7.553  -4.851
  396   1HB   LYS  53          2HB       LYS  53  10.617  -8.147  -7.352
  397   2HB   LYS  53          1HB       LYS  53  12.326  -8.578  -7.428
  398   1HG   LYS  53          2HG       LYS  53  10.912  -9.594  -5.043
  399   2HG   LYS  53          1HG       LYS  53  10.354 -10.272  -6.572
  400   1HD   LYS  53          2HD       LYS  53  13.069 -10.342  -6.917
  401   2HD   LYS  53          1HD       LYS  53  12.930 -10.641  -5.183
  402   1HE   LYS  53          2HE       LYS  53  12.395 -12.774  -5.657
  403   2HE   LYS  53          1HE       LYS  53  10.900 -12.184  -6.383
  404   1HZ   LYS  53          1HZ       LYS  53  12.167 -13.511  -7.946
  405   2HZ   LYS  53          2HZ       LYS  53  13.506 -12.481  -7.775
  406   3HZ   LYS  53          3HZ       LYS  53  12.072 -11.903  -8.477
  407    H    ASN  54           H        ASN  54  13.866  -6.729  -7.070
  408    HA   ASN  54           HA       ASN  54  15.843  -8.177  -5.615
  409   1HB   ASN  54          2HB       ASN  54  16.340  -5.698  -7.271
  410   2HB   ASN  54          1HB       ASN  54  17.453  -7.033  -6.972
  411   1HD2  ASN  54          1HD2      ASN  54  17.008  -6.485  -9.627
  412   2HD2  ASN  54          2HD2      ASN  54  15.985  -7.647 -10.325
  413    H    LYS  55           H        LYS  55  14.897  -4.738  -5.489
  414    HA   LYS  55           HA       LYS  55  16.814  -3.792  -3.689
  415   1HB   LYS  55          2HB       LYS  55  14.940  -2.470  -4.788
  416   2HB   LYS  55          1HB       LYS  55  13.875  -3.084  -3.523
  417   1HG   LYS  55          2HG       LYS  55  14.599  -1.454  -2.155
  418   2HG   LYS  55          1HG       LYS  55  16.224  -2.136  -2.238
  419   1HD   LYS  55          2HD       LYS  55  15.099  -0.249  -4.323
  420   2HD   LYS  55          1HD       LYS  55  16.077   0.282  -2.956
  421   1HE   LYS  55          2HE       LYS  55  18.000  -0.775  -3.748
  422   2HE   LYS  55          1HE       LYS  55  17.086  -1.930  -4.718
  423   1HZ   LYS  55          1HZ       LYS  55  16.346   0.117  -6.024
  424   2HZ   LYS  55          2HZ       LYS  55  17.933  -0.441  -6.265
  425   3HZ   LYS  55          3HZ       LYS  55  17.646   0.914  -5.280
  426    H    GLY  56           H        GLY  56  14.284  -6.093  -3.109
  427   1HA   GLY  56          1HA       GLY  56  13.885  -7.399  -1.190
  428   2HA   GLY  56          2HA       GLY  56  15.311  -6.660  -0.459
  429    H    ILE  57           H        ILE  57  12.359  -5.120  -1.715
  430    HA   ILE  57           HA       ILE  57  12.083  -3.748   0.909
  431    HB   ILE  57           HB       ILE  57  12.126  -2.548  -1.408
  432   1HG1  ILE  57          2HG1      ILE  57  11.536  -1.542   0.824
  433   2HG1  ILE  57          1HG1      ILE  57  10.703  -0.797  -0.540
  434   1HG2  ILE  57          1HG2      ILE  57  10.460  -3.946  -2.528
  435   2HG2  ILE  57          2HG2      ILE  57   9.849  -2.296  -2.391
  436   3HG2  ILE  57          3HG2      ILE  57   9.264  -3.547  -1.294
  437   1HD1  ILE  57          1HD1      ILE  57   9.591  -2.262   1.729
  438   2HD1  ILE  57          2HD1      ILE  57   9.017  -2.888   0.184
  439   3HD1  ILE  57          3HD1      ILE  57   8.786  -1.187   0.587
  440    H    ILE  58           H        ILE  58  10.306  -4.053   2.208
  441    HA   ILE  58           HA       ILE  58   8.396  -6.175   1.362
  442    HB   ILE  58           HB       ILE  58   9.329  -6.675   3.495
  443   1HG1  ILE  58          2HG1      ILE  58   7.431  -6.662   4.946
  444   2HG1  ILE  58          1HG1      ILE  58   6.795  -5.187   4.217
  445   1HG2  ILE  58          1HG2      ILE  58   8.988  -4.734   5.306
  446   2HG2  ILE  58          2HG2      ILE  58   9.114  -3.722   3.867
  447   3HG2  ILE  58          3HG2      ILE  58  10.431  -4.814   4.294
  448   1HD1  ILE  58          1HD1      ILE  58   5.826  -7.563   3.535
  449   2HD1  ILE  58          2HD1      ILE  58   7.221  -7.568   2.455
  450   3HD1  ILE  58          3HD1      ILE  58   6.015  -6.286   2.333
  451    H    TRP  59           H        TRP  59   6.557  -5.414   0.466
  452    HA   TRP  59           HA       TRP  59   5.743  -2.710   0.482
  453   1HB   TRP  59          2HB       TRP  59   4.233  -5.265  -0.070
  454   2HB   TRP  59          1HB       TRP  59   3.496  -3.670  -0.258
  455    HD1  TRP  59           HD1      TRP  59   4.853  -6.051  -2.421
  456    HE1  TRP  59           HE1      TRP  59   6.128  -5.030  -4.415
  457    HE3  TRP  59           HE3      TRP  59   5.541  -1.295  -0.687
  458    HZ2  TRP  59           HZ2      TRP  59   7.281  -2.531  -5.167
  459    HZ3  TRP  59           HZ3      TRP  59   6.732   0.383  -2.064
  460    HH2  TRP  59           HH2      TRP  59   7.601  -0.227  -4.301
  461    H    GLY  60           H        GLY  60   5.220  -1.592   2.263
  462   1HA   GLY  60          1HA       GLY  60   3.195  -2.775   4.104
  463   2HA   GLY  60          2HA       GLY  60   4.649  -2.037   4.777
  464    H    GLU  61           H        GLU  61   3.174  -0.497   5.833
  465    HA   GLU  61           HA       GLU  61   1.554   1.305   4.233
  466   1HB   GLU  61          2HB       GLU  61   0.924   0.876   6.540
  467   2HB   GLU  61          1HB       GLU  61   2.496   1.435   7.113
  468   1HG   GLU  61          2HG       GLU  61   1.632   3.572   5.598
  469   2HG   GLU  61          1HG       GLU  61   0.132   2.993   6.324
  470    H    ASP  62           H        ASP  62   4.197   2.224   6.450
  471    HA   ASP  62           HA       ASP  62   4.787   4.646   5.098
  472   1HB   ASP  62          2HB       ASP  62   5.668   3.370   7.410
  473   2HB   ASP  62          1HB       ASP  62   7.113   3.469   6.404
  474    H    THR  63           H        THR  63   6.117   1.382   4.674
  475    HA   THR  63           HA       THR  63   8.290   2.064   2.982
  476    HB   THR  63           HB       THR  63   7.573  -0.339   1.981
  477    HG1  THR  63           HG1      THR  63   6.643  -0.630   4.577
  478   1HG2  THR  63          1HG2      THR  63   8.606  -1.045   4.451
  479   2HG2  THR  63          2HG2      THR  63   9.138   0.625   4.255
  480   3HG2  THR  63          3HG2      THR  63   9.554  -0.580   3.038
  481    H    LEU  64           H        LEU  64   4.898   1.310   2.193
  482    HA   LEU  64           HA       LEU  64   5.238   1.652  -0.652
  483   1HB   LEU  64          2HB       LEU  64   3.251   0.659   0.906
  484   2HB   LEU  64          1HB       LEU  64   2.592   2.252   0.541
  485    HG   LEU  64           HG       LEU  64   3.553   0.204  -1.475
  486   1HD1  LEU  64          1HD1      LEU  64   1.273   0.003  -0.203
  487   2HD1  LEU  64          2HD1      LEU  64   1.299  -0.189  -1.956
  488   3HD1  LEU  64          3HD1      LEU  64   0.781   1.338  -1.243
  489   1HD2  LEU  64          1HD2      LEU  64   2.453   1.935  -3.059
  490   2HD2  LEU  64          2HD2      LEU  64   4.052   2.319  -2.419
  491   3HD2  LEU  64          3HD2      LEU  64   2.618   3.066  -1.714
  492    H    MET  65           H        MET  65   4.753   3.833   2.019
  493    HA   MET  65           HA       MET  65   3.676   6.068   0.643
  494   1HB   MET  65          2HB       MET  65   3.889   5.940   3.112
  495   2HB   MET  65          1HB       MET  65   5.642   6.063   2.954
  496   1HG   MET  65          2HG       MET  65   5.056   8.291   3.329
  497   2HG   MET  65          1HG       MET  65   5.080   8.227   1.567
  498   1HE   MET  65          1HE       MET  65   2.953   7.460   4.641
  499   2HE   MET  65          2HE       MET  65   1.520   8.458   4.411
  500   3HE   MET  65          3HE       MET  65   3.092   9.223   4.629
  501    H    GLU  66           H        GLU  66   7.060   5.081   1.165
  502    HA   GLU  66           HA       GLU  66   8.170   7.321  -0.255
  503   1HB   GLU  66          2HB       GLU  66   9.382   5.824   1.405
  504   2HB   GLU  66          1HB       GLU  66   9.474   4.621   0.119
  505   1HG   GLU  66          2HG       GLU  66  11.312   5.662  -0.656
  506   2HG   GLU  66          1HG       GLU  66  10.307   7.060  -1.037
  507    H    TYR  67           H        TYR  67   7.890   3.870  -1.219
  508    HA   TYR  67           HA       TYR  67   8.762   4.143  -3.870
  509   1HB   TYR  67          2HB       TYR  67   8.287   1.948  -2.934
  510   2HB   TYR  67          1HB       TYR  67   6.576   2.347  -2.779
  511    HD1  TYR  67           HD1      TYR  67   9.167   2.648  -5.498
  512    HD2  TYR  67           HD2      TYR  67   5.236   1.323  -4.379
  513    HE1  TYR  67           HE1      TYR  67   8.764   1.881  -7.817
  514    HE2  TYR  67           HE2      TYR  67   4.834   0.559  -6.701
  515    HH   TYR  67           HH       TYR  67   7.159   0.027  -8.885
  516    H    LEU  68           H        LEU  68   5.686   5.097  -2.470
  517    HA   LEU  68           HA       LEU  68   4.466   5.530  -5.103
  518   1HB   LEU  68          2HB       LEU  68   3.436   5.097  -2.588
  519   2HB   LEU  68          1HB       LEU  68   3.197   6.833  -2.797
  520    HG   LEU  68           HG       LEU  68   2.209   6.318  -5.072
  521   1HD1  LEU  68          1HD1      LEU  68   1.927   3.504  -4.010
  522   2HD1  LEU  68          2HD1      LEU  68   3.287   3.965  -5.033
  523   3HD1  LEU  68          3HD1      LEU  68   1.639   4.092  -5.649
  524   1HD2  LEU  68          1HD2      LEU  68   0.931   6.720  -2.876
  525   2HD2  LEU  68          2HD2      LEU  68   0.705   4.971  -2.820
  526   3HD2  LEU  68          3HD2      LEU  68   0.047   5.903  -4.166
  527    H    GLU  69           H        GLU  69   6.114   7.448  -2.651
  528    HA   GLU  69           HA       GLU  69   5.373  10.035  -3.567
  529   1HB   GLU  69          2HB       GLU  69   6.861   9.220  -1.530
  530   2HB   GLU  69          1HB       GLU  69   8.176   9.456  -2.676
  531   1HG   GLU  69          2HG       GLU  69   8.128  11.639  -2.076
  532   2HG   GLU  69          1HG       GLU  69   6.623  11.744  -2.992
  533    H    ASN  70           H        ASN  70   7.460   7.579  -4.777
  534    HA   ASN  70           HA       ASN  70   7.668   8.779  -7.384
  535   1HB   ASN  70          2HB       ASN  70   9.948   9.104  -5.457
  536   2HB   ASN  70          1HB       ASN  70  10.299   8.832  -7.163
  537   1HD2  ASN  70          1HD2      ASN  70   9.212  10.402  -8.729
  538   2HD2  ASN  70          2HD2      ASN  70   8.933  11.991  -8.204
  539    HA   PRO  71           HA       PRO  71   8.256   4.300  -7.344
  540   1HB   PRO  71          2HB       PRO  71   7.102   3.932  -9.825
  541   2HB   PRO  71          1HB       PRO  71   6.181   4.009  -8.315
  542   1HG   PRO  71          2HG       PRO  71   6.443   6.058 -10.460
  543   2HG   PRO  71          1HG       PRO  71   5.136   5.822  -9.289
  544   1HD   PRO  71          2HD       PRO  71   7.154   7.799  -9.129
  545   2HD   PRO  71          1HD       PRO  71   6.054   7.323  -7.819
  546    H    LYS  72           H        LYS  72   9.021   6.621  -9.902
  547    HA   LYS  72           HA       LYS  72  10.935   4.832 -11.184
  548   1HB   LYS  72          2HB       LYS  72   9.608   6.578 -12.426
  549   2HB   LYS  72          1HB       LYS  72  10.572   7.808 -11.606
  550   1HG   LYS  72          2HG       LYS  72  12.405   5.909 -12.637
  551   2HG   LYS  72          1HG       LYS  72  11.253   6.244 -13.929
  552   1HD   LYS  72          2HD       LYS  72  11.985   8.690 -12.557
  553   2HD   LYS  72          1HD       LYS  72  13.421   7.855 -13.152
  554   1HE   LYS  72          2HE       LYS  72  12.912   8.898 -15.113
  555   2HE   LYS  72          1HE       LYS  72  11.755   7.578 -15.291
  556   1HZ   LYS  72          1HZ       LYS  72  11.292  10.363 -14.492
  557   2HZ   LYS  72          2HZ       LYS  72  10.261   9.159 -13.881
  558   3HZ   LYS  72          3HZ       LYS  72  10.407   9.385 -15.559
  559    H    LYS  73           H        LYS  73  10.984   7.372  -8.764
  560    HA   LYS  73           HA       LYS  73  13.910   7.655  -8.882
  561   1HB   LYS  73          2HB       LYS  73  12.084   8.645  -6.682
  562   2HB   LYS  73          1HB       LYS  73  13.663   9.276  -7.146
  563   1HG   LYS  73          2HG       LYS  73  11.723   9.241  -9.352
  564   2HG   LYS  73          1HG       LYS  73  11.248  10.284  -8.012
  565   1HD   LYS  73          2HD       LYS  73  12.594  11.798  -9.074
  566   2HD   LYS  73          1HD       LYS  73  13.874  10.942  -8.214
  567   1HE   LYS  73          2HE       LYS  73  13.085   9.668 -10.748
  568   2HE   LYS  73          1HE       LYS  73  13.773  11.279 -10.944
  569   1HZ   LYS  73          1HZ       LYS  73  15.019   9.101  -9.356
  570   2HZ   LYS  73          2HZ       LYS  73  15.693  10.623  -9.700
  571   3HZ   LYS  73          3HZ       LYS  73  15.451   9.496 -10.949
  572    H    TYR  74           H        TYR  74  11.510   5.970  -6.924
  573    HA   TYR  74           HA       TYR  74  13.477   5.079  -4.958
  574   1HB   TYR  74          2HB       TYR  74  11.022   5.383  -4.452
  575   2HB   TYR  74          1HB       TYR  74  10.694   3.989  -5.478
  576    HD1  TYR  74           HD1      TYR  74  13.677   4.350  -3.285
  577    HD2  TYR  74           HD2      TYR  74   9.834   2.502  -3.793
  578    HE1  TYR  74           HE1      TYR  74  14.150   2.834  -1.383
  579    HE2  TYR  74           HE2      TYR  74  10.309   0.987  -1.891
  580    HH   TYR  74           HH       TYR  74  12.966   0.190  -0.799
  581    H    ILE  75           H        ILE  75  11.363   3.160  -7.132
  582    HA   ILE  75           HA       ILE  75  13.553   1.183  -7.340
  583    HB   ILE  75           HB       ILE  75  10.744   0.795  -8.336
  584   1HG1  ILE  75          2HG1      ILE  75  10.737   1.759  -5.972
  585   2HG1  ILE  75          1HG1      ILE  75  10.008   0.167  -6.136
  586   1HG2  ILE  75          1HG2      ILE  75  13.129  -0.789  -7.752
  587   2HG2  ILE  75          2HG2      ILE  75  11.734  -1.188  -8.756
  588   3HG2  ILE  75          3HG2      ILE  75  11.671  -1.443  -7.013
  589   1HD1  ILE  75          1HD1      ILE  75  12.016  -0.911  -5.325
  590   2HD1  ILE  75          2HD1      ILE  75  11.577   0.359  -4.181
  591   3HD1  ILE  75          3HD1      ILE  75  12.890   0.622  -5.330
  592    HA   PRO  76           HA       PRO  76  13.941   2.953 -11.471
  593   1HB   PRO  76          2HB       PRO  76  16.410   1.838 -11.942
  594   2HB   PRO  76          1HB       PRO  76  16.176   3.337 -11.026
  595   1HG   PRO  76          2HG       PRO  76  16.852   0.611 -10.021
  596   2HG   PRO  76          1HG       PRO  76  17.216   2.191  -9.307
  597   1HD   PRO  76          2HD       PRO  76  15.149   0.438  -8.488
  598   2HD   PRO  76          1HD       PRO  76  15.318   2.145  -8.020
  599    H    GLY  77           H        GLY  77  12.132   1.174 -11.757
  600   1HA   GLY  77          2HA       GLY  77  12.914  -0.550 -13.920
  601   2HA   GLY  77          1HA       GLY  77  12.687  -1.490 -12.445
  602    H    THR  78           H        THR  78  10.535   0.031 -11.316
  603    HA   THR  78           HA       THR  78   8.271  -1.197 -12.314
  604    HB   THR  78           HB       THR  78   8.392   0.353 -10.288
  605    HG1  THR  78           HG1      THR  78   6.414  -0.412 -10.830
  606   1HG2  THR  78          1HG2      THR  78   8.553   2.598 -10.554
  607   2HG2  THR  78          2HG2      THR  78   7.375   2.604 -11.866
  608   3HG2  THR  78          3HG2      THR  78   9.067   2.239 -12.203
  609    H    LYS  79           H        LYS  79   6.626  -0.631 -13.806
  610    HA   LYS  79           HA       LYS  79   7.575   1.199 -15.971
  611   1HB   LYS  79          2HB       LYS  79   5.506  -0.986 -16.283
  612   2HB   LYS  79          1HB       LYS  79   6.419  -0.161 -17.548
  613   1HG   LYS  79          2HG       LYS  79   7.559  -2.034 -15.453
  614   2HG   LYS  79          1HG       LYS  79   7.363  -2.388 -17.171
  615   1HD   LYS  79          2HD       LYS  79   9.097  -0.178 -16.024
  616   2HD   LYS  79          1HD       LYS  79   9.688  -1.717 -16.655
  617   1HE   LYS  79          2HE       LYS  79   8.103  -0.826 -18.720
  618   2HE   LYS  79          1HE       LYS  79   8.788   0.678 -18.106
  619   1HZ   LYS  79          1HZ       LYS  79  10.458  -1.705 -18.635
  620   2HZ   LYS  79          2HZ       LYS  79  10.955  -0.092 -18.441
  621   3HZ   LYS  79          3HZ       LYS  79  10.119  -0.564 -19.843
  622    H    MET  80           H        MET  80   5.623   1.303 -13.381
  623    HA   MET  80           HA       MET  80   3.240   2.363 -14.744
  624   1HB   MET  80          2HB       MET  80   2.254   2.571 -12.549
  625   2HB   MET  80          1HB       MET  80   3.095   1.039 -12.628
  626   1HG   MET  80          2HG       MET  80   4.935   1.866 -11.384
  627   2HG   MET  80          1HG       MET  80   4.320   3.499 -11.446
  628   1HE   MET  80          1HE       MET  80   1.910   4.162  -9.265
  629   2HE   MET  80          2HE       MET  80   3.427   4.536 -10.079
  630   3HE   MET  80          3HE       MET  80   3.443   4.036  -8.390
  631    H    ILE  81           H        ILE  81   3.188   4.365 -15.471
  632    HA   ILE  81           HA       ILE  81   5.109   6.376 -14.484
  633    HB   ILE  81           HB       ILE  81   4.709   6.157 -16.923
  634   1HG1  ILE  81          2HG1      ILE  81   3.651   8.707 -16.999
  635   2HG1  ILE  81          1HG1      ILE  81   4.294   8.614 -15.359
  636   1HG2  ILE  81          1HG2      ILE  81   2.279   7.359 -17.390
  637   2HG2  ILE  81          2HG2      ILE  81   1.921   6.346 -15.992
  638   3HG2  ILE  81          3HG2      ILE  81   2.570   5.622 -17.463
  639   1HD1  ILE  81          1HD1      ILE  81   5.973   7.626 -17.641
  640   2HD1  ILE  81          2HD1      ILE  81   6.481   8.290 -16.088
  641   3HD1  ILE  81          3HD1      ILE  81   5.861   9.361 -17.345
  642    H    PHE  82           H        PHE  82   3.453   5.732 -12.475
  643    HA   PHE  82           HA       PHE  82   0.971   7.083 -12.280
  644   1HB   PHE  82          2HB       PHE  82   1.760   5.384 -10.678
  645   2HB   PHE  82          1HB       PHE  82   2.992   6.501 -10.098
  646    HD1  PHE  82           HD1      PHE  82  -0.625   6.930 -10.984
  647    HD2  PHE  82           HD2      PHE  82   2.419   7.270  -7.975
  648    HE1  PHE  82           HE1      PHE  82  -2.280   7.912  -9.422
  649    HE2  PHE  82           HE2      PHE  82   0.765   8.254  -6.412
  650    HZ   PHE  82           HZ       PHE  82  -1.581   8.570  -7.137
  651    H    VAL  83           H        VAL  83   0.426   9.119 -11.382
  652    HA   VAL  83           HA       VAL  83   2.338  11.243 -11.930
  653    HB   VAL  83           HB       VAL  83  -0.117  11.823 -10.384
  654   1HG1  VAL  83          1HG1      VAL  83   1.178  13.671 -11.191
  655   2HG1  VAL  83          2HG1      VAL  83  -0.264  13.584 -12.202
  656   3HG1  VAL  83          3HG1      VAL  83   1.276  12.972 -12.807
  657   1HG2  VAL  83          1HG2      VAL  83  -1.384  10.465 -11.703
  658   2HG2  VAL  83          2HG2      VAL  83  -0.091  10.262 -12.885
  659   3HG2  VAL  83          3HG2      VAL  83  -1.116  11.695 -12.937
  660    H    GLY  84           H        GLY  84   3.270  12.661 -10.375
  661   1HA   GLY  84          2HA       GLY  84   4.129  11.443  -7.942
  662   2HA   GLY  84          1HA       GLY  84   4.297  13.155  -8.328
  663    H    ILE  85           H        ILE  85   3.387  11.673  -5.821
  664    HA   ILE  85           HA       ILE  85   0.577  12.248  -5.475
  665    HB   ILE  85           HB       ILE  85   2.846  11.653  -3.570
  666   1HG1  ILE  85          2HG1      ILE  85   0.947   9.756  -3.207
  667   2HG1  ILE  85          1HG1      ILE  85   0.618  10.186  -4.884
  668   1HG2  ILE  85          1HG2      ILE  85  -0.057  12.243  -2.916
  669   2HG2  ILE  85          2HG2      ILE  85   1.347  13.161  -2.377
  670   3HG2  ILE  85          3HG2      ILE  85   1.090  11.519  -1.791
  671   1HD1  ILE  85          1HD1      ILE  85   3.374  10.038  -4.838
  672   2HD1  ILE  85          2HD1      ILE  85   2.298   8.757  -5.396
  673   3HD1  ILE  85          3HD1      ILE  85   2.904   8.742  -3.739
  674    H    LYS  86           H        LYS  86  -0.397  14.066  -4.555
  675    HA   LYS  86           HA       LYS  86   1.404  16.343  -3.851
  676   1HB   LYS  86          2HB       LYS  86  -1.161  16.587  -5.451
  677   2HB   LYS  86          1HB       LYS  86  -0.036  17.886  -5.053
  678   1HG   LYS  86          2HG       LYS  86   1.700  16.885  -6.411
  679   2HG   LYS  86          1HG       LYS  86   0.715  15.447  -6.688
  680   1HD   LYS  86          2HD       LYS  86  -0.358  16.435  -8.405
  681   2HD   LYS  86          1HD       LYS  86  -0.749  17.842  -7.414
  682   1HE   LYS  86          2HE       LYS  86   0.614  18.614  -9.247
  683   2HE   LYS  86          1HE       LYS  86   1.613  18.655  -7.794
  684   1HZ   LYS  86          1HZ       LYS  86   1.770  16.111  -9.012
  685   2HZ   LYS  86          2HZ       LYS  86   3.014  17.228  -8.707
  686   3HZ   LYS  86          3HZ       LYS  86   2.132  17.310 -10.157
  687    H    LYS  87           H        LYS  87  -0.472  14.271  -2.452
  688    HA   LYS  87           HA       LYS  87  -1.477  16.175  -0.471
  689   1HB   LYS  87          2HB       LYS  87  -3.826  15.072  -0.653
  690   2HB   LYS  87          1HB       LYS  87  -3.401  16.325  -1.821
  691   1HG   LYS  87          2HG       LYS  87  -2.641  14.509  -3.387
  692   2HG   LYS  87          1HG       LYS  87  -3.290  13.328  -2.249
  693   1HD   LYS  87          2HD       LYS  87  -5.091  13.621  -3.711
  694   2HD   LYS  87          1HD       LYS  87  -5.478  14.764  -2.425
  695   1HE   LYS  87          2HE       LYS  87  -3.904  16.316  -4.018
  696   2HE   LYS  87          1HE       LYS  87  -4.669  15.279  -5.222
  697   1HZ   LYS  87          1HZ       LYS  87  -5.836  17.312  -3.518
  698   2HZ   LYS  87          2HZ       LYS  87  -6.750  15.887  -3.671
  699   3HZ   LYS  87          3HZ       LYS  87  -6.316  16.776  -5.054
  700    H    LYS  88           H        LYS  88  -0.016  14.936   0.862
  701    HA   LYS  88           HA       LYS  88  -0.015  12.128   1.155
  702   1HB   LYS  88          2HB       LYS  88   0.769  14.433   2.869
  703   2HB   LYS  88          1HB       LYS  88   0.558  12.879   3.676
  704   1HG   LYS  88          2HG       LYS  88   2.177  11.821   2.263
  705   2HG   LYS  88          1HG       LYS  88   2.224  13.206   1.172
  706   1HD   LYS  88          2HD       LYS  88   3.877  14.109   2.398
  707   2HD   LYS  88          1HD       LYS  88   2.802  14.159   3.796
  708   1HE   LYS  88          2HE       LYS  88   3.731  11.456   3.330
  709   2HE   LYS  88          1HE       LYS  88   5.097  12.560   3.492
  710   1HZ   LYS  88          1HZ       LYS  88   4.668  12.077   5.666
  711   2HZ   LYS  88          2HZ       LYS  88   2.995  11.902   5.428
  712   3HZ   LYS  88          3HZ       LYS  88   3.691  13.450   5.479
  713    H    GLU  89           H        GLU  89  -2.267  14.530   2.377
  714    HA   GLU  89           HA       GLU  89  -3.532  13.042   4.415
  715   1HB   GLU  89          2HB       GLU  89  -4.023  15.452   3.066
  716   2HB   GLU  89          1HB       GLU  89  -5.468  14.478   2.794
  717   1HG   GLU  89          2HG       GLU  89  -5.357  13.967   5.330
  718   2HG   GLU  89          1HG       GLU  89  -4.259  15.345   5.417
  719    H    GLU  90           H        GLU  90  -4.396  13.190   0.943
  720    HA   GLU  90           HA       GLU  90  -6.434  11.204   1.068
  721   1HB   GLU  90          2HB       GLU  90  -4.768  12.425  -1.084
  722   2HB   GLU  90          1HB       GLU  90  -5.599  10.915  -1.463
  723   1HG   GLU  90          2HG       GLU  90  -7.635  12.183  -0.281
  724   2HG   GLU  90          1HG       GLU  90  -6.739  13.600  -0.828
  725    H    ARG  91           H        ARG  91  -2.923  10.942   0.737
  726    HA   ARG  91           HA       ARG  91  -2.833   8.198  -0.050
  727   1HB   ARG  91          2HB       ARG  91  -0.839   9.694   1.679
  728   2HB   ARG  91          1HB       ARG  91  -0.529   8.223   0.759
  729   1HG   ARG  91          2HG       ARG  91  -1.381  10.868  -0.455
  730   2HG   ARG  91          1HG       ARG  91   0.277  10.266  -0.419
  731   1HD   ARG  91          2HD       ARG  91  -0.107   8.731  -2.067
  732   2HD   ARG  91          1HD       ARG  91  -1.737   8.381  -1.505
  733    HE   ARG  91           HE       ARG  91  -1.460  11.033  -2.705
  734   1HH1  ARG  91          1HH2      ARG  91  -1.793   7.662  -3.337
  735   2HH1  ARG  91          2HH2      ARG  91  -2.785   7.888  -4.739
  736   1HH2  ARG  91          1HH1      ARG  91  -2.858  11.342  -4.460
  737   2HH2  ARG  91          2HH1      ARG  91  -3.387   9.970  -5.374
  738    H    ALA  92           H        ALA  92  -2.837   9.701   3.193
  739    HA   ALA  92           HA       ALA  92  -2.590   7.318   4.701
  740   1HB   ALA  92          1HB       ALA  92  -4.310   9.707   5.431
  741   2HB   ALA  92          2HB       ALA  92  -2.557   9.667   5.626
  742   3HB   ALA  92          3HB       ALA  92  -3.573   8.551   6.541
  743    H    ASP  93           H        ASP  93  -5.478   8.898   3.345
  744    HA   ASP  93           HA       ASP  93  -7.356   7.021   4.415
  745   1HB   ASP  93          2HB       ASP  93  -7.694   8.509   1.807
  746   2HB   ASP  93          1HB       ASP  93  -8.947   8.012   2.946
  747    H    LEU  94           H        LEU  94  -5.205   6.946   1.667
  748    HA   LEU  94           HA       LEU  94  -6.523   4.853   0.198
  749   1HB   LEU  94          2HB       LEU  94  -3.690   5.889   0.292
  750   2HB   LEU  94          1HB       LEU  94  -4.100   4.469  -0.668
  751    HG   LEU  94           HG       LEU  94  -5.625   7.063  -0.912
  752   1HD1  LEU  94          1HD1      LEU  94  -4.087   6.958  -3.157
  753   2HD1  LEU  94          2HD1      LEU  94  -2.965   6.299  -1.967
  754   3HD1  LEU  94          3HD1      LEU  94  -3.662   7.900  -1.726
  755   1HD2  LEU  94          1HD2      LEU  94  -6.141   6.054  -3.163
  756   2HD2  LEU  94          2HD2      LEU  94  -6.758   5.110  -1.807
  757   3HD2  LEU  94          3HD2      LEU  94  -5.295   4.595  -2.646
  758    H    ILE  95           H        ILE  95  -3.616   4.704   2.278
  759    HA   ILE  95           HA       ILE  95  -3.371   1.920   2.445
  760    HB   ILE  95           HB       ILE  95  -2.977   3.720   4.839
  761   1HG1  ILE  95          2HG1      ILE  95  -1.947   5.001   3.140
  762   2HG1  ILE  95          1HG1      ILE  95  -0.627   4.022   3.780
  763   1HG2  ILE  95          1HG2      ILE  95  -2.518   1.043   4.455
  764   2HG2  ILE  95          2HG2      ILE  95  -1.651   2.047   5.618
  765   3HG2  ILE  95          3HG2      ILE  95  -0.952   1.735   4.028
  766   1HD1  ILE  95          1HD1      ILE  95  -0.316   3.568   1.551
  767   2HD1  ILE  95          2HD1      ILE  95  -2.009   3.855   1.150
  768   3HD1  ILE  95          3HD1      ILE  95  -1.525   2.331   1.892
  769    H    ALA  96           H        ALA  96  -5.602   4.058   4.102
  770    HA   ALA  96           HA       ALA  96  -6.544   2.271   6.095
  771   1HB   ALA  96          1HB       ALA  96  -7.438   4.775   4.872
  772   2HB   ALA  96          2HB       ALA  96  -7.558   4.238   6.547
  773   3HB   ALA  96          3HB       ALA  96  -8.778   3.742   5.373
  774    H    TYR  97           H        TYR  97  -7.821   2.841   2.795
  775    HA   TYR  97           HA       TYR  97  -9.886   0.881   2.989
  776   1HB   TYR  97          2HB       TYR  97 -10.018   2.504   1.222
  777   2HB   TYR  97          1HB       TYR  97  -8.434   2.039   0.598
  778    HD1  TYR  97           HD1      TYR  97  -8.562   0.846  -1.395
  779    HD2  TYR  97           HD2      TYR  97 -11.537   0.187   1.632
  780    HE1  TYR  97           HE1      TYR  97  -9.622  -0.889  -2.815
  781    HE2  TYR  97           HE2      TYR  97 -12.599  -1.546   0.212
  782    HH   TYR  97           HH       TYR  97 -11.869  -1.934  -3.067
  783    H    LEU  98           H        LEU  98  -6.628   0.683   1.530
  784    HA   LEU  98           HA       LEU  98  -6.828  -2.089   0.849
  785   1HB   LEU  98          2HB       LEU  98  -4.628  -0.091   1.090
  786   2HB   LEU  98          1HB       LEU  98  -4.170  -1.792   1.122
  787    HG   LEU  98           HG       LEU  98  -4.121  -1.039  -1.183
  788   1HD1  LEU  98          1HD1      LEU  98  -5.115  -2.925  -1.942
  789   2HD1  LEU  98          2HD1      LEU  98  -6.703  -2.412  -1.373
  790   3HD1  LEU  98          3HD1      LEU  98  -5.584  -3.203  -0.264
  791   1HD2  LEU  98          1HD2      LEU  98  -6.754  -0.476  -1.877
  792   2HD2  LEU  98          2HD2      LEU  98  -5.466   0.713  -1.682
  793   3HD2  LEU  98          3HD2      LEU  98  -6.550   0.358  -0.338
  794    H    LYS  99           H        LYS  99  -6.345  -0.512   3.882
  795    HA   LYS  99           HA       LYS  99  -5.015  -2.782   5.134
  796   1HB   LYS  99          2HB       LYS  99  -5.637  -0.063   5.860
  797   2HB   LYS  99          1HB       LYS  99  -6.197  -1.157   7.124
  798   1HG   LYS  99          2HG       LYS  99  -3.983  -2.207   7.234
  799   2HG   LYS  99          1HG       LYS  99  -3.408  -1.164   5.932
  800   1HD   LYS  99          2HD       LYS  99  -3.325   0.709   7.279
  801   2HD   LYS  99          1HD       LYS  99  -4.632   0.146   8.321
  802   1HE   LYS  99          2HE       LYS  99  -2.954  -1.715   9.032
  803   2HE   LYS  99          1HE       LYS  99  -1.726  -0.648   8.352
  804   1HZ   LYS  99          1HZ       LYS  99  -2.504  -0.465  10.850
  805   2HZ   LYS  99          2HZ       LYS  99  -3.691   0.535  10.160
  806   3HZ   LYS  99          3HZ       LYS  99  -2.045   0.900   9.957
  807    H    LYS 100           H        LYS 100  -8.266  -1.699   4.574
  808    HA   LYS 100           HA       LYS 100  -9.491  -3.421   6.586
  809   1HB   LYS 100          2HB       LYS 100 -10.780  -1.525   6.003
  810   2HB   LYS 100          1HB       LYS 100 -10.514  -1.768   4.278
  811   1HG   LYS 100          2HG       LYS 100 -12.810  -2.423   4.954
  812   2HG   LYS 100          1HG       LYS 100 -11.898  -3.795   4.328
  813   1HD   LYS 100          2HD       LYS 100 -11.368  -4.504   6.628
  814   2HD   LYS 100          1HD       LYS 100 -12.271  -3.127   7.262
  815   1HE   LYS 100          2HE       LYS 100 -14.151  -4.357   7.171
  816   2HE   LYS 100          1HE       LYS 100 -13.980  -4.438   5.417
  817   1HZ   LYS 100          1HZ       LYS 100 -14.046  -6.647   6.265
  818   2HZ   LYS 100          2HZ       LYS 100 -12.842  -6.313   7.416
  819   3HZ   LYS 100          3HZ       LYS 100 -12.455  -6.343   5.763
  820    H    ALA 101           H        ALA 101  -8.839  -3.594   3.111
  821    HA   ALA 101           HA       ALA 101 -10.129  -6.222   2.936
  822   1HB   ALA 101          1HB       ALA 101  -8.613  -4.741   0.781
  823   2HB   ALA 101          2HB       ALA 101 -10.322  -4.476   1.123
  824   3HB   ALA 101          3HB       ALA 101  -9.769  -6.054   0.562
  825    H    THR 102           H        THR 102  -6.863  -4.922   2.200
  826    HA   THR 102           HA       THR 102  -5.806  -7.678   2.245
  827    HB   THR 102           HB       THR 102  -3.829  -6.760   1.281
  828    HG1  THR 102           HG1      THR 102  -3.987  -4.272   1.114
  829   1HG2  THR 102          1HG2      THR 102  -4.675  -5.749  -0.690
  830   2HG2  THR 102          2HG2      THR 102  -6.017  -5.003   0.177
  831   3HG2  THR 102          3HG2      THR 102  -6.000  -6.745  -0.090
  832    H    ASN 103           H        ASN 103  -6.600  -5.907   4.739
  833    HA   ASN 103           HA       ASN 103  -4.380  -6.901   6.348
  834   1HB   ASN 103          2HB       ASN 103  -3.739  -4.561   5.446
  835   2HB   ASN 103          1HB       ASN 103  -4.960  -3.953   6.562
  836   1HD2  ASN 103          1HD2      ASN 103  -2.131  -3.395   6.869
  837   2HD2  ASN 103          2HD2      ASN 103  -1.615  -4.135   8.307
  838    H    GLU 104           HN       GLU 104  -7.329  -7.229   6.126
  839    HA   GLU 104           HA       GLU 104  -7.895  -7.065   8.988
  840   1HB   GLU 104          2HB       GLU 104  -8.654  -4.879   7.391
  841   2HB   GLU 104          1HB       GLU 104 -10.130  -5.810   7.638
  842   1HG   GLU 104          2HG       GLU 104  -8.823  -5.807  10.133
  843   2HG   GLU 104          1HG       GLU 104  -8.683  -4.156   9.528
  844    HHA  HEC 105           HHA      HEC 105   4.307  -2.785  -9.334
  845    HHB  HEC 105           HHB      HEC 105   1.570   1.074  -5.135
  846    HHC  HEC 105           HHC      HEC 105  -1.640   3.881  -9.807
  847    HHD  HEC 105           HHD      HEC 105   0.995  -0.063 -13.970
  848   1HMA  HEC 105          1HMA      HEC 105   4.316  -0.363  -4.333
  849   2HMA  HEC 105          2HMA      HEC 105   3.472  -1.907  -4.209
  850   3HMA  HEC 105          3HMA      HEC 105   2.571  -0.396  -4.078
  851   1HAA  HEC 105          1HAA      HEC 105   5.386  -2.505  -5.874
  852   2HAA  HEC 105          2HAA      HEC 105   5.311  -2.992  -7.555
  853   1HBA  HEC 105          1HBA      HEC 105   3.086  -4.194  -6.766
  854   2HBA  HEC 105          2HBA      HEC 105   3.873  -4.117  -5.189
  855   1HMB  HEC 105          1HMB      HEC 105  -1.302   2.809  -4.512
  856   2HMB  HEC 105          2HMB      HEC 105  -0.118   4.105  -4.652
  857   3HMB  HEC 105          3HMB      HEC 105   0.413   2.466  -4.287
  858    HAB  HEC 105           HAB      HEC 105  -2.028   4.949  -8.109
  859   1HBB  HEC 105          1HBB      HEC 105  -0.351   5.742  -6.303
  860   2HBB  HEC 105          2HBB      HEC 105  -1.669   5.342  -5.203
  861   3HBB  HEC 105          3HBB      HEC 105  -1.923   6.515  -6.495
  862   1HMC  HEC 105          1HMC      HEC 105  -2.523   4.222 -11.575
  863   2HMC  HEC 105          2HMC      HEC 105  -1.652   4.632 -13.053
  864   3HMC  HEC 105          3HMC      HEC 105  -2.929   3.415 -13.090
  865    HAC  HEC 105           HAC      HEC 105   0.046   1.567 -15.073
  866   1HBC  HEC 105          1HBC      HEC 105  -2.427   3.178 -15.062
  867   2HBC  HEC 105          2HBC      HEC 105  -1.074   3.156 -16.194
  868   3HBC  HEC 105          3HBC      HEC 105  -0.904   3.957 -14.632
  869   1HMD  HEC 105          1HMD      HEC 105   3.335  -1.269 -14.789
  870   2HMD  HEC 105          2HMD      HEC 105   3.341  -2.994 -14.417
  871   3HMD  HEC 105          3HMD      HEC 105   1.813  -2.151 -14.668
  872   1HAD  HEC 105          1HAD      HEC 105   4.299  -4.109 -11.099
  873   2HAD  HEC 105          2HAD      HEC 105   4.129  -4.052 -12.847
  874   1HBD  HEC 105          1HBD      HEC 105   6.483  -3.706 -11.548
  875   2HBD  HEC 105          2HBD      HEC 105   5.953  -2.032 -11.692
  Start of MODEL    2
    1   1H    GLY   1          1HT       GLY   1  -9.518   5.735   8.457
    2   2H    GLY   1          2HT       GLY   1  -9.377   6.966   7.293
    3   3H    GLY   1          3HT       GLY   1 -10.414   5.648   7.019
    4   1HA   GLY   1          1HA       GLY   1 -11.100   6.891   9.462
    5   2HA   GLY   1          2HA       GLY   1 -11.059   8.085   8.163
    6    H    ASP   2           H        ASP   2 -12.124   7.209   6.043
    7    HA   ASP   2           HA       ASP   2 -14.652   5.807   6.817
    8   1HB   ASP   2          2HB       ASP   2 -14.206   7.796   4.570
    9   2HB   ASP   2          1HB       ASP   2 -15.746   7.063   5.021
   10    H    VAL   3           H        VAL   3 -15.627   4.507   5.016
   11    HA   VAL   3           HA       VAL   3 -13.480   3.049   3.584
   12    HB   VAL   3           HB       VAL   3 -15.193   1.814   4.945
   13   1HG1  VAL   3          1HG1      VAL   3 -17.092   3.330   4.381
   14   2HG1  VAL   3          2HG1      VAL   3 -17.469   1.635   4.077
   15   3HG1  VAL   3          3HG1      VAL   3 -17.068   2.704   2.733
   16   1HG2  VAL   3          1HG2      VAL   3 -15.292   1.241   1.966
   17   2HG2  VAL   3          2HG2      VAL   3 -15.581   0.083   3.264
   18   3HG2  VAL   3          3HG2      VAL   3 -13.972   0.766   3.033
   19    H    GLU   4           H        GLU   4 -16.421   4.918   2.946
   20    HA   GLU   4           HA       GLU   4 -16.406   4.431   0.089
   21   1HB   GLU   4          2HB       GLU   4 -17.826   6.304   1.944
   22   2HB   GLU   4          1HB       GLU   4 -17.824   6.673   0.220
   23   1HG   GLU   4          2HG       GLU   4 -18.511   3.901   1.157
   24   2HG   GLU   4          1HG       GLU   4 -19.734   5.171   1.190
   25    H    LYS   5           H        LYS   5 -14.360   6.222   2.074
   26    HA   LYS   5           HA       LYS   5 -13.814   8.304   0.041
   27   1HB   LYS   5          2HB       LYS   5 -13.587   8.170   2.854
   28   2HB   LYS   5          1HB       LYS   5 -11.939   8.279   2.235
   29   1HG   LYS   5          2HG       LYS   5 -13.248  10.106   0.656
   30   2HG   LYS   5          1HG       LYS   5 -14.093  10.287   2.194
   31   1HD   LYS   5          2HD       LYS   5 -11.113  10.129   2.264
   32   2HD   LYS   5          1HD       LYS   5 -11.840  11.626   1.679
   33   1HE   LYS   5          2HE       LYS   5 -13.191  10.659   4.066
   34   2HE   LYS   5          1HE       LYS   5 -11.468  10.899   4.356
   35   1HZ   LYS   5          1HZ       LYS   5 -13.516  12.853   3.586
   36   2HZ   LYS   5          2HZ       LYS   5 -11.919  13.102   3.060
   37   3HZ   LYS   5          3HZ       LYS   5 -12.261  12.992   4.720
   38    H    GLY   6           H        GLY   6 -11.912   5.832   1.820
   39   1HA   GLY   6          1HA       GLY   6  -9.616   6.066   0.112
   40   2HA   GLY   6          2HA       GLY   6  -9.950   4.708   1.189
   41    H    LYS   7           H        LYS   7 -12.280   3.685   0.193
   42    HA   LYS   7           HA       LYS   7 -11.414   2.205  -2.092
   43   1HB   LYS   7          2HB       LYS   7 -13.133   1.394  -0.496
   44   2HB   LYS   7          1HB       LYS   7 -14.241   2.637  -1.074
   45   1HG   LYS   7          2HG       LYS   7 -13.346   1.375  -3.403
   46   2HG   LYS   7          1HG       LYS   7 -13.588   0.057  -2.256
   47   1HD   LYS   7          2HD       LYS   7 -15.822   1.527  -1.774
   48   2HD   LYS   7          1HD       LYS   7 -15.580   1.877  -3.484
   49   1HE   LYS   7          2HE       LYS   7 -15.847  -0.350  -4.118
   50   2HE   LYS   7          1HE       LYS   7 -15.374  -0.960  -2.532
   51   1HZ   LYS   7          1HZ       LYS   7 -17.573  -1.206  -2.268
   52   2HZ   LYS   7          2HZ       LYS   7 -17.964  -0.084  -3.482
   53   3HZ   LYS   7          3HZ       LYS   7 -17.555   0.455  -1.923
   54    H    LYS   8           H        LYS   8 -12.675   5.361  -1.821
   55    HA   LYS   8           HA       LYS   8 -13.863   5.398  -4.512
   56   1HB   LYS   8          2HB       LYS   8 -13.832   7.143  -2.176
   57   2HB   LYS   8          1HB       LYS   8 -13.527   8.039  -3.665
   58   1HG   LYS   8          2HG       LYS   8 -15.742   6.015  -3.613
   59   2HG   LYS   8          1HG       LYS   8 -16.009   7.597  -2.879
   60   1HD   LYS   8          2HD       LYS   8 -15.673   8.735  -4.916
   61   2HD   LYS   8          1HD       LYS   8 -14.856   7.357  -5.654
   62   1HE   LYS   8          2HE       LYS   8 -17.171   6.153  -5.233
   63   2HE   LYS   8          1HE       LYS   8 -17.788   7.805  -5.213
   64   1HZ   LYS   8          1HZ       LYS   8 -17.825   6.819  -7.438
   65   2HZ   LYS   8          2HZ       LYS   8 -16.137   6.630  -7.385
   66   3HZ   LYS   8          3HZ       LYS   8 -16.823   8.186  -7.370
   67    H    ILE   9           H        ILE   9 -11.109   7.037  -2.905
   68    HA   ILE   9           HA       ILE   9 -10.009   8.196  -5.245
   69    HB   ILE   9           HB       ILE   9  -8.502   7.144  -2.832
   70   1HG1  ILE   9          2HG1      ILE   9  -9.592   9.929  -3.322
   71   2HG1  ILE   9          1HG1      ILE   9 -10.434   8.719  -2.352
   72   1HG2  ILE   9          1HG2      ILE   9  -7.844   9.186  -4.971
   73   2HG2  ILE   9          2HG2      ILE   9  -6.973   7.694  -4.612
   74   3HG2  ILE   9          3HG2      ILE   9  -6.938   9.032  -3.465
   75   1HD1  ILE   9          1HD1      ILE   9  -8.709  10.469  -1.265
   76   2HD1  ILE   9          2HD1      ILE   9  -7.565   9.203  -1.710
   77   3HD1  ILE   9          3HD1      ILE   9  -8.911   8.835  -0.632
   78    H    PHE  10           H        PHE  10  -9.102   5.103  -3.671
   79    HA   PHE  10           HA       PHE  10  -7.277   4.280  -5.694
   80   1HB   PHE  10          2HB       PHE  10  -7.496   3.206  -3.444
   81   2HB   PHE  10          1HB       PHE  10  -9.020   2.493  -3.972
   82    HD1  PHE  10           HD1      PHE  10  -8.933   1.167  -6.245
   83    HD2  PHE  10           HD2      PHE  10  -5.504   2.032  -3.806
   84    HE1  PHE  10           HE1      PHE  10  -7.695  -0.687  -7.330
   85    HE2  PHE  10           HE2      PHE  10  -4.265   0.177  -4.892
   86    HZ   PHE  10           HZ       PHE  10  -5.361  -1.182  -6.653
   87    H    ILE  11           H        ILE  11 -10.785   3.719  -5.356
   88    HA   ILE  11           HA       ILE  11 -11.091   1.990  -7.583
   89    HB   ILE  11           HB       ILE  11 -12.903   3.876  -6.116
   90   1HG1  ILE  11          2HG1      ILE  11 -13.010   0.916  -6.783
   91   2HG1  ILE  11          1HG1      ILE  11 -12.439   1.601  -5.261
   92   1HG2  ILE  11          1HG2      ILE  11 -14.777   3.215  -7.608
   93   2HG2  ILE  11          2HG2      ILE  11 -13.624   2.429  -8.686
   94   3HG2  ILE  11          3HG2      ILE  11 -13.572   4.178  -8.463
   95   1HD1  ILE  11          1HD1      ILE  11 -15.237   1.829  -6.406
   96   2HD1  ILE  11          2HD1      ILE  11 -14.685   2.663  -4.953
   97   3HD1  ILE  11          3HD1      ILE  11 -14.754   0.901  -4.985
   98    H    MET  12           H        MET  12 -10.501   5.427  -7.433
   99    HA   MET  12           HA       MET  12 -10.791   5.527 -10.411
  100   1HB   MET  12          2HB       MET  12 -11.558   7.779 -10.273
  101   2HB   MET  12          1HB       MET  12 -12.468   6.898  -9.045
  102   1HG   MET  12          2HG       MET  12 -10.681   7.611  -7.378
  103   2HG   MET  12          1HG       MET  12 -10.068   8.694  -8.628
  104   1HE   MET  12          1HE       MET  12 -10.499  10.574  -9.021
  105   2HE   MET  12          2HE       MET  12 -10.891  11.379  -7.503
  106   3HE   MET  12          3HE       MET  12 -11.974  11.538  -8.884
  107    H    LYS  13           H        LYS  13  -8.436   5.074  -8.409
  108    HA   LYS  13           HA       LYS  13  -6.675   7.133  -9.674
  109   1HB   LYS  13          2HB       LYS  13  -7.139   7.374  -7.135
  110   2HB   LYS  13          1HB       LYS  13  -6.105   5.956  -6.957
  111   1HG   LYS  13          2HG       LYS  13  -4.616   7.785  -6.749
  112   2HG   LYS  13          1HG       LYS  13  -4.406   7.246  -8.415
  113   1HD   LYS  13          2HD       LYS  13  -5.097   9.237  -9.205
  114   2HD   LYS  13          1HD       LYS  13  -6.581   9.145  -8.256
  115   1HE   LYS  13          2HE       LYS  13  -4.332   9.690  -6.524
  116   2HE   LYS  13          1HE       LYS  13  -4.391  10.875  -7.828
  117   1HZ   LYS  13          1HZ       LYS  13  -6.224  10.451  -5.634
  118   2HZ   LYS  13          2HZ       LYS  13  -6.974  10.687  -7.140
  119   3HZ   LYS  13          3HZ       LYS  13  -5.905  11.856  -6.526
  120    H    CYS  14           H        CYS  14  -6.707   3.897  -8.126
  121    HA   CYS  14           HA       CYS  14  -4.687   3.076 -10.167
  122   1HB   CYS  14          2HB       CYS  14  -4.377   1.635  -7.640
  123   2HB   CYS  14          1HB       CYS  14  -3.151   2.414  -8.633
  124    H    SER  15           H        SER  15  -7.699   2.698  -9.652
  125    HA   SER  15           HA       SER  15  -7.894  -0.203  -9.202
  126   1HB   SER  15          2HB       SER  15  -9.621   1.701  -8.604
  127   2HB   SER  15          1HB       SER  15 -10.153   1.456 -10.262
  128    HG   SER  15           HG       SER  15 -10.225  -0.843  -9.669
  129    H    GLN  16           H        GLN  16  -6.729   1.436 -11.696
  130    HA   GLN  16           HA       GLN  16  -8.182  -0.078 -13.806
  131   1HB   GLN  16          2HB       GLN  16  -6.381   2.333 -13.804
  132   2HB   GLN  16          1HB       GLN  16  -6.559   1.379 -15.277
  133   1HG   GLN  16          2HG       GLN  16  -9.168   1.747 -14.221
  134   2HG   GLN  16          1HG       GLN  16  -8.371   3.320 -14.174
  135   1HE2  GLN  16          1HE2      GLN  16 -10.378   3.240 -15.996
  136   2HE2  GLN  16          2HE2      GLN  16  -9.789   3.066 -17.578
  137    H    CYS  17           H        CYS  17  -4.937   0.540 -12.510
  138    HA   CYS  17           HA       CYS  17  -3.861  -1.721 -14.090
  139   1HB   CYS  17          2HB       CYS  17  -2.616   0.433 -12.373
  140   2HB   CYS  17          1HB       CYS  17  -1.688  -0.975 -12.888
  141    H    HIS  18           H        HIS  18  -4.817  -0.848 -10.833
  142    HA   HIS  18           HA       HIS  18  -3.907  -3.538  -9.886
  143   1HB   HIS  18          2HB       HIS  18  -4.485  -1.011  -8.316
  144   2HB   HIS  18          1HB       HIS  18  -4.108  -2.571  -7.589
  145    HD1  HIS  18           HD1      HIS  18  -1.663  -3.298  -7.552
  146    HD2  HIS  18           HD2      HIS  18  -2.291   0.163  -9.777
  147    HE1  HIS  18           HE1      HIS  18   0.633  -2.346  -8.061
  148    H    THR  19           H        THR  19  -5.880  -4.516 -10.759
  149    HA   THR  19           HA       THR  19  -8.473  -3.608  -9.758
  150    HB   THR  19           HB       THR  19  -9.393  -5.468 -10.973
  151    HG1  THR  19           HG1      THR  19  -8.352  -7.271 -11.074
  152   1HG2  THR  19          1HG2      THR  19  -6.939  -4.684 -12.551
  153   2HG2  THR  19          2HG2      THR  19  -8.288  -3.579 -12.290
  154   3HG2  THR  19          3HG2      THR  19  -8.541  -5.088 -13.167
  155    H    VAL  20           H        VAL  20  -8.003  -3.674  -7.459
  156    HA   VAL  20           HA       VAL  20  -7.324  -6.237  -6.216
  157    HB   VAL  20           HB       VAL  20  -7.260  -5.020  -4.168
  158   1HG1  VAL  20          1HG1      VAL  20  -5.432  -3.883  -4.820
  159   2HG1  VAL  20          2HG1      VAL  20  -6.437  -2.654  -5.587
  160   3HG1  VAL  20          3HG1      VAL  20  -5.945  -4.082  -6.496
  161   1HG2  VAL  20          1HG2      VAL  20  -8.972  -3.009  -5.645
  162   2HG2  VAL  20          2HG2      VAL  20  -8.161  -2.626  -4.127
  163   3HG2  VAL  20          3HG2      VAL  20  -9.378  -3.902  -4.181
  164    H    GLU  21           H        GLU  21  -9.888  -6.108  -7.728
  165    HA   GLU  21           HA       GLU  21 -11.552  -7.308  -5.652
  166   1HB   GLU  21          2HB       GLU  21 -12.035  -4.553  -6.614
  167   2HB   GLU  21          1HB       GLU  21 -13.452  -5.606  -6.609
  168   1HG   GLU  21          2HG       GLU  21 -11.928  -5.988  -4.184
  169   2HG   GLU  21          1HG       GLU  21 -12.313  -4.280  -4.393
  170    H    LYS  22           H        LYS  22 -10.323  -7.793  -8.409
  171    HA   LYS  22           HA       LYS  22 -12.801  -8.388  -9.945
  172   1HB   LYS  22          2HB       LYS  22 -10.716  -7.231 -10.965
  173   2HB   LYS  22          1HB       LYS  22  -9.978  -8.832 -10.915
  174   1HG   LYS  22          2HG       LYS  22 -12.271  -9.547 -12.057
  175   2HG   LYS  22          1HG       LYS  22 -12.276  -7.856 -12.563
  176   1HD   LYS  22          2HD       LYS  22  -9.927  -9.725 -12.977
  177   2HD   LYS  22          1HD       LYS  22 -11.155  -9.406 -14.203
  178   1HE   LYS  22          2HE       LYS  22 -10.456  -6.863 -13.403
  179   2HE   LYS  22          1HE       LYS  22  -8.916  -7.720 -13.315
  180   1HZ   LYS  22          1HZ       LYS  22  -9.547  -8.613 -15.601
  181   2HZ   LYS  22          2HZ       LYS  22  -9.044  -6.993 -15.503
  182   3HZ   LYS  22          3HZ       LYS  22 -10.696  -7.365 -15.646
  183    H    GLY  23           H        GLY  23 -11.135  -9.860  -7.589
  184   1HA   GLY  23          2HA       GLY  23 -11.836 -12.206  -7.102
  185   2HA   GLY  23          1HA       GLY  23 -11.544 -12.563  -8.804
  186    H    GLY  24           H        GLY  24  -9.078 -10.745  -8.620
  187   1HA   GLY  24          1HA       GLY  24  -6.999 -11.054  -7.157
  188   2HA   GLY  24          2HA       GLY  24  -7.315 -12.782  -7.319
  189    H    LYS  25           H        LYS  25  -8.264 -11.724 -10.209
  190    HA   LYS  25           HA       LYS  25  -5.775 -12.522 -11.507
  191   1HB   LYS  25          2HB       LYS  25  -8.191 -12.959 -12.329
  192   2HB   LYS  25          1HB       LYS  25  -8.153 -11.291 -12.900
  193   1HG   LYS  25          2HG       LYS  25  -7.081 -11.997 -14.746
  194   2HG   LYS  25          1HG       LYS  25  -5.715 -12.455 -13.730
  195   1HD   LYS  25          2HD       LYS  25  -7.738 -14.456 -13.445
  196   2HD   LYS  25          1HD       LYS  25  -7.489 -14.169 -15.167
  197   1HE   LYS  25          2HE       LYS  25  -5.284 -14.861 -15.110
  198   2HE   LYS  25          1HE       LYS  25  -5.073 -14.393 -13.423
  199   1HZ   LYS  25          1HZ       LYS  25  -6.101 -16.865 -14.547
  200   2HZ   LYS  25          2HZ       LYS  25  -6.911 -16.287 -13.170
  201   3HZ   LYS  25          3HZ       LYS  25  -5.242 -16.601 -13.109
  202    H    HIS  26           H        HIS  26  -4.338 -11.173 -12.611
  203    HA   HIS  26           HA       HIS  26  -4.883  -8.243 -12.435
  204   1HB   HIS  26          2HB       HIS  26  -2.267  -8.156 -12.236
  205   2HB   HIS  26          1HB       HIS  26  -3.234  -8.488 -10.801
  206    HD1  HIS  26           HD1      HIS  26  -2.564 -11.030 -13.520
  207    HD2  HIS  26           HD2      HIS  26  -1.390 -10.254  -9.594
  208    HE1  HIS  26           HE1      HIS  26  -1.251 -13.055 -12.751
  209    H    LYS  27           H        LYS  27  -3.274  -7.042 -13.974
  210    HA   LYS  27           HA       LYS  27  -2.514  -8.604 -16.335
  211   1HB   LYS  27          2HB       LYS  27  -4.998  -7.222 -16.228
  212   2HB   LYS  27          1HB       LYS  27  -3.937  -6.304 -17.297
  213   1HG   LYS  27          2HG       LYS  27  -3.536  -8.218 -18.688
  214   2HG   LYS  27          1HG       LYS  27  -4.300  -9.301 -17.524
  215   1HD   LYS  27          2HD       LYS  27  -6.437  -7.948 -17.866
  216   2HD   LYS  27          1HD       LYS  27  -5.628  -7.194 -19.241
  217   1HE   LYS  27          2HE       LYS  27  -5.674 -10.188 -19.021
  218   2HE   LYS  27          1HE       LYS  27  -7.101  -9.343 -19.617
  219   1HZ   LYS  27          1HZ       LYS  27  -5.426  -8.146 -21.131
  220   2HZ   LYS  27          2HZ       LYS  27  -5.888  -9.734 -21.525
  221   3HZ   LYS  27          3HZ       LYS  27  -4.392  -9.443 -20.773
  222    H    THR  28           H        THR  28  -3.139  -5.127 -15.777
  223    HA   THR  28           HA       THR  28  -0.428  -4.522 -16.753
  224    HB   THR  28           HB       THR  28  -2.746  -2.788 -15.861
  225    HG1  THR  28           HG1      THR  28  -2.959  -2.437 -17.984
  226   1HG2  THR  28          1HG2      THR  28   0.074  -2.049 -16.656
  227   2HG2  THR  28          2HG2      THR  28  -0.808  -1.564 -15.209
  228   3HG2  THR  28          3HG2      THR  28  -1.270  -0.914 -16.782
  229    H    GLY  29           H        GLY  29  -2.287  -3.785 -13.778
  230   1HA   GLY  29          2HA       GLY  29   0.274  -3.320 -12.350
  231   2HA   GLY  29          1HA       GLY  29  -1.324  -2.921 -11.735
  232    HA   PRO  30           HA       PRO  30   0.172  -7.294 -10.469
  233   1HB   PRO  30          2HB       PRO  30   1.328  -6.727  -8.047
  234   2HB   PRO  30          1HB       PRO  30   2.231  -6.863  -9.560
  235   1HG   PRO  30          2HG       PRO  30   1.414  -4.387  -8.080
  236   2HG   PRO  30          1HG       PRO  30   2.862  -4.687  -9.059
  237   1HD   PRO  30          2HD       PRO  30   0.652  -3.253  -9.957
  238   2HD   PRO  30          1HD       PRO  30   1.822  -4.066 -11.015
  239    H    ASN  31           H        ASN  31  -1.487  -8.363  -9.574
  240    HA   ASN  31           HA       ASN  31  -3.787  -7.263  -8.514
  241   1HB   ASN  31          2HB       ASN  31  -3.526  -9.667  -9.075
  242   2HB   ASN  31          1HB       ASN  31  -2.562  -9.887  -7.613
  243   1HD2  ASN  31          1HD2      ASN  31  -5.690  -8.220  -8.356
  244   2HD2  ASN  31          2HD2      ASN  31  -6.533  -8.923  -7.063
  245    H    LEU  32           H        LEU  32  -3.597  -5.634  -7.010
  246    HA   LEU  32           HA       LEU  32  -1.900  -5.916  -4.656
  247   1HB   LEU  32          2HB       LEU  32  -3.365  -3.796  -5.997
  248   2HB   LEU  32          1HB       LEU  32  -3.657  -3.764  -4.261
  249    HG   LEU  32           HG       LEU  32  -1.390  -3.416  -3.756
  250   1HD1  LEU  32          1HD1      LEU  32  -0.974  -4.941  -6.225
  251   2HD1  LEU  32          2HD1      LEU  32   0.050  -4.820  -4.796
  252   3HD1  LEU  32          3HD1      LEU  32   0.141  -3.587  -6.053
  253   1HD2  LEU  32          1HD2      LEU  32  -0.671  -1.843  -5.877
  254   2HD2  LEU  32          2HD2      LEU  32  -1.756  -1.328  -4.585
  255   3HD2  LEU  32          3HD2      LEU  32  -2.417  -1.944  -6.101
  256    H    HIS  33           H        HIS  33  -3.854  -8.004  -4.805
  257    HA   HIS  33           HA       HIS  33  -6.031  -7.274  -2.962
  258   1HB   HIS  33          2HB       HIS  33  -6.237  -8.926  -4.917
  259   2HB   HIS  33          1HB       HIS  33  -5.316 -10.052  -3.918
  260    HD1  HIS  33           HD1      HIS  33  -6.434 -10.805  -1.639
  261    HD2  HIS  33           HD2      HIS  33  -8.923  -8.595  -4.149
  262    HE1  HIS  33           HE1      HIS  33  -8.791 -11.119  -0.767
  263    H    GLY  34           H        GLY  34  -2.827  -8.467  -2.791
  264   1HA   GLY  34          2HA       GLY  34  -3.078  -8.771   0.131
  265   2HA   GLY  34          1HA       GLY  34  -2.550 -10.211  -0.745
  266    H    LEU  35           H        LEU  35  -1.790  -6.859  -1.562
  267    HA   LEU  35           HA       LEU  35   0.995  -7.413  -1.912
  268   1HB   LEU  35          2HB       LEU  35  -0.115  -5.598  -3.111
  269   2HB   LEU  35          1HB       LEU  35  -0.461  -4.778  -1.588
  270    HG   LEU  35           HG       LEU  35   2.169  -5.009  -1.268
  271   1HD1  LEU  35          1HD1      LEU  35   2.950  -4.404  -3.792
  272   2HD1  LEU  35          2HD1      LEU  35   1.661  -5.553  -4.142
  273   3HD1  LEU  35          3HD1      LEU  35   3.021  -6.036  -3.129
  274   1HD2  LEU  35          1HD2      LEU  35   0.468  -3.001  -2.665
  275   2HD2  LEU  35          2HD2      LEU  35   2.215  -2.796  -2.810
  276   3HD2  LEU  35          3HD2      LEU  35   1.459  -2.822  -1.216
  277    H    PHE  36           H        PHE  36  -0.879  -6.117   0.788
  278    HA   PHE  36           HA       PHE  36   1.327  -5.158   2.334
  279   1HB   PHE  36          2HB       PHE  36  -1.468  -6.052   3.007
  280   2HB   PHE  36          1HB       PHE  36  -0.330  -5.632   4.288
  281    HD1  PHE  36           HD1      PHE  36  -1.081  -4.243   0.879
  282    HD2  PHE  36           HD2      PHE  36  -0.684  -3.474   5.087
  283    HE1  PHE  36           HE1      PHE  36  -1.519  -1.835   0.479
  284    HE2  PHE  36           HE2      PHE  36  -1.122  -1.065   4.687
  285    HZ   PHE  36           HZ       PHE  36  -1.539  -0.246   2.385
  286    H    GLY  37           H        GLY  37   2.840  -6.244   3.497
  287   1HA   GLY  37          2HA       GLY  37   3.853  -7.990   4.716
  288   2HA   GLY  37          1HA       GLY  37   2.314  -8.848   4.680
  289    H    ARG  38           H        ARG  38   3.592  -7.751   1.646
  290    HA   ARG  38           HA       ARG  38   4.891 -10.358   1.117
  291   1HB   ARG  38          2HB       ARG  38   2.484 -10.691   0.572
  292   2HB   ARG  38          1HB       ARG  38   2.578  -9.342  -0.561
  293   1HG   ARG  38          2HG       ARG  38   4.424 -10.567  -1.756
  294   2HG   ARG  38          1HG       ARG  38   4.113 -11.951  -0.708
  295   1HD   ARG  38          2HD       ARG  38   2.473 -12.600  -2.103
  296   2HD   ARG  38          1HD       ARG  38   1.599 -11.117  -1.721
  297    HE   ARG  38           HE       ARG  38   2.908 -11.655  -4.207
  298   1HH1  ARG  38          1HH1      ARG  38   1.050  -9.368  -2.846
  299   2HH1  ARG  38          2HH1      ARG  38   1.870  -7.987  -3.494
  300   1HH2  ARG  38          1HH2      ARG  38   4.605  -9.806  -4.609
  301   2HH2  ARG  38          2HH2      ARG  38   3.886  -8.234  -4.488
  302    H    LYS  39           H        LYS  39   6.755  -9.877   0.079
  303    HA   LYS  39           HA       LYS  39   7.273  -7.267  -1.029
  304   1HB   LYS  39          2HB       LYS  39   9.418  -8.159  -1.672
  305   2HB   LYS  39          1HB       LYS  39   9.013  -8.866  -0.107
  306   1HG   LYS  39          2HG       LYS  39   8.054 -10.846  -1.369
  307   2HG   LYS  39          1HG       LYS  39   8.768 -10.165  -2.830
  308   1HD   LYS  39          2HD       LYS  39  10.655 -11.273  -2.268
  309   2HD   LYS  39          1HD       LYS  39  10.847 -10.078  -0.984
  310   1HE   LYS  39          2HE       LYS  39  10.636 -11.744   0.514
  311   2HE   LYS  39          1HE       LYS  39   8.964 -11.938  -0.014
  312   1HZ   LYS  39          1HZ       LYS  39   9.529 -13.910  -0.811
  313   2HZ   LYS  39          2HZ       LYS  39  11.166 -13.657  -0.430
  314   3HZ   LYS  39          3HZ       LYS  39  10.552 -13.153  -1.932
  315    H    THR  40           H        THR  40   7.802  -6.863  -3.331
  316    HA   THR  40           HA       THR  40   5.728  -7.774  -5.088
  317    HB   THR  40           HB       THR  40   7.055  -5.608  -5.259
  318    HG1  THR  40           HG1      THR  40   7.310  -6.127  -7.717
  319   1HG2  THR  40          1HG2      THR  40   9.184  -7.479  -5.501
  320   2HG2  THR  40          2HG2      THR  40   9.278  -5.718  -5.538
  321   3HG2  THR  40          3HG2      THR  40   9.052  -6.620  -7.036
  322    H    GLY  41           H        GLY  41   6.695  -8.529  -7.451
  323   1HA   GLY  41          2HA       GLY  41   7.459 -10.396  -8.643
  324   2HA   GLY  41          1HA       GLY  41   8.843 -10.362  -7.551
  325    H    GLN  42           H        GLN  42   5.502 -11.543  -7.860
  326    HA   GLN  42           HA       GLN  42   6.281 -13.999  -6.441
  327   1HB   GLN  42          2HB       GLN  42   5.157 -11.881  -4.963
  328   2HB   GLN  42          1HB       GLN  42   3.846 -13.038  -5.203
  329   1HG   GLN  42          2HG       GLN  42   5.155 -13.540  -3.153
  330   2HG   GLN  42          1HG       GLN  42   5.252 -14.848  -4.332
  331   1HE2  GLN  42          1HE2      GLN  42   7.054 -11.857  -3.399
  332   2HE2  GLN  42          2HE2      GLN  42   8.586 -12.503  -3.739
  333    H    ALA  43           H        ALA  43   3.344 -12.178  -7.431
  334    HA   ALA  43           HA       ALA  43   1.628 -14.261  -7.990
  335   1HB   ALA  43          1HB       ALA  43   1.009 -12.773 -10.104
  336   2HB   ALA  43          2HB       ALA  43   2.103 -11.629  -9.329
  337   3HB   ALA  43          3HB       ALA  43   0.675 -12.204  -8.469
  338    HA   PRO  44           HA       PRO  44   3.781 -16.600 -11.084
  339   1HB   PRO  44          2HB       PRO  44   1.735 -18.360 -11.600
  340   2HB   PRO  44          1HB       PRO  44   2.780 -18.466 -10.173
  341   1HG   PRO  44          2HG       PRO  44  -0.049 -17.545 -10.364
  342   2HG   PRO  44          1HG       PRO  44   0.814 -18.240  -8.982
  343   1HD   PRO  44          2HD       PRO  44   0.244 -15.491  -9.376
  344   2HD   PRO  44          1HD       PRO  44   1.364 -16.168  -8.174
  345    H    GLY  45           H        GLY  45   3.961 -16.278 -13.289
  346   1HA   GLY  45          2HA       GLY  45   3.220 -15.961 -15.528
  347   2HA   GLY  45          1HA       GLY  45   1.566 -15.817 -14.932
  348    H    TYR  46           H        TYR  46   2.993 -13.849 -12.878
  349    HA   TYR  46           HA       TYR  46   3.152 -11.528 -14.746
  350   1HB   TYR  46          2HB       TYR  46   0.901 -11.580 -13.725
  351   2HB   TYR  46          1HB       TYR  46   1.631 -11.593 -12.124
  352    HD1  TYR  46           HD1      TYR  46   3.764  -9.606 -14.081
  353    HD2  TYR  46           HD2      TYR  46  -0.108  -9.514 -12.245
  354    HE1  TYR  46           HE1      TYR  46   3.818  -7.134 -14.074
  355    HE2  TYR  46           HE2      TYR  46  -0.047  -7.050 -12.261
  356    HH   TYR  46           HH       TYR  46   1.339  -5.246 -12.471
  357    H    SER  47           H        SER  47   5.500 -11.969 -14.333
  358    HA   SER  47           HA       SER  47   6.596 -11.570 -11.686
  359   1HB   SER  47          2HB       SER  47   8.264 -10.801 -14.010
  360   2HB   SER  47          1HB       SER  47   8.623 -11.915 -12.695
  361    HG   SER  47           HG       SER  47   6.884 -13.232 -13.840
  362    H    TYR  48           H        TYR  48   5.625  -9.655 -10.868
  363    HA   TYR  48           HA       TYR  48   5.172  -7.236 -12.129
  364   1HB   TYR  48          2HB       TYR  48   6.387  -7.421  -9.372
  365   2HB   TYR  48          1HB       TYR  48   5.328  -6.159  -9.989
  366    HD1  TYR  48           HD1      TYR  48   3.685  -8.531 -11.530
  367    HD2  TYR  48           HD2      TYR  48   4.784  -7.614  -7.500
  368    HE1  TYR  48           HE1      TYR  48   1.711  -9.786 -10.705
  369    HE2  TYR  48           HE2      TYR  48   2.811  -8.859  -6.662
  370    HH   TYR  48           HH       TYR  48   0.249  -9.725  -8.571
  371    H    THR  49           H        THR  49   6.557  -5.140 -11.590
  372    HA   THR  49           HA       THR  49   8.955  -5.282 -13.109
  373    HB   THR  49           HB       THR  49   8.391  -3.171 -11.020
  374    HG1  THR  49           HG1      THR  49   6.975  -2.268 -12.395
  375   1HG2  THR  49          1HG2      THR  49  10.503  -3.455 -12.688
  376   2HG2  THR  49          2HG2      THR  49   9.881  -1.886 -12.182
  377   3HG2  THR  49          3HG2      THR  49   9.406  -2.561 -13.739
  378    H    ALA  50           H        ALA  50  10.160  -7.003 -12.198
  379    HA   ALA  50           HA       ALA  50  10.969  -7.642  -9.693
  380   1HB   ALA  50          1HB       ALA  50  13.341  -7.347 -11.357
  381   2HB   ALA  50          2HB       ALA  50  12.000  -8.063 -12.252
  382   3HB   ALA  50          3HB       ALA  50  12.571  -8.818 -10.763
  383    H    ALA  51           H        ALA  51  11.895  -4.755 -11.449
  384    HA   ALA  51           HA       ALA  51  14.038  -3.648 -10.238
  385   1HB   ALA  51          1HB       ALA  51  12.589  -1.466 -10.028
  386   2HB   ALA  51          2HB       ALA  51  11.349  -2.443 -10.813
  387   3HB   ALA  51          3HB       ALA  51  12.890  -2.158 -11.622
  388    H    ASN  52           H        ASN  52  10.818  -3.379  -8.688
  389    HA   ASN  52           HA       ASN  52  11.814  -2.491  -6.165
  390   1HB   ASN  52          2HB       ASN  52   9.396  -2.422  -6.978
  391   2HB   ASN  52          1HB       ASN  52   9.313  -4.140  -6.591
  392   1HD2  ASN  52          1HD2      ASN  52   8.357  -4.428  -4.579
  393   2HD2  ASN  52          2HD2      ASN  52   8.621  -3.441  -3.224
  394    H    LYS  53           H        LYS  53  10.716  -5.739  -7.172
  395    HA   LYS  53           HA       LYS  53  11.204  -7.231  -4.917
  396   1HB   LYS  53          2HB       LYS  53  10.529  -7.975  -7.325
  397   2HB   LYS  53          1HB       LYS  53  12.259  -8.233  -7.550
  398   1HG   LYS  53          2HG       LYS  53  11.986  -9.478  -5.195
  399   2HG   LYS  53          1HG       LYS  53  10.339  -9.688  -5.790
  400   1HD   LYS  53          2HD       LYS  53  11.526 -11.592  -6.581
  401   2HD   LYS  53          1HD       LYS  53  11.405 -10.516  -7.974
  402   1HE   LYS  53          2HE       LYS  53  13.676 -11.187  -7.955
  403   2HE   LYS  53          1HE       LYS  53  13.688  -9.583  -7.222
  404   1HZ   LYS  53          1HZ       LYS  53  14.339 -10.406  -5.274
  405   2HZ   LYS  53          2HZ       LYS  53  14.729 -11.828  -6.118
  406   3HZ   LYS  53          3HZ       LYS  53  13.232 -11.691  -5.329
  407    H    ASN  54           H        ASN  54  13.650  -5.728  -6.945
  408    HA   ASN  54           HA       ASN  54  15.776  -7.152  -5.497
  409   1HB   ASN  54          2HB       ASN  54  17.287  -6.341  -7.134
  410   2HB   ASN  54          1HB       ASN  54  15.820  -6.729  -8.030
  411   1HD2  ASN  54          1HD2      ASN  54  15.312  -5.110  -9.500
  412   2HD2  ASN  54          2HD2      ASN  54  15.587  -3.452  -9.262
  413    H    LYS  55           H        LYS  55  14.375  -3.922  -5.793
  414    HA   LYS  55           HA       LYS  55  16.363  -2.420  -4.485
  415   1HB   LYS  55          2HB       LYS  55  14.105  -1.650  -5.491
  416   2HB   LYS  55          1HB       LYS  55  13.426  -2.039  -3.911
  417   1HG   LYS  55          2HG       LYS  55  13.997   0.248  -3.733
  418   2HG   LYS  55          1HG       LYS  55  15.345  -0.583  -2.954
  419   1HD   LYS  55          2HD       LYS  55  16.602  -0.487  -5.106
  420   2HD   LYS  55          1HD       LYS  55  15.276   0.439  -5.809
  421   1HE   LYS  55          2HE       LYS  55  17.108   1.911  -5.002
  422   2HE   LYS  55          1HE       LYS  55  15.594   2.212  -4.148
  423   1HZ   LYS  55          1HZ       LYS  55  17.645   0.344  -3.117
  424   2HZ   LYS  55          2HZ       LYS  55  16.339   1.036  -2.281
  425   3HZ   LYS  55          3HZ       LYS  55  17.662   1.998  -2.742
  426    H    GLY  56           H        GLY  56  14.336  -4.927  -3.249
  427   1HA   GLY  56          1HA       GLY  56  14.406  -5.984  -1.146
  428   2HA   GLY  56          2HA       GLY  56  15.717  -4.893  -0.696
  429    H    ILE  57           H        ILE  57  12.175  -4.975  -1.164
  430    HA   ILE  57           HA       ILE  57  11.901  -3.267   1.234
  431    HB   ILE  57           HB       ILE  57  12.090  -1.781  -0.832
  432   1HG1  ILE  57          2HG1      ILE  57  10.983  -1.149   1.352
  433   2HG1  ILE  57          1HG1      ILE  57  10.357  -0.291  -0.055
  434   1HG2  ILE  57          1HG2      ILE  57   9.330  -2.918  -1.366
  435   2HG2  ILE  57          2HG2      ILE  57  10.770  -3.307  -2.309
  436   3HG2  ILE  57          3HG2      ILE  57  10.146  -1.658  -2.291
  437   1HD1  ILE  57          1HD1      ILE  57   9.003  -2.197   1.730
  438   2HD1  ILE  57          2HD1      ILE  57   8.754  -2.539   0.020
  439   3HD1  ILE  57          3HD1      ILE  57   8.317  -0.963   0.675
  440    H    ILE  58           H        ILE  58  10.239  -4.022   2.432
  441    HA   ILE  58           HA       ILE  58   8.348  -5.951   1.215
  442    HB   ILE  58           HB       ILE  58   9.215  -6.647   3.345
  443   1HG1  ILE  58          2HG1      ILE  58   7.210  -6.906   4.633
  444   2HG1  ILE  58          1HG1      ILE  58   6.525  -5.413   3.990
  445   1HG2  ILE  58          1HG2      ILE  58   8.408  -4.782   5.239
  446   2HG2  ILE  58          2HG2      ILE  58   9.002  -3.783   3.912
  447   3HG2  ILE  58          3HG2      ILE  58  10.055  -4.994   4.643
  448   1HD1  ILE  58          1HD1      ILE  58   7.176  -7.839   2.295
  449   2HD1  ILE  58          2HD1      ILE  58   6.320  -6.386   1.780
  450   3HD1  ILE  58          3HD1      ILE  58   5.572  -7.487   2.938
  451    H    TRP  59           H        TRP  59   6.816  -4.791   0.072
  452    HA   TRP  59           HA       TRP  59   5.876  -2.242   0.444
  453   1HB   TRP  59          2HB       TRP  59   4.353  -4.716  -0.378
  454   2HB   TRP  59          1HB       TRP  59   3.640  -3.103  -0.431
  455    HD1  TRP  59           HD1      TRP  59   4.809  -5.235  -2.852
  456    HE1  TRP  59           HE1      TRP  59   6.162  -4.103  -4.723
  457    HE3  TRP  59           HE3      TRP  59   5.997  -0.802  -0.567
  458    HZ2  TRP  59           HZ2      TRP  59   7.574  -1.674  -5.193
  459    HZ3  TRP  59           HZ3      TRP  59   7.361   0.882  -1.753
  460    HH2  TRP  59           HH2      TRP  59   8.153   0.449  -4.062
  461    H    GLY  60           H        GLY  60   5.425  -1.338   2.364
  462   1HA   GLY  60          1HA       GLY  60   3.354  -2.663   4.061
  463   2HA   GLY  60          2HA       GLY  60   4.795  -1.952   4.791
  464    H    GLU  61           H        GLU  61   3.412  -0.445   5.962
  465    HA   GLU  61           HA       GLU  61   1.697   1.390   4.489
  466   1HB   GLU  61          2HB       GLU  61   1.107   0.926   6.777
  467   2HB   GLU  61          1HB       GLU  61   2.716   1.378   7.341
  468   1HG   GLU  61          2HG       GLU  61   2.339   3.657   7.008
  469   2HG   GLU  61          1HG       GLU  61   1.076   3.375   5.809
  470    H    ASP  62           H        ASP  62   4.370   2.310   6.662
  471    HA   ASP  62           HA       ASP  62   4.886   4.754   5.301
  472   1HB   ASP  62          2HB       ASP  62   5.590   4.335   7.625
  473   2HB   ASP  62          1HB       ASP  62   6.745   3.128   7.059
  474    H    THR  63           H        THR  63   6.327   1.530   4.940
  475    HA   THR  63           HA       THR  63   8.481   2.277   3.241
  476    HB   THR  63           HB       THR  63   7.670  -0.236   2.344
  477    HG1  THR  63           HG1      THR  63   7.294  -1.184   4.525
  478   1HG2  THR  63          1HG2      THR  63   9.605  -0.953   3.405
  479   2HG2  THR  63          2HG2      THR  63   9.320   0.047   4.828
  480   3HG2  THR  63          3HG2      THR  63   9.897   0.784   3.334
  481    H    LEU  64           H        LEU  64   5.262   0.995   2.352
  482    HA   LEU  64           HA       LEU  64   5.595   1.427  -0.459
  483   1HB   LEU  64          2HB       LEU  64   3.758   0.108   0.946
  484   2HB   LEU  64          1HB       LEU  64   2.882   1.629   0.786
  485    HG   LEU  64           HG       LEU  64   4.091   0.102  -1.536
  486   1HD1  LEU  64          1HD1      LEU  64   2.159  -1.063  -1.748
  487   2HD1  LEU  64          2HD1      LEU  64   1.170   0.343  -1.358
  488   3HD1  LEU  64          3HD1      LEU  64   1.871  -0.628  -0.063
  489   1HD2  LEU  64          1HD2      LEU  64   3.896   2.253  -2.349
  490   2HD2  LEU  64          2HD2      LEU  64   2.629   2.683  -1.200
  491   3HD2  LEU  64          3HD2      LEU  64   2.240   1.711  -2.620
  492    H    MET  65           H        MET  65   4.937   3.589   2.150
  493    HA   MET  65           HA       MET  65   3.548   5.641   0.723
  494   1HB   MET  65          2HB       MET  65   3.690   5.597   3.184
  495   2HB   MET  65          1HB       MET  65   5.429   5.878   3.090
  496   1HG   MET  65          2HG       MET  65   3.882   7.824   1.541
  497   2HG   MET  65          1HG       MET  65   3.494   7.853   3.262
  498   1HE   MET  65          1HE       MET  65   5.840  10.498   4.099
  499   2HE   MET  65          2HE       MET  65   4.787   9.312   4.866
  500   3HE   MET  65          3HE       MET  65   4.230  10.180   3.437
  501    H    GLU  66           H        GLU  66   7.024   5.137   1.365
  502    HA   GLU  66           HA       GLU  66   7.896   7.471  -0.042
  503   1HB   GLU  66          2HB       GLU  66   9.191   5.902   1.601
  504   2HB   GLU  66          1HB       GLU  66   9.559   4.974   0.147
  505   1HG   GLU  66          2HG       GLU  66  11.309   6.415  -0.061
  506   2HG   GLU  66          1HG       GLU  66  10.093   7.525  -0.697
  507    H    TYR  67           H        TYR  67   7.732   4.033  -1.063
  508    HA   TYR  67           HA       TYR  67   8.679   4.370  -3.697
  509   1HB   TYR  67          2HB       TYR  67   8.328   2.136  -3.022
  510   2HB   TYR  67          1HB       TYR  67   6.684   2.463  -2.480
  511    HD1  TYR  67           HD1      TYR  67   5.068   1.447  -3.800
  512    HD2  TYR  67           HD2      TYR  67   8.608   2.990  -5.681
  513    HE1  TYR  67           HE1      TYR  67   4.189   0.763  -6.013
  514    HE2  TYR  67           HE2      TYR  67   7.724   2.306  -7.892
  515    HH   TYR  67           HH       TYR  67   6.158   0.837  -8.869
  516    H    LEU  68           H        LEU  68   5.389   4.860  -2.422
  517    HA   LEU  68           HA       LEU  68   4.241   5.459  -5.001
  518   1HB   LEU  68          2HB       LEU  68   3.290   5.146  -2.367
  519   2HB   LEU  68          1HB       LEU  68   2.865   6.793  -2.838
  520    HG   LEU  68           HG       LEU  68   1.988   5.807  -5.020
  521   1HD1  LEU  68          1HD1      LEU  68   2.451   3.633  -5.387
  522   2HD1  LEU  68          2HD1      LEU  68   1.326   3.236  -4.088
  523   3HD1  LEU  68          3HD1      LEU  68   3.043   3.430  -3.738
  524   1HD2  LEU  68          1HD2      LEU  68  -0.047   5.924  -4.039
  525   2HD2  LEU  68          2HD2      LEU  68   0.809   6.127  -2.510
  526   3HD2  LEU  68          3HD2      LEU  68   0.289   4.522  -3.021
  527    H    GLU  69           H        GLU  69   5.813   7.409  -2.513
  528    HA   GLU  69           HA       GLU  69   5.077   9.975  -3.488
  529   1HB   GLU  69          2HB       GLU  69   6.492   9.143  -1.381
  530   2HB   GLU  69          1HB       GLU  69   7.837   9.492  -2.457
  531   1HG   GLU  69          2HG       GLU  69   6.713  11.765  -2.869
  532   2HG   GLU  69          1HG       GLU  69   5.702  11.389  -1.472
  533    H    ASN  70           H        ASN  70   7.218   7.527  -4.617
  534    HA   ASN  70           HA       ASN  70   7.575   8.784  -7.188
  535   1HB   ASN  70          2HB       ASN  70   9.230   9.986  -5.531
  536   2HB   ASN  70          1HB       ASN  70  10.165   8.500  -5.685
  537   1HD2  ASN  70          1HD2      ASN  70  11.113  11.025  -6.711
  538   2HD2  ASN  70          2HD2      ASN  70  11.179  10.912  -8.404
  539    HA   PRO  71           HA       PRO  71   8.047   4.282  -7.164
  540   1HB   PRO  71          2HB       PRO  71   6.811   3.948  -9.608
  541   2HB   PRO  71          1HB       PRO  71   5.948   4.015  -8.062
  542   1HG   PRO  71          2HG       PRO  71   6.136   6.082 -10.195
  543   2HG   PRO  71          1HG       PRO  71   4.882   5.847  -8.971
  544   1HD   PRO  71          2HD       PRO  71   6.929   7.803  -8.881
  545   2HD   PRO  71          1HD       PRO  71   5.873   7.333  -7.533
  546    H    LYS  72           H        LYS  72   8.715   6.517  -9.857
  547    HA   LYS  72           HA       LYS  72  10.536   4.702 -11.175
  548   1HB   LYS  72          2HB       LYS  72   9.561   6.415 -12.530
  549   2HB   LYS  72          1HB       LYS  72  10.062   7.679 -11.407
  550   1HG   LYS  72          2HG       LYS  72  12.336   7.486 -12.015
  551   2HG   LYS  72          1HG       LYS  72  12.093   5.902 -12.755
  552   1HD   LYS  72          2HD       LYS  72  10.556   8.210 -13.868
  553   2HD   LYS  72          1HD       LYS  72  12.277   8.111 -14.240
  554   1HE   LYS  72          2HE       LYS  72  12.046   6.145 -15.442
  555   2HE   LYS  72          1HE       LYS  72  10.619   5.637 -14.540
  556   1HZ   LYS  72          1HZ       LYS  72  10.761   7.791 -16.577
  557   2HZ   LYS  72          2HZ       LYS  72   9.391   7.457 -15.630
  558   3HZ   LYS  72          3HZ       LYS  72   9.967   6.300 -16.731
  559    H    LYS  73           H        LYS  73  10.743   6.496  -8.330
  560    HA   LYS  73           HA       LYS  73  13.670   6.914  -8.524
  561   1HB   LYS  73          2HB       LYS  73  12.412   8.729  -7.517
  562   2HB   LYS  73          1HB       LYS  73  11.646   7.617  -6.382
  563   1HG   LYS  73          2HG       LYS  73  13.507   8.844  -5.312
  564   2HG   LYS  73          1HG       LYS  73  13.834   7.112  -5.378
  565   1HD   LYS  73          2HD       LYS  73  15.525   7.346  -6.908
  566   2HD   LYS  73          1HD       LYS  73  14.750   8.713  -7.709
  567   1HE   LYS  73          2HE       LYS  73  15.698  10.253  -6.295
  568   2HE   LYS  73          1HE       LYS  73  15.670   9.157  -4.915
  569   1HZ   LYS  73          1HZ       LYS  73  17.900   9.282  -5.433
  570   2HZ   LYS  73          2HZ       LYS  73  17.629   9.322  -7.110
  571   3HZ   LYS  73          3HZ       LYS  73  17.431   7.872  -6.248
  572    H    TYR  74           H        TYR  74  11.411   5.383  -6.202
  573    HA   TYR  74           HA       TYR  74  13.425   3.907  -4.805
  574   1HB   TYR  74          2HB       TYR  74  10.790   4.359  -4.387
  575   2HB   TYR  74          1HB       TYR  74  10.700   2.737  -5.067
  576    HD1  TYR  74           HD1      TYR  74  13.728   2.293  -3.909
  577    HD2  TYR  74           HD2      TYR  74   9.891   3.311  -2.268
  578    HE1  TYR  74           HE1      TYR  74  14.407   1.336  -1.722
  579    HE2  TYR  74           HE2      TYR  74  10.570   2.357  -0.083
  580    HH   TYR  74           HH       TYR  74  13.154   0.335   0.313
  581    H    ILE  75           H        ILE  75  10.977   2.687  -7.083
  582    HA   ILE  75           HA       ILE  75  12.513   0.279  -7.620
  583    HB   ILE  75           HB       ILE  75  10.183   1.185  -9.283
  584   1HG1  ILE  75          2HG1      ILE  75   9.436   1.762  -7.055
  585   2HG1  ILE  75          1HG1      ILE  75   8.692   0.222  -7.478
  586   1HG2  ILE  75          1HG2      ILE  75   9.791  -1.394  -8.464
  587   2HG2  ILE  75          2HG2      ILE  75  11.551  -1.290  -8.491
  588   3HG2  ILE  75          3HG2      ILE  75  10.625  -0.935  -9.948
  589   1HD1  ILE  75          1HD1      ILE  75   9.539  -0.041  -5.256
  590   2HD1  ILE  75          2HD1      ILE  75  11.087   0.686  -5.690
  591   3HD1  ILE  75          3HD1      ILE  75  10.653  -0.906  -6.313
  592    HA   PRO  76           HA       PRO  76  14.726   2.496 -10.833
  593   1HB   PRO  76          2HB       PRO  76  16.477   0.443 -11.369
  594   2HB   PRO  76          1HB       PRO  76  16.674   1.579 -10.023
  595   1HG   PRO  76          2HG       PRO  76  15.766  -1.264  -9.966
  596   2HG   PRO  76          1HG       PRO  76  16.590  -0.324  -8.711
  597   1HD   PRO  76          2HD       PRO  76  13.835  -0.913  -8.761
  598   2HD   PRO  76          1HD       PRO  76  14.607   0.333  -7.759
  599    H    GLY  77           H        GLY  77  12.581   2.150 -12.066
  600   1HA   GLY  77          2HA       GLY  77  12.403   1.637 -14.539
  601   2HA   GLY  77          1HA       GLY  77  12.950   0.013 -14.126
  602    H    THR  78           H        THR  78  10.695   1.718 -12.024
  603    HA   THR  78           HA       THR  78   8.825  -0.370 -11.908
  604    HB   THR  78           HB       THR  78   8.835   1.764 -10.488
  605    HG1  THR  78           HG1      THR  78   6.441   1.759 -10.494
  606   1HG2  THR  78          1HG2      THR  78   8.798   3.245 -12.579
  607   2HG2  THR  78          2HG2      THR  78   7.680   3.688 -11.288
  608   3HG2  THR  78          3HG2      THR  78   7.089   2.831 -12.711
  609    H    LYS  79           H        LYS  79   6.652  -0.502 -12.914
  610    HA   LYS  79           HA       LYS  79   6.799   0.334 -15.768
  611   1HB   LYS  79          2HB       LYS  79   5.946  -2.068 -14.452
  612   2HB   LYS  79          1HB       LYS  79   4.559  -1.362 -15.285
  613   1HG   LYS  79          2HG       LYS  79   5.407  -1.837 -17.325
  614   2HG   LYS  79          1HG       LYS  79   7.011  -1.252 -16.882
  615   1HD   LYS  79          2HD       LYS  79   7.757  -3.338 -16.424
  616   2HD   LYS  79          1HD       LYS  79   6.298  -3.743 -15.518
  617   1HE   LYS  79          2HE       LYS  79   5.104  -4.313 -17.514
  618   2HE   LYS  79          1HE       LYS  79   6.358  -3.618 -18.541
  619   1HZ   LYS  79          1HZ       LYS  79   6.238  -6.185 -18.053
  620   2HZ   LYS  79          2HZ       LYS  79   7.137  -5.736 -16.682
  621   3HZ   LYS  79          3HZ       LYS  79   7.723  -5.387 -18.238
  622    H    MET  80           H        MET  80   5.566   1.478 -12.927
  623    HA   MET  80           HA       MET  80   3.127   2.517 -14.307
  624   1HB   MET  80          2HB       MET  80   2.123   2.840 -12.103
  625   2HB   MET  80          1HB       MET  80   2.671   1.187 -12.287
  626   1HG   MET  80          2HG       MET  80   4.620   1.579 -10.978
  627   2HG   MET  80          1HG       MET  80   4.289   3.299 -10.912
  628   1HE   MET  80          1HE       MET  80   1.672   4.125  -8.985
  629   2HE   MET  80          2HE       MET  80   3.290   4.422  -9.615
  630   3HE   MET  80          3HE       MET  80   3.085   3.914  -7.941
  631    H    ILE  81           H        ILE  81   3.206   4.570 -14.874
  632    HA   ILE  81           HA       ILE  81   5.310   6.336 -13.779
  633    HB   ILE  81           HB       ILE  81   4.940   6.268 -16.231
  634   1HG1  ILE  81          2HG1      ILE  81   4.033   8.917 -15.062
  635   2HG1  ILE  81          1HG1      ILE  81   5.708   8.367 -15.057
  636   1HG2  ILE  81          1HG2      ILE  81   2.529   7.786 -16.409
  637   2HG2  ILE  81          2HG2      ILE  81   2.202   6.377 -15.399
  638   3HG2  ILE  81          3HG2      ILE  81   2.841   6.164 -17.029
  639   1HD1  ILE  81          1HD1      ILE  81   5.569   8.131 -17.555
  640   2HD1  ILE  81          2HD1      ILE  81   5.388   9.792 -16.992
  641   3HD1  ILE  81          3HD1      ILE  81   3.969   8.870 -17.486
  642    H    PHE  82           H        PHE  82   3.749   5.900 -11.745
  643    HA   PHE  82           HA       PHE  82   1.373   7.563 -11.616
  644   1HB   PHE  82          2HB       PHE  82   1.788   5.497 -10.245
  645   2HB   PHE  82          1HB       PHE  82   2.997   6.403  -9.337
  646    HD1  PHE  82           HD1      PHE  82   2.332   7.550  -7.427
  647    HD2  PHE  82           HD2      PHE  82  -0.572   6.675 -10.469
  648    HE1  PHE  82           HE1      PHE  82   0.544   8.475  -5.984
  649    HE2  PHE  82           HE2      PHE  82  -2.362   7.604  -9.025
  650    HZ   PHE  82           HZ       PHE  82  -1.800   8.497  -6.782
  651    H    VAL  83           H        VAL  83   1.148   9.483 -10.308
  652    HA   VAL  83           HA       VAL  83   3.639  11.107 -10.249
  653    HB   VAL  83           HB       VAL  83   1.654  12.012 -11.451
  654   1HG1  VAL  83          1HG1      VAL  83  -0.166  12.873  -9.748
  655   2HG1  VAL  83          2HG1      VAL  83   0.429  11.546  -8.749
  656   3HG1  VAL  83          3HG1      VAL  83  -0.240  11.216 -10.347
  657   1HG2  VAL  83          1HG2      VAL  83   1.597  14.216 -10.235
  658   2HG2  VAL  83          2HG2      VAL  83   3.228  13.605 -10.506
  659   3HG2  VAL  83          3HG2      VAL  83   2.486  13.456  -8.914
  660    H    GLY  84           H        GLY  84   4.235  12.241  -8.321
  661   1HA   GLY  84          2HA       GLY  84   3.510  10.840  -5.859
  662   2HA   GLY  84          1HA       GLY  84   4.664  12.168  -5.994
  663    H    ILE  85           H        ILE  85   1.754  11.377  -4.673
  664    HA   ILE  85           HA       ILE  85   0.260  13.818  -5.184
  665    HB   ILE  85           HB       ILE  85   0.000  11.700  -3.025
  666   1HG1  ILE  85          2HG1      ILE  85  -1.833  12.200  -5.372
  667   2HG1  ILE  85          1HG1      ILE  85  -0.411  11.169  -5.532
  668   1HG2  ILE  85          1HG2      ILE  85  -0.917  14.074  -2.540
  669   2HG2  ILE  85          2HG2      ILE  85  -2.025  12.713  -2.357
  670   3HG2  ILE  85          3HG2      ILE  85  -2.099  13.723  -3.801
  671   1HD1  ILE  85          1HD1      ILE  85  -2.912  10.720  -3.965
  672   2HD1  ILE  85          2HD1      ILE  85  -1.404  10.100  -3.292
  673   3HD1  ILE  85          3HD1      ILE  85  -1.941   9.570  -4.886
  674    H    LYS  86           H        LYS  86   0.463  15.754  -4.119
  675    HA   LYS  86           HA       LYS  86   2.659  16.114  -2.250
  676   1HB   LYS  86          2HB       LYS  86   1.743  17.833  -3.940
  677   2HB   LYS  86          1HB       LYS  86   0.455  18.113  -2.768
  678   1HG   LYS  86          2HG       LYS  86   2.224  19.727  -2.363
  679   2HG   LYS  86          1HG       LYS  86   2.210  18.567  -1.034
  680   1HD   LYS  86          2HD       LYS  86   4.060  17.334  -2.034
  681   2HD   LYS  86          1HD       LYS  86   4.033  18.384  -3.450
  682   1HE   LYS  86          2HE       LYS  86   5.705  19.423  -2.240
  683   2HE   LYS  86          1HE       LYS  86   4.305  20.284  -1.600
  684   1HZ   LYS  86          1HZ       LYS  86   4.844  19.535   0.395
  685   2HZ   LYS  86          2HZ       LYS  86   6.122  18.613  -0.240
  686   3HZ   LYS  86          3HZ       LYS  86   4.563  17.946  -0.128
  687    H    LYS  87           H        LYS  87  -0.902  16.296  -1.963
  688    HA   LYS  87           HA       LYS  87  -0.875  16.780   0.874
  689   1HB   LYS  87          2HB       LYS  87  -2.838  16.470  -1.187
  690   2HB   LYS  87          1HB       LYS  87  -3.258  15.388   0.142
  691   1HG   LYS  87          2HG       LYS  87  -3.504  17.129   1.665
  692   2HG   LYS  87          1HG       LYS  87  -2.415  18.195   0.777
  693   1HD   LYS  87          2HD       LYS  87  -4.104  18.415  -1.017
  694   2HD   LYS  87          1HD       LYS  87  -5.199  17.378  -0.102
  695   1HE   LYS  87          2HE       LYS  87  -4.263  19.436   1.647
  696   2HE   LYS  87          1HE       LYS  87  -4.821  20.197   0.158
  697   1HZ   LYS  87          1HZ       LYS  87  -6.580  18.120   0.971
  698   2HZ   LYS  87          2HZ       LYS  87  -6.915  19.760   0.683
  699   3HZ   LYS  87          3HZ       LYS  87  -6.383  19.255   2.216
  700    H    LYS  88           H        LYS  88   0.427  15.274   1.945
  701    HA   LYS  88           HA       LYS  88   0.501  12.483   1.458
  702   1HB   LYS  88          2HB       LYS  88   1.099  14.174   3.876
  703   2HB   LYS  88          1HB       LYS  88   1.193  12.415   3.965
  704   1HG   LYS  88          2HG       LYS  88   3.336  12.767   3.249
  705   2HG   LYS  88          1HG       LYS  88   2.563  12.843   1.664
  706   1HD   LYS  88          2HD       LYS  88   2.889  15.086   1.473
  707   2HD   LYS  88          1HD       LYS  88   2.526  15.380   3.174
  708   1HE   LYS  88          2HE       LYS  88   4.894  13.976   3.313
  709   2HE   LYS  88          1HE       LYS  88   5.120  14.951   1.863
  710   1HZ   LYS  88          1HZ       LYS  88   4.014  16.712   3.561
  711   2HZ   LYS  88          2HZ       LYS  88   5.685  16.542   3.306
  712   3HZ   LYS  88          3HZ       LYS  88   4.941  15.771   4.624
  713    H    GLU  89           H        GLU  89  -1.737  14.426   3.381
  714    HA   GLU  89           HA       GLU  89  -2.986  12.467   4.931
  715   1HB   GLU  89          2HB       GLU  89  -3.703  14.767   5.101
  716   2HB   GLU  89          1HB       GLU  89  -4.223  14.783   3.415
  717   1HG   GLU  89          2HG       GLU  89  -6.088  13.437   3.837
  718   2HG   GLU  89          1HG       GLU  89  -5.392  12.770   5.315
  719    H    GLU  90           H        GLU  90  -3.855  13.359   1.570
  720    HA   GLU  90           HA       GLU  90  -5.783  11.292   1.213
  721   1HB   GLU  90          2HB       GLU  90  -4.915  13.370  -0.317
  722   2HB   GLU  90          1HB       GLU  90  -4.149  12.017  -1.149
  723   1HG   GLU  90          2HG       GLU  90  -6.169  11.866  -2.203
  724   2HG   GLU  90          1HG       GLU  90  -6.630  10.988  -0.744
  725    H    ARG  91           H        ARG  91  -2.284  11.360   0.499
  726    HA   ARG  91           HA       ARG  91  -1.999   8.839  -0.686
  727   1HB   ARG  91          2HB       ARG  91  -0.204  10.643  -0.108
  728   2HB   ARG  91          1HB       ARG  91  -0.051   9.770   1.417
  729   1HG   ARG  91          2HG       ARG  91  -0.007   7.707  -0.379
  730   2HG   ARG  91          1HG       ARG  91   0.798   8.978  -1.299
  731   1HD   ARG  91          2HD       ARG  91   1.741   8.948   1.444
  732   2HD   ARG  91          1HD       ARG  91   1.948   7.364   0.693
  733    HE   ARG  91           HE       ARG  91   3.788   8.384  -0.365
  734   1HH1  ARG  91          1HH2      ARG  91   3.477  11.074   0.870
  735   2HH1  ARG  91          2HH2      ARG  91   3.185  12.086  -0.504
  736   1HH2  ARG  91          1HH1      ARG  91   2.379   9.445  -2.606
  737   2HH2  ARG  91          2HH1      ARG  91   2.559  11.163  -2.474
  738    H    ALA  92           H        ALA  92  -2.420   9.649   2.729
  739    HA   ALA  92           HA       ALA  92  -1.913   7.036   3.773
  740   1HB   ALA  92          1HB       ALA  92  -3.732   8.133   5.519
  741   2HB   ALA  92          2HB       ALA  92  -3.057   9.568   4.746
  742   3HB   ALA  92          3HB       ALA  92  -1.994   8.426   5.568
  743    H    ASP  93           H        ASP  93  -4.900   8.672   2.728
  744    HA   ASP  93           HA       ASP  93  -6.775   6.702   3.427
  745   1HB   ASP  93          2HB       ASP  93  -6.877   9.039   2.007
  746   2HB   ASP  93          1HB       ASP  93  -7.144   7.853   0.729
  747    H    LEU  94           H        LEU  94  -4.518   6.798   0.709
  748    HA   LEU  94           HA       LEU  94  -5.580   4.544  -0.713
  749   1HB   LEU  94          2HB       LEU  94  -2.677   5.410  -0.607
  750   2HB   LEU  94          1HB       LEU  94  -3.485   4.535  -1.907
  751    HG   LEU  94           HG       LEU  94  -3.964   7.398  -1.047
  752   1HD1  LEU  94          1HD1      LEU  94  -2.460   6.057  -3.162
  753   2HD1  LEU  94          2HD1      LEU  94  -2.403   7.742  -2.643
  754   3HD1  LEU  94          3HD1      LEU  94  -3.620   7.219  -3.806
  755   1HD2  LEU  94          1HD2      LEU  94  -5.754   7.461  -2.704
  756   2HD2  LEU  94          2HD2      LEU  94  -6.100   6.186  -1.535
  757   3HD2  LEU  94          3HD2      LEU  94  -5.462   5.774  -3.127
  758    H    ILE  95           H        ILE  95  -2.765   4.749   1.494
  759    HA   ILE  95           HA       ILE  95  -2.182   1.998   1.639
  760    HB   ILE  95           HB       ILE  95  -2.037   3.984   3.928
  761   1HG1  ILE  95          2HG1      ILE  95  -0.873   4.993   2.113
  762   2HG1  ILE  95          1HG1      ILE  95   0.377   4.190   3.065
  763   1HG2  ILE  95          1HG2      ILE  95  -1.505   1.956   4.909
  764   2HG2  ILE  95          2HG2      ILE  95   0.080   2.416   4.289
  765   3HG2  ILE  95          3HG2      ILE  95  -0.914   1.262   3.399
  766   1HD1  ILE  95          1HD1      ILE  95  -0.858   3.298   0.463
  767   2HD1  ILE  95          2HD1      ILE  95  -0.008   2.165   1.514
  768   3HD1  ILE  95          3HD1      ILE  95   0.847   3.551   0.837
  769    H    ALA  96           H        ALA  96  -3.887   3.752   4.204
  770    HA   ALA  96           HA       ALA  96  -4.925   1.686   5.677
  771   1HB   ALA  96          1HB       ALA  96  -5.639   4.432   5.234
  772   2HB   ALA  96          2HB       ALA  96  -5.930   3.437   6.660
  773   3HB   ALA  96          3HB       ALA  96  -7.111   3.468   5.350
  774    H    TYR  97           H        TYR  97  -6.241   2.824   2.569
  775    HA   TYR  97           HA       TYR  97  -8.568   1.186   2.583
  776   1HB   TYR  97          2HB       TYR  97  -8.290   2.995   0.952
  777   2HB   TYR  97          1HB       TYR  97  -6.925   2.147   0.223
  778    HD1  TYR  97           HD1      TYR  97  -7.482   1.155  -1.812
  779    HD2  TYR  97           HD2      TYR  97 -10.347   1.133   1.389
  780    HE1  TYR  97           HE1      TYR  97  -9.043  -0.164  -3.217
  781    HE2  TYR  97           HE2      TYR  97 -11.909  -0.183  -0.015
  782    HH   TYR  97           HH       TYR  97 -11.548  -1.857  -2.092
  783    H    LEU  98           H        LEU  98  -5.346   0.588   1.142
  784    HA   LEU  98           HA       LEU  98  -6.044  -2.139   0.420
  785   1HB   LEU  98          2HB       LEU  98  -3.587  -0.443   0.331
  786   2HB   LEU  98          1HB       LEU  98  -3.368  -2.191   0.299
  787    HG   LEU  98           HG       LEU  98  -3.534  -1.448  -1.987
  788   1HD1  LEU  98          1HD1      LEU  98  -5.197  -2.899  -2.733
  789   2HD1  LEU  98          2HD1      LEU  98  -6.327  -2.416  -1.467
  790   3HD1  LEU  98          3HD1      LEU  98  -4.962  -3.465  -1.079
  791   1HD2  LEU  98          1HD2      LEU  98  -4.810   0.299  -2.638
  792   2HD2  LEU  98          2HD2      LEU  98  -5.149   0.564  -0.927
  793   3HD2  LEU  98          3HD2      LEU  98  -6.257  -0.397  -1.909
  794    H    LYS  99           H        LYS  99  -5.444  -0.718   3.361
  795    HA   LYS  99           HA       LYS  99  -4.076  -3.081   4.482
  796   1HB   LYS  99          2HB       LYS  99  -3.582  -0.509   4.983
  797   2HB   LYS  99          1HB       LYS  99  -4.862  -0.752   6.170
  798   1HG   LYS  99          2HG       LYS  99  -3.206  -3.013   6.400
  799   2HG   LYS  99          1HG       LYS  99  -2.105  -1.642   6.259
  800   1HD   LYS  99          2HD       LYS  99  -3.780  -0.537   7.991
  801   2HD   LYS  99          1HD       LYS  99  -4.151  -2.220   8.371
  802   1HE   LYS  99          2HE       LYS  99  -1.337  -2.071   8.192
  803   2HE   LYS  99          1HE       LYS  99  -1.839  -0.663   9.127
  804   1HZ   LYS  99          1HZ       LYS  99  -1.460  -2.831  10.374
  805   2HZ   LYS  99          2HZ       LYS  99  -2.924  -3.353   9.687
  806   3HZ   LYS  99          3HZ       LYS  99  -2.896  -1.989  10.700
  807    H    LYS 100           H        LYS 100  -7.200  -1.819   4.062
  808    HA   LYS 100           HA       LYS 100  -8.228  -3.464   6.340
  809   1HB   LYS 100          2HB       LYS 100  -8.693  -0.877   6.091
  810   2HB   LYS 100          1HB       LYS 100  -9.902  -1.415   4.926
  811   1HG   LYS 100          2HG       LYS 100 -11.268  -2.200   6.547
  812   2HG   LYS 100          1HG       LYS 100  -9.937  -2.981   7.400
  813   1HD   LYS 100          2HD       LYS 100 -10.875  -1.230   8.817
  814   2HD   LYS 100          1HD       LYS 100  -9.256  -0.755   8.301
  815   1HE   LYS 100          2HE       LYS 100 -10.793   0.256   6.267
  816   2HE   LYS 100          1HE       LYS 100 -11.865   0.458   7.653
  817   1HZ   LYS 100          1HZ       LYS 100  -9.122   1.181   8.162
  818   2HZ   LYS 100          2HZ       LYS 100 -10.554   2.012   8.541
  819   3HZ   LYS 100          3HZ       LYS 100  -9.877   2.145   6.989
  820    H    ALA 101           H        ALA 101  -8.843  -2.581   2.942
  821    HA   ALA 101           HA       ALA 101 -10.937  -4.546   2.630
  822   1HB   ALA 101          1HB       ALA 101 -11.302  -3.412   0.724
  823   2HB   ALA 101          2HB       ALA 101  -9.691  -3.813   0.130
  824   3HB   ALA 101          3HB       ALA 101  -9.929  -2.384   1.134
  825    H    THR 102           H        THR 102  -7.447  -4.516   2.051
  826    HA   THR 102           HA       THR 102  -7.661  -7.419   1.381
  827    HB   THR 102           HB       THR 102  -5.440  -6.825   0.055
  828    HG1  THR 102           HG1      THR 102  -5.312  -4.687   0.499
  829   1HG2  THR 102          1HG2      THR 102  -7.142  -6.090  -1.879
  830   2HG2  THR 102          2HG2      THR 102  -8.319  -6.652  -0.690
  831   3HG2  THR 102          3HG2      THR 102  -7.070  -7.748  -1.281
  832    H    ASN 103           H        ASN 103  -7.274  -6.568   4.003
  833    HA   ASN 103           HA       ASN 103  -4.876  -7.931   4.718
  834   1HB   ASN 103          2HB       ASN 103  -4.165  -5.523   3.793
  835   2HB   ASN 103          1HB       ASN 103  -4.563  -5.054   5.446
  836   1HD2  ASN 103          1HD2      ASN 103  -2.756  -5.141   6.782
  837   2HD2  ASN 103          2HD2      ASN 103  -1.490  -6.262   6.644
  838    H    GLU 104           HN       GLU 104  -7.522  -8.083   5.565
  839    HA   GLU 104           HA       GLU 104  -7.180  -7.692   8.442
  840   1HB   GLU 104          2HB       GLU 104  -8.163  -5.505   7.259
  841   2HB   GLU 104          1HB       GLU 104  -9.666  -6.422   7.371
  842   1HG   GLU 104          2HG       GLU 104  -9.235  -6.761   9.805
  843   2HG   GLU 104          1HG       GLU 104  -7.803  -5.742   9.665
  844    HHA  HEC 105           HHA      HEC 105   4.043  -2.737  -8.603
  845    HHB  HEC 105           HHB      HEC 105   0.855   1.169  -4.828
  846    HHC  HEC 105           HHC      HEC 105  -1.927   3.791  -9.867
  847    HHD  HEC 105           HHD      HEC 105   1.027  -0.340 -13.632
  848   1HMA  HEC 105          1HMA      HEC 105   3.308  -1.520  -3.673
  849   2HMA  HEC 105          2HMA      HEC 105   1.682  -0.843  -3.605
  850   3HMA  HEC 105          3HMA      HEC 105   3.078   0.228  -3.725
  851   1HAA  HEC 105          1HAA      HEC 105   4.369  -2.632  -4.874
  852   2HAA  HEC 105          2HAA      HEC 105   5.199  -2.424  -6.401
  853   1HBA  HEC 105          1HBA      HEC 105   2.865  -4.001  -6.879
  854   2HBA  HEC 105          2HBA      HEC 105   3.717  -4.682  -5.492
  855   1HMB  HEC 105          1HMB      HEC 105  -2.068   2.906  -4.538
  856   2HMB  HEC 105          2HMB      HEC 105  -0.838   4.167  -4.570
  857   3HMB  HEC 105          3HMB      HEC 105  -0.396   2.516  -4.139
  858    HAB  HEC 105           HAB      HEC 105  -2.408   4.970  -8.226
  859   1HBB  HEC 105          1HBB      HEC 105  -2.118   5.362  -5.289
  860   2HBB  HEC 105          2HBB      HEC 105  -2.521   6.536  -6.541
  861   3HBB  HEC 105          3HBB      HEC 105  -0.885   5.883  -6.438
  862   1HMC  HEC 105          1HMC      HEC 105  -2.767   3.253 -13.449
  863   2HMC  HEC 105          2HMC      HEC 105  -2.910   3.795 -11.777
  864   3HMC  HEC 105          3HMC      HEC 105  -1.697   4.513 -12.836
  865    HAC  HEC 105           HAC      HEC 105  -0.003   0.931 -14.843
  866   1HBC  HEC 105          1HBC      HEC 105  -0.061   2.799 -15.950
  867   2HBC  HEC 105          2HBC      HEC 105  -0.633   3.632 -14.506
  868   3HBC  HEC 105          3HBC      HEC 105  -1.791   2.962 -15.654
  869   1HMD  HEC 105          1HMD      HEC 105   2.556  -1.520 -14.332
  870   2HMD  HEC 105          2HMD      HEC 105   4.000  -2.427 -13.884
  871   3HMD  HEC 105          3HMD      HEC 105   2.429  -3.221 -13.889
  872   1HAD  HEC 105          1HAD      HEC 105   3.963  -4.413 -10.862
  873   2HAD  HEC 105          2HAD      HEC 105   4.785  -3.638 -12.206
  874   1HBD  HEC 105          1HBD      HEC 105   6.519  -3.534 -10.732
  875   2HBD  HEC 105          2HBD      HEC 105   5.471  -3.660  -9.329
  Start of MODEL    3
    1   1H    GLY   1          1HT       GLY   1  -8.886  10.693   8.521
    2   2H    GLY   1          2HT       GLY   1  -8.989   9.061   8.984
    3   3H    GLY   1          3HT       GLY   1 -10.329  10.088   9.175
    4   1HA   GLY   1          1HA       GLY   1 -10.219  10.405   6.661
    5   2HA   GLY   1          2HA       GLY   1  -9.200   8.965   6.689
    6    H    ASP   2           H        ASP   2 -11.770   9.048   5.448
    7    HA   ASP   2           HA       ASP   2 -13.423   7.406   7.318
    8   1HB   ASP   2          2HB       ASP   2 -14.200   8.856   4.769
    9   2HB   ASP   2          1HB       ASP   2 -15.296   7.896   5.762
   10    H    VAL   3           H        VAL   3 -14.308   5.416   6.515
   11    HA   VAL   3           HA       VAL   3 -12.501   3.952   4.785
   12    HB   VAL   3           HB       VAL   3 -13.670   2.851   6.649
   13   1HG1  VAL   3          1HG1      VAL   3 -15.758   4.244   6.432
   14   2HG1  VAL   3          2HG1      VAL   3 -16.070   2.517   6.613
   15   3HG1  VAL   3          3HG1      VAL   3 -16.195   3.274   5.025
   16   1HG2  VAL   3          1HG2      VAL   3 -13.017   1.550   4.607
   17   2HG2  VAL   3          2HG2      VAL   3 -14.642   1.806   3.970
   18   3HG2  VAL   3          3HG2      VAL   3 -14.412   0.864   5.443
   19    H    GLU   4           H        GLU   4 -15.744   5.341   4.407
   20    HA   GLU   4           HA       GLU   4 -16.333   4.190   1.861
   21   1HB   GLU   4          2HB       GLU   4 -17.332   6.478   3.467
   22   2HB   GLU   4          1HB       GLU   4 -17.639   6.562   1.732
   23   1HG   GLU   4          2HG       GLU   4 -18.617   4.274   1.824
   24   2HG   GLU   4          1HG       GLU   4 -18.383   4.268   3.571
   25    H    LYS   5           H        LYS   5 -14.194   6.769   2.785
   26    HA   LYS   5           HA       LYS   5 -14.060   7.899   0.077
   27   1HB   LYS   5          2HB       LYS   5 -13.705   9.176   2.289
   28   2HB   LYS   5          1HB       LYS   5 -12.109   8.427   2.318
   29   1HG   LYS   5          2HG       LYS   5 -11.541   9.412   0.177
   30   2HG   LYS   5          1HG       LYS   5 -13.181  10.036  -0.016
   31   1HD   LYS   5          2HD       LYS   5 -12.271  10.948   2.505
   32   2HD   LYS   5          1HD       LYS   5 -10.954  11.233   1.367
   33   1HE   LYS   5          2HE       LYS   5 -13.835  12.097   0.977
   34   2HE   LYS   5          1HE       LYS   5 -12.499  13.157   1.423
   35   1HZ   LYS   5          1HZ       LYS   5 -12.765  13.342  -0.897
   36   2HZ   LYS   5          2HZ       LYS   5 -12.859  11.658  -1.107
   37   3HZ   LYS   5          3HZ       LYS   5 -11.386  12.382  -0.667
   38    H    GLY   6           H        GLY   6 -11.837   6.083   2.216
   39   1HA   GLY   6          1HA       GLY   6  -9.668   5.835   0.456
   40   2HA   GLY   6          2HA       GLY   6 -10.094   4.614   1.656
   41    H    LYS   7           H        LYS   7 -12.555   3.740   0.680
   42    HA   LYS   7           HA       LYS   7 -11.783   1.882  -1.330
   43   1HB   LYS   7          2HB       LYS   7 -13.704   1.517   0.175
   44   2HB   LYS   7          1HB       LYS   7 -14.572   2.835  -0.614
   45   1HG   LYS   7          2HG       LYS   7 -14.920   1.628  -2.562
   46   2HG   LYS   7          1HG       LYS   7 -13.489   0.625  -2.320
   47   1HD   LYS   7          2HD       LYS   7 -14.573  -0.678  -0.631
   48   2HD   LYS   7          1HD       LYS   7 -15.917   0.459  -0.525
   49   1HE   LYS   7          2HE       LYS   7 -16.924  -1.052  -1.919
   50   2HE   LYS   7          1HE       LYS   7 -16.048  -0.152  -3.157
   51   1HZ   LYS   7          1HZ       LYS   7 -15.830  -2.728  -2.989
   52   2HZ   LYS   7          2HZ       LYS   7 -14.692  -2.362  -1.781
   53   3HZ   LYS   7          3HZ       LYS   7 -14.475  -1.777  -3.362
   54    H    LYS   8           H        LYS   8 -13.387   5.035  -1.578
   55    HA   LYS   8           HA       LYS   8 -13.928   4.802  -4.414
   56   1HB   LYS   8          2HB       LYS   8 -15.108   6.371  -2.825
   57   2HB   LYS   8          1HB       LYS   8 -13.635   7.342  -2.790
   58   1HG   LYS   8          2HG       LYS   8 -14.275   8.358  -4.689
   59   2HG   LYS   8          1HG       LYS   8 -14.231   6.801  -5.520
   60   1HD   LYS   8          2HD       LYS   8 -16.495   6.486  -5.346
   61   2HD   LYS   8          1HD       LYS   8 -16.595   7.316  -3.792
   62   1HE   LYS   8          2HE       LYS   8 -16.992   9.330  -4.757
   63   2HE   LYS   8          1HE       LYS   8 -15.795   9.061  -6.024
   64   1HZ   LYS   8          1HZ       LYS   8 -17.322   8.205  -7.406
   65   2HZ   LYS   8          2HZ       LYS   8 -18.428   9.058  -6.440
   66   3HZ   LYS   8          3HZ       LYS   8 -18.164   7.400  -6.174
   67    H    ILE   9           H        ILE   9 -11.128   5.644  -2.545
   68    HA   ILE   9           HA       ILE   9  -9.810   7.167  -4.640
   69    HB   ILE   9           HB       ILE   9  -8.715   5.786  -2.174
   70   1HG1  ILE   9          2HG1      ILE   9 -10.348   7.671  -1.834
   71   2HG1  ILE   9          1HG1      ILE   9  -8.736   8.018  -1.209
   72   1HG2  ILE   9          1HG2      ILE   9  -7.451   7.508  -4.298
   73   2HG2  ILE   9          2HG2      ILE   9  -6.840   6.021  -3.571
   74   3HG2  ILE   9          3HG2      ILE   9  -6.826   7.525  -2.649
   75   1HD1  ILE   9          1HD1      ILE   9  -9.632   9.938  -2.488
   76   2HD1  ILE   9          2HD1      ILE   9  -9.795   8.905  -3.909
   77   3HD1  ILE   9          3HD1      ILE   9  -8.196   9.267  -3.260
   78    H    PHE  10           H        PHE  10  -8.982   3.957  -3.260
   79    HA   PHE  10           HA       PHE  10  -7.237   3.193  -5.352
   80   1HB   PHE  10          2HB       PHE  10  -7.682   2.017  -3.094
   81   2HB   PHE  10          1HB       PHE  10  -9.027   1.229  -3.918
   82    HD1  PHE  10           HD1      PHE  10  -5.341   1.695  -3.932
   83    HD2  PHE  10           HD2      PHE  10  -8.664  -0.506  -5.539
   84    HE1  PHE  10           HE1      PHE  10  -3.774   0.058  -4.942
   85    HE2  PHE  10           HE2      PHE  10  -7.082  -2.139  -6.543
   86    HZ   PHE  10           HZ       PHE  10  -4.662  -1.861  -6.249
   87    H    ILE  11           H        ILE  11 -10.742   2.627  -4.997
   88    HA   ILE  11           HA       ILE  11 -11.112   1.136  -7.385
   89    HB   ILE  11           HB       ILE  11 -12.938   2.976  -5.830
   90   1HG1  ILE  11          2HG1      ILE  11 -12.760  -0.031  -6.202
   91   2HG1  ILE  11          1HG1      ILE  11 -12.343   0.870  -4.744
   92   1HG2  ILE  11          1HG2      ILE  11 -14.785   1.987  -7.217
   93   2HG2  ILE  11          2HG2      ILE  11 -13.559   1.301  -8.282
   94   3HG2  ILE  11          3HG2      ILE  11 -13.717   3.051  -8.132
   95   1HD1  ILE  11          1HD1      ILE  11 -14.621  -0.176  -4.643
   96   2HD1  ILE  11          2HD1      ILE  11 -15.105   0.846  -5.997
   97   3HD1  ILE  11          3HD1      ILE  11 -14.650   1.578  -4.457
   98    H    MET  12           H        MET  12 -10.758   4.594  -6.848
   99    HA   MET  12           HA       MET  12 -11.082   5.003  -9.795
  100   1HB   MET  12          2HB       MET  12 -12.629   6.196  -8.010
  101   2HB   MET  12          1HB       MET  12 -11.240   7.270  -7.840
  102   1HG   MET  12          2HG       MET  12 -11.265   7.724 -10.248
  103   2HG   MET  12          1HG       MET  12 -12.613   6.606 -10.461
  104   1HE   MET  12          1HE       MET  12 -12.577  10.821  -8.734
  105   2HE   MET  12          2HE       MET  12 -11.511  10.116  -9.947
  106   3HE   MET  12          3HE       MET  12 -11.407   9.577  -8.273
  107    H    LYS  13           H        LYS  13  -8.649   4.284  -8.058
  108    HA   LYS  13           HA       LYS  13  -6.918   6.465  -9.131
  109   1HB   LYS  13          2HB       LYS  13  -7.291   6.672  -6.626
  110   2HB   LYS  13          1HB       LYS  13  -6.451   5.130  -6.456
  111   1HG   LYS  13          2HG       LYS  13  -4.482   6.212  -6.543
  112   2HG   LYS  13          1HG       LYS  13  -4.875   6.758  -8.174
  113   1HD   LYS  13          2HD       LYS  13  -6.239   8.229  -6.000
  114   2HD   LYS  13          1HD       LYS  13  -4.490   8.446  -6.067
  115   1HE   LYS  13          2HE       LYS  13  -6.139   8.657  -8.576
  116   2HE   LYS  13          1HE       LYS  13  -6.002  10.034  -7.484
  117   1HZ   LYS  13          1HZ       LYS  13  -3.447   9.066  -7.761
  118   2HZ   LYS  13          2HZ       LYS  13  -4.083  10.473  -8.472
  119   3HZ   LYS  13          3HZ       LYS  13  -4.097   9.004  -9.326
  120    H    CYS  14           H        CYS  14  -6.491   3.343  -7.403
  121    HA   CYS  14           HA       CYS  14  -4.654   2.562  -9.632
  122   1HB   CYS  14          2HB       CYS  14  -4.319   0.961  -7.224
  123   2HB   CYS  14          1HB       CYS  14  -3.113   1.875  -8.122
  124    H    SER  15           H        SER  15  -7.587   2.145  -9.507
  125    HA   SER  15           HA       SER  15  -7.848  -0.760  -9.018
  126   1HB   SER  15          2HB       SER  15  -9.653   1.057  -8.523
  127   2HB   SER  15          1HB       SER  15  -9.980   0.974 -10.250
  128    HG   SER  15           HG       SER  15 -10.346  -0.935  -8.241
  129    H    GLN  16           H        GLN  16  -7.084   1.345 -11.591
  130    HA   GLN  16           HA       GLN  16  -8.086  -0.410 -13.714
  131   1HB   GLN  16          2HB       GLN  16  -6.026   1.733 -14.154
  132   2HB   GLN  16          1HB       GLN  16  -7.351   1.233 -15.203
  133   1HG   GLN  16          2HG       GLN  16  -8.395   3.086 -14.396
  134   2HG   GLN  16          1HG       GLN  16  -8.720   2.072 -12.988
  135   1HE2  GLN  16          1HE2      GLN  16  -8.358   4.974 -12.874
  136   2HE2  GLN  16          2HE2      GLN  16  -6.973   5.268 -11.937
  137    H    CYS  17           H        CYS  17  -4.935   0.442 -12.290
  138    HA   CYS  17           HA       CYS  17  -3.639  -1.663 -13.903
  139   1HB   CYS  17          2HB       CYS  17  -2.681   0.560 -12.127
  140   2HB   CYS  17          1HB       CYS  17  -1.612  -0.813 -12.418
  141    H    HIS  18           H        HIS  18  -4.604  -1.014 -10.551
  142    HA   HIS  18           HA       HIS  18  -3.734  -3.800  -9.864
  143   1HB   HIS  18          2HB       HIS  18  -4.243  -1.454  -8.017
  144   2HB   HIS  18          1HB       HIS  18  -3.780  -3.074  -7.505
  145    HD1  HIS  18           HD1      HIS  18  -1.334  -3.677  -7.624
  146    HD2  HIS  18           HD2      HIS  18  -2.189  -0.054  -9.466
  147    HE1  HIS  18           HE1      HIS  18   0.895  -2.580  -8.094
  148    H    THR  19           H        THR  19  -5.847  -4.542 -10.813
  149    HA   THR  19           HA       THR  19  -8.270  -3.637  -9.450
  150    HB   THR  19           HB       THR  19  -9.448  -4.939 -10.988
  151    HG1  THR  19           HG1      THR  19  -7.337  -6.637 -11.616
  152   1HG2  THR  19          1HG2      THR  19  -6.881  -4.915 -12.541
  153   2HG2  THR  19          2HG2      THR  19  -7.612  -3.388 -12.047
  154   3HG2  THR  19          3HG2      THR  19  -8.509  -4.503 -13.076
  155    H    VAL  20           H        VAL  20  -8.015  -4.131  -7.265
  156    HA   VAL  20           HA       VAL  20  -7.208  -6.826  -6.441
  157    HB   VAL  20           HB       VAL  20  -7.225  -5.971  -4.226
  158   1HG1  VAL  20          1HG1      VAL  20  -6.464  -3.870  -6.254
  159   2HG1  VAL  20          2HG1      VAL  20  -5.406  -4.963  -5.365
  160   3HG1  VAL  20          3HG1      VAL  20  -6.196  -3.625  -4.530
  161   1HG2  VAL  20          1HG2      VAL  20  -8.359  -3.846  -3.631
  162   2HG2  VAL  20          2HG2      VAL  20  -9.504  -5.033  -4.259
  163   3HG2  VAL  20          3HG2      VAL  20  -8.952  -3.710  -5.288
  164    H    GLU  21           H        GLU  21 -10.082  -5.457  -7.493
  165    HA   GLU  21           HA       GLU  21 -11.674  -7.417  -5.888
  166   1HB   GLU  21          2HB       GLU  21 -12.136  -4.607  -6.578
  167   2HB   GLU  21          1HB       GLU  21 -13.501  -5.644  -6.995
  168   1HG   GLU  21          2HG       GLU  21 -12.990  -6.639  -4.563
  169   2HG   GLU  21          1HG       GLU  21 -12.346  -5.015  -4.317
  170    H    LYS  22           H        LYS  22 -10.199  -7.785  -8.492
  171    HA   LYS  22           HA       LYS  22 -12.494  -8.246 -10.333
  172   1HB   LYS  22          2HB       LYS  22 -10.438  -7.065 -11.181
  173   2HB   LYS  22          1HB       LYS  22  -9.530  -8.550 -10.895
  174   1HG   LYS  22          2HG       LYS  22 -10.528  -9.664 -12.643
  175   2HG   LYS  22          1HG       LYS  22 -12.048  -8.788 -12.469
  176   1HD   LYS  22          2HD       LYS  22 -10.129  -6.843 -13.164
  177   2HD   LYS  22          1HD       LYS  22  -9.819  -8.220 -14.223
  178   1HE   LYS  22          2HE       LYS  22 -11.454  -6.918 -15.363
  179   2HE   LYS  22          1HE       LYS  22 -12.348  -8.261 -14.650
  180   1HZ   LYS  22          1HZ       LYS  22 -12.035  -5.623 -13.334
  181   2HZ   LYS  22          2HZ       LYS  22 -13.070  -6.891 -12.877
  182   3HZ   LYS  22          3HZ       LYS  22 -13.362  -6.026 -14.310
  183    H    GLY  23           H        GLY  23  -9.631  -9.978  -9.058
  184   1HA   GLY  23          2HA       GLY  23 -10.416 -12.249  -8.036
  185   2HA   GLY  23          1HA       GLY  23 -11.028 -12.540  -9.665
  186    H    GLY  24           H        GLY  24  -7.978 -11.334  -8.207
  187   1HA   GLY  24          1HA       GLY  24  -5.761 -11.996  -8.607
  188   2HA   GLY  24          2HA       GLY  24  -6.409 -13.511  -9.237
  189    H    LYS  25           H        LYS  25  -7.481 -10.485 -10.597
  190    HA   LYS  25           HA       LYS  25  -6.166 -11.241 -13.151
  191   1HB   LYS  25          2HB       LYS  25  -8.689 -10.578 -12.845
  192   2HB   LYS  25          1HB       LYS  25  -8.062  -8.928 -12.846
  193   1HG   LYS  25          2HG       LYS  25  -8.408  -9.227 -15.118
  194   2HG   LYS  25          1HG       LYS  25  -6.742  -9.790 -14.982
  195   1HD   LYS  25          2HD       LYS  25  -7.306 -11.971 -15.350
  196   2HD   LYS  25          1HD       LYS  25  -8.828 -11.831 -14.468
  197   1HE   LYS  25          2HE       LYS  25  -9.628 -10.381 -16.447
  198   2HE   LYS  25          1HE       LYS  25  -8.237 -11.030 -17.315
  199   1HZ   LYS  25          1HZ       LYS  25  -9.059 -13.279 -16.726
  200   2HZ   LYS  25          2HZ       LYS  25 -10.102 -12.417 -17.754
  201   3HZ   LYS  25          3HZ       LYS  25 -10.464 -12.566 -16.101
  202    H    HIS  26           H        HIS  26  -4.206 -10.318 -13.512
  203    HA   HIS  26           HA       HIS  26  -3.843  -7.479 -12.702
  204   1HB   HIS  26          2HB       HIS  26  -1.409  -8.143 -12.288
  205   2HB   HIS  26          1HB       HIS  26  -2.588  -8.642 -11.084
  206    HD1  HIS  26           HD1      HIS  26  -2.591 -10.585 -14.255
  207    HD2  HIS  26           HD2      HIS  26  -0.770 -10.853 -10.512
  208    HE1  HIS  26           HE1      HIS  26  -1.667 -12.932 -14.075
  209    H    LYS  27           H        LYS  27  -4.200  -6.816 -14.884
  210    HA   LYS  27           HA       LYS  27  -2.544  -7.942 -17.010
  211   1HB   LYS  27          2HB       LYS  27  -4.991  -6.789 -17.053
  212   2HB   LYS  27          1HB       LYS  27  -3.992  -5.397 -17.474
  213   1HG   LYS  27          2HG       LYS  27  -3.812  -6.182 -19.573
  214   2HG   LYS  27          1HG       LYS  27  -2.993  -7.614 -18.946
  215   1HD   LYS  27          2HD       LYS  27  -6.006  -7.346 -18.961
  216   2HD   LYS  27          1HD       LYS  27  -5.109  -8.052 -20.307
  217   1HE   LYS  27          2HE       LYS  27  -4.545  -9.937 -19.125
  218   2HE   LYS  27          1HE       LYS  27  -4.457  -9.075 -17.589
  219   1HZ   LYS  27          1HZ       LYS  27  -6.813 -10.157 -18.977
  220   2HZ   LYS  27          2HZ       LYS  27  -6.994  -8.836 -17.924
  221   3HZ   LYS  27          3HZ       LYS  27  -6.365 -10.306 -17.348
  222    H    THR  28           H        THR  28  -2.997  -4.538 -15.979
  223    HA   THR  28           HA       THR  28  -0.220  -3.977 -16.819
  224    HB   THR  28           HB       THR  28  -2.382  -2.142 -15.745
  225    HG1  THR  28           HG1      THR  28  -1.413  -2.061 -18.350
  226   1HG2  THR  28          1HG2      THR  28  -0.158  -1.243 -15.296
  227   2HG2  THR  28          2HG2      THR  28  -0.890  -0.346 -16.626
  228   3HG2  THR  28          3HG2      THR  28   0.337  -1.569 -16.958
  229    H    GLY  29           H        GLY  29  -2.164  -3.265 -13.887
  230   1HA   GLY  29          2HA       GLY  29   0.334  -3.075 -12.331
  231   2HA   GLY  29          1HA       GLY  29  -1.275  -2.679 -11.740
  232    HA   PRO  30           HA       PRO  30   0.169  -7.185 -10.794
  233   1HB   PRO  30          2HB       PRO  30   1.303  -6.786  -8.334
  234   2HB   PRO  30          1HB       PRO  30   2.218  -6.842  -9.844
  235   1HG   PRO  30          2HG       PRO  30   1.383  -4.440  -8.243
  236   2HG   PRO  30          1HG       PRO  30   2.874  -4.709  -9.168
  237   1HD   PRO  30          2HD       PRO  30   0.783  -3.185 -10.119
  238   2HD   PRO  30          1HD       PRO  30   1.912  -4.061 -11.167
  239    H    ASN  31           H        ASN  31  -1.320  -8.400  -9.812
  240    HA   ASN  31           HA       ASN  31  -3.706  -7.373  -8.757
  241   1HB   ASN  31          2HB       ASN  31  -3.653  -9.653  -9.478
  242   2HB   ASN  31          1HB       ASN  31  -2.370 -10.053  -8.335
  243   1HD2  ASN  31          1HD2      ASN  31  -5.659  -8.536  -8.150
  244   2HD2  ASN  31          2HD2      ASN  31  -6.138  -9.418  -6.782
  245    H    LEU  32           H        LEU  32  -3.531  -5.866  -7.109
  246    HA   LEU  32           HA       LEU  32  -1.865  -6.371  -4.768
  247   1HB   LEU  32          2HB       LEU  32  -3.398  -4.129  -5.872
  248   2HB   LEU  32          1HB       LEU  32  -3.524  -4.255  -4.119
  249    HG   LEU  32           HG       LEU  32  -1.218  -3.973  -3.800
  250   1HD1  LEU  32          1HD1      LEU  32   0.146  -3.994  -6.171
  251   2HD1  LEU  32          2HD1      LEU  32  -1.079  -5.228  -6.467
  252   3HD1  LEU  32          3HD1      LEU  32   0.013  -5.384  -5.092
  253   1HD2  LEU  32          1HD2      LEU  32  -0.632  -2.229  -5.807
  254   2HD2  LEU  32          2HD2      LEU  32  -1.645  -1.815  -4.423
  255   3HD2  LEU  32          3HD2      LEU  32  -2.389  -2.299  -5.947
  256    H    HIS  33           H        HIS  33  -3.134  -8.498  -4.419
  257    HA   HIS  33           HA       HIS  33  -5.797  -8.121  -3.203
  258   1HB   HIS  33          2HB       HIS  33  -4.889 -10.143  -4.674
  259   2HB   HIS  33          1HB       HIS  33  -4.329 -10.728  -3.108
  260    HD1  HIS  33           HD1      HIS  33  -7.569  -9.238  -4.495
  261    HD2  HIS  33           HD2      HIS  33  -6.284 -12.181  -1.837
  262    HE1  HIS  33           HE1      HIS  33  -9.657 -10.370  -3.616
  263    H    GLY  34           H        GLY  34  -2.549  -9.220  -2.206
  264   1HA   GLY  34          2HA       GLY  34  -3.251  -8.409   0.574
  265   2HA   GLY  34          1HA       GLY  34  -2.568 -10.012   0.296
  266    H    LEU  35           H        LEU  35  -1.691  -7.007  -1.377
  267    HA   LEU  35           HA       LEU  35   1.086  -7.438  -1.279
  268   1HB   LEU  35          2HB       LEU  35  -0.058  -5.716  -2.686
  269   2HB   LEU  35          1HB       LEU  35  -0.295  -4.742  -1.234
  270    HG   LEU  35           HG       LEU  35   2.333  -5.182  -0.981
  271   1HD1  LEU  35          1HD1      LEU  35   1.647  -5.852  -3.779
  272   2HD1  LEU  35          2HD1      LEU  35   3.054  -6.317  -2.822
  273   3HD1  LEU  35          3HD1      LEU  35   2.995  -4.731  -3.590
  274   1HD2  LEU  35          1HD2      LEU  35   0.765  -3.109  -2.469
  275   2HD2  LEU  35          2HD2      LEU  35   2.525  -3.040  -2.552
  276   3HD2  LEU  35          3HD2      LEU  35   1.714  -2.948  -0.990
  277    H    PHE  36           H        PHE  36  -1.068  -6.143   1.157
  278    HA   PHE  36           HA       PHE  36   0.926  -4.913   2.818
  279   1HB   PHE  36          2HB       PHE  36  -1.869  -5.928   3.259
  280   2HB   PHE  36          1HB       PHE  36  -0.888  -5.435   4.640
  281    HD1  PHE  36           HD1      PHE  36  -1.775  -3.361   5.324
  282    HD2  PHE  36           HD2      PHE  36  -0.967  -4.065   1.164
  283    HE1  PHE  36           HE1      PHE  36  -2.265  -0.982   4.826
  284    HE2  PHE  36           HE2      PHE  36  -1.459  -1.687   0.666
  285    HZ   PHE  36           HZ       PHE  36  -2.107  -0.144   2.497
  286    H    GLY  37           H        GLY  37   2.268  -5.792   4.352
  287   1HA   GLY  37          2HA       GLY  37   3.403  -7.433   5.582
  288   2HA   GLY  37          1HA       GLY  37   1.875  -8.310   5.638
  289    H    ARG  38           H        ARG  38   3.002  -7.530   2.486
  290    HA   ARG  38           HA       ARG  38   4.228 -10.235   2.202
  291   1HB   ARG  38          2HB       ARG  38   1.818 -10.213   1.434
  292   2HB   ARG  38          1HB       ARG  38   2.288  -9.038   0.207
  293   1HG   ARG  38          2HG       ARG  38   4.039 -10.693  -0.572
  294   2HG   ARG  38          1HG       ARG  38   3.307 -11.874   0.514
  295   1HD   ARG  38          2HD       ARG  38   1.571 -12.237  -0.889
  296   2HD   ARG  38          1HD       ARG  38   1.332 -10.511  -1.163
  297    HE   ARG  38           HE       ARG  38   2.878 -12.317  -2.858
  298   1HH1  ARG  38          1HH2      ARG  38   2.821  -9.133  -1.569
  299   2HH1  ARG  38          2HH2      ARG  38   3.331  -8.378  -3.041
  300   1HH2  ARG  38          1HH1      ARG  38   3.356 -11.328  -4.859
  301   2HH2  ARG  38          2HH1      ARG  38   3.632  -9.619  -4.901
  302    H    LYS  39           H        LYS  39   6.056 -10.231   0.942
  303    HA   LYS  39           HA       LYS  39   7.292  -7.744   0.241
  304   1HB   LYS  39          2HB       LYS  39   7.891 -10.636  -0.211
  305   2HB   LYS  39          1HB       LYS  39   8.752  -9.453  -1.197
  306   1HG   LYS  39          2HG       LYS  39  10.168  -9.223   0.545
  307   2HG   LYS  39          1HG       LYS  39   8.857  -8.374   1.366
  308   1HD   LYS  39          2HD       LYS  39   8.973 -10.009   2.923
  309   2HD   LYS  39          1HD       LYS  39   8.193 -11.040   1.724
  310   1HE   LYS  39          2HE       LYS  39  11.158 -10.689   1.556
  311   2HE   LYS  39          1HE       LYS  39  10.516 -11.733   2.825
  312   1HZ   LYS  39          1HZ       LYS  39  10.003 -11.971  -0.090
  313   2HZ   LYS  39          2HZ       LYS  39   9.259 -12.926   1.102
  314   3HZ   LYS  39          3HZ       LYS  39  10.937 -13.021   0.859
  315    H    THR  40           H        THR  40   8.289  -7.800  -2.228
  316    HA   THR  40           HA       THR  40   6.236  -6.874  -3.919
  317    HB   THR  40           HB       THR  40   7.850  -6.778  -5.625
  318    HG1  THR  40           HG1      THR  40   8.962  -9.053  -4.361
  319   1HG2  THR  40          1HG2      THR  40   9.750  -5.881  -4.587
  320   2HG2  THR  40          2HG2      THR  40   9.712  -7.066  -3.282
  321   3HG2  THR  40          3HG2      THR  40   8.528  -5.761  -3.320
  322    H    GLY  41           H        GLY  41   6.254  -8.189  -6.333
  323   1HA   GLY  41          2HA       GLY  41   5.413 -10.972  -5.668
  324   2HA   GLY  41          1HA       GLY  41   4.348  -9.929  -6.607
  325    H    GLN  42           H        GLN  42   4.983 -12.163  -7.854
  326    HA   GLN  42           HA       GLN  42   6.553 -11.288 -10.142
  327   1HB   GLN  42          2HB       GLN  42   7.967 -13.500  -9.934
  328   2HB   GLN  42          1HB       GLN  42   8.484 -12.054  -9.070
  329   1HG   GLN  42          2HG       GLN  42   6.582 -13.492  -7.454
  330   2HG   GLN  42          1HG       GLN  42   7.861 -14.592  -7.969
  331   1HE2  GLN  42          1HE2      GLN  42   7.109 -12.507  -5.499
  332   2HE2  GLN  42          2HE2      GLN  42   8.674 -12.058  -5.020
  333    H    ALA  43           H        ALA  43   3.937 -11.840 -10.176
  334    HA   ALA  43           HA       ALA  43   2.933 -14.408 -10.364
  335   1HB   ALA  43          1HB       ALA  43   2.204 -11.835 -11.403
  336   2HB   ALA  43          2HB       ALA  43   1.166 -13.228 -11.100
  337   3HB   ALA  43          3HB       ALA  43   1.957 -13.042 -12.665
  338    HA   PRO  44           HA       PRO  44   4.843 -16.495 -13.699
  339   1HB   PRO  44          2HB       PRO  44   2.711 -17.722 -14.934
  340   2HB   PRO  44          1HB       PRO  44   3.375 -18.239 -13.374
  341   1HG   PRO  44          2HG       PRO  44   0.860 -16.730 -13.938
  342   2HG   PRO  44          1HG       PRO  44   1.239 -17.815 -12.590
  343   1HD   PRO  44          2HD       PRO  44   1.241 -15.001 -12.468
  344   2HD   PRO  44          1HD       PRO  44   1.990 -16.088 -11.278
  345    H    GLY  45           H        GLY  45   1.751 -15.437 -15.177
  346   1HA   GLY  45          2HA       GLY  45   3.156 -14.705 -17.642
  347   2HA   GLY  45          1HA       GLY  45   1.421 -14.561 -17.357
  348    H    TYR  46           H        TYR  46   3.096 -13.231 -14.770
  349    HA   TYR  46           HA       TYR  46   3.091 -10.510 -15.998
  350   1HB   TYR  46          2HB       TYR  46   1.044 -10.909 -14.613
  351   2HB   TYR  46          1HB       TYR  46   2.081 -11.226 -13.231
  352    HD1  TYR  46           HD1      TYR  46   4.031  -8.826 -14.606
  353    HD2  TYR  46           HD2      TYR  46   0.070  -9.173 -13.018
  354    HE1  TYR  46           HE1      TYR  46   4.040  -6.438 -14.076
  355    HE2  TYR  46           HE2      TYR  46   0.094  -6.762 -12.504
  356    HH   TYR  46           HH       TYR  46   1.199  -4.854 -12.702
  357    H    SER  47           H        SER  47   5.281 -10.138 -16.034
  358    HA   SER  47           HA       SER  47   7.033 -10.993 -13.863
  359   1HB   SER  47          2HB       SER  47   7.942 -10.757 -16.131
  360   2HB   SER  47          1HB       SER  47   7.467  -9.061 -16.168
  361    HG   SER  47           HG       SER  47   9.540 -10.333 -14.793
  362    H    TYR  48           H        TYR  48   5.869 -10.009 -12.082
  363    HA   TYR  48           HA       TYR  48   4.994  -7.429 -11.712
  364   1HB   TYR  48          2HB       TYR  48   6.223  -9.465  -9.973
  365   2HB   TYR  48          1HB       TYR  48   6.178  -7.832  -9.322
  366    HD1  TYR  48           HD1      TYR  48   3.696  -9.182 -11.712
  367    HD2  TYR  48           HD2      TYR  48   4.572  -8.247  -7.633
  368    HE1  TYR  48           HE1      TYR  48   1.310  -9.540 -11.125
  369    HE2  TYR  48           HE2      TYR  48   2.188  -8.601  -7.027
  370    HH   TYR  48           HH       TYR  48   0.056 -10.216  -8.866
  371    H    THR  49           H        THR  49   6.217  -5.730 -10.232
  372    HA   THR  49           HA       THR  49   8.360  -4.625 -11.745
  373    HB   THR  49           HB       THR  49   8.381  -3.908  -8.893
  374    HG1  THR  49           HG1      THR  49   6.321  -3.334  -8.726
  375   1HG2  THR  49          1HG2      THR  49   7.448  -1.994 -10.924
  376   2HG2  THR  49          2HG2      THR  49   9.011  -2.725 -11.289
  377   3HG2  THR  49          3HG2      THR  49   8.777  -1.855  -9.773
  378    H    ALA  50           H        ALA  50   9.855  -6.360 -12.033
  379    HA   ALA  50           HA       ALA  50  11.053  -7.948 -10.058
  380   1HB   ALA  50          1HB       ALA  50  12.459  -8.605 -11.731
  381   2HB   ALA  50          2HB       ALA  50  12.897  -6.948 -12.144
  382   3HB   ALA  50          3HB       ALA  50  11.395  -7.642 -12.755
  383    H    ALA  51           H        ALA  51  11.842  -4.649 -11.080
  384    HA   ALA  51           HA       ALA  51  14.246  -4.247  -9.715
  385   1HB   ALA  51          1HB       ALA  51  13.222  -2.512 -11.111
  386   2HB   ALA  51          2HB       ALA  51  13.547  -1.872  -9.502
  387   3HB   ALA  51          3HB       ALA  51  11.906  -2.333  -9.953
  388    H    ASN  52           H        ASN  52  11.109  -3.205  -8.300
  389    HA   ASN  52           HA       ASN  52  11.904  -2.924  -5.663
  390   1HB   ASN  52          2HB       ASN  52   9.432  -3.206  -7.018
  391   2HB   ASN  52          1HB       ASN  52   9.403  -4.367  -5.691
  392   1HD2  ASN  52          1HD2      ASN  52  11.172  -2.790  -3.932
  393   2HD2  ASN  52          2HD2      ASN  52  10.262  -1.457  -3.405
  394    H    LYS  53           H        LYS  53  10.677  -5.966  -7.088
  395    HA   LYS  53           HA       LYS  53  10.878  -7.727  -5.001
  396   1HB   LYS  53          2HB       LYS  53  10.216  -8.600  -7.107
  397   2HB   LYS  53          1HB       LYS  53  11.707  -8.071  -7.884
  398   1HG   LYS  53          2HG       LYS  53  11.701 -10.519  -7.456
  399   2HG   LYS  53          1HG       LYS  53  12.996  -9.699  -6.582
  400   1HD   LYS  53          2HD       LYS  53  11.534  -9.625  -4.561
  401   2HD   LYS  53          1HD       LYS  53  10.320 -10.554  -5.441
  402   1HE   LYS  53          2HE       LYS  53  11.387 -12.370  -4.593
  403   2HE   LYS  53          1HE       LYS  53  12.582 -12.057  -5.852
  404   1HZ   LYS  53          1HZ       LYS  53  13.621 -12.252  -3.682
  405   2HZ   LYS  53          2HZ       LYS  53  12.662 -10.985  -3.083
  406   3HZ   LYS  53          3HZ       LYS  53  13.814 -10.683  -4.295
  407    H    ASN  54           H        ASN  54  13.662  -6.661  -6.980
  408    HA   ASN  54           HA       ASN  54  15.541  -8.175  -5.392
  409   1HB   ASN  54          2HB       ASN  54  16.163  -7.737  -7.659
  410   2HB   ASN  54          1HB       ASN  54  15.874  -6.007  -7.471
  411   1HD2  ASN  54          1HD2      ASN  54  17.596  -4.726  -6.672
  412   2HD2  ASN  54          2HD2      ASN  54  19.085  -5.362  -6.164
  413    H    LYS  55           H        LYS  55  14.390  -4.828  -5.368
  414    HA   LYS  55           HA       LYS  55  16.342  -3.672  -3.705
  415   1HB   LYS  55          2HB       LYS  55  14.629  -2.265  -4.630
  416   2HB   LYS  55          1HB       LYS  55  13.354  -3.205  -3.853
  417   1HG   LYS  55          2HG       LYS  55  13.687  -1.191  -2.554
  418   2HG   LYS  55          1HG       LYS  55  14.325  -2.548  -1.626
  419   1HD   LYS  55          2HD       LYS  55  16.577  -2.000  -2.171
  420   2HD   LYS  55          1HD       LYS  55  16.076  -0.887  -3.444
  421   1HE   LYS  55          2HE       LYS  55  14.782   0.098  -1.195
  422   2HE   LYS  55          1HE       LYS  55  16.350  -0.415  -0.570
  423   1HZ   LYS  55          1HZ       LYS  55  17.206   1.415  -1.443
  424   2HZ   LYS  55          2HZ       LYS  55  15.725   1.829  -2.168
  425   3HZ   LYS  55          3HZ       LYS  55  16.831   0.837  -2.992
  426    H    GLY  56           H        GLY  56  14.075  -6.169  -2.972
  427   1HA   GLY  56          1HA       GLY  56  13.705  -7.358  -0.979
  428   2HA   GLY  56          2HA       GLY  56  15.192  -6.624  -0.372
  429    H    ILE  57           H        ILE  57  12.002  -5.352  -1.348
  430    HA   ILE  57           HA       ILE  57  12.001  -3.743   1.169
  431    HB   ILE  57           HB       ILE  57  11.874  -2.647  -1.159
  432   1HG1  ILE  57          2HG1      ILE  57  11.236  -1.616   1.088
  433   2HG1  ILE  57          1HG1      ILE  57  10.478  -0.897  -0.331
  434   1HG2  ILE  57          1HG2      ILE  57   9.533  -2.548  -2.069
  435   2HG2  ILE  57          2HG2      ILE  57   9.095  -3.837  -0.948
  436   3HG2  ILE  57          3HG2      ILE  57  10.285  -4.136  -2.214
  437   1HD1  ILE  57          1HD1      ILE  57   8.785  -3.019   0.462
  438   2HD1  ILE  57          2HD1      ILE  57   8.473  -1.291   0.604
  439   3HD1  ILE  57          3HD1      ILE  57   9.225  -2.164   1.938
  440    H    ILE  58           H        ILE  58  10.317  -3.961   2.622
  441    HA   ILE  58           HA       ILE  58   8.368  -6.134   2.046
  442    HB   ILE  58           HB       ILE  58   9.792  -6.111   4.176
  443   1HG1  ILE  58          2HG1      ILE  58   7.720  -7.464   3.897
  444   2HG1  ILE  58          1HG1      ILE  58   7.945  -6.926   5.561
  445   1HG2  ILE  58          1HG2      ILE  58   7.812  -4.232   5.360
  446   2HG2  ILE  58          2HG2      ILE  58   9.100  -3.524   4.383
  447   3HG2  ILE  58          3HG2      ILE  58   9.499  -4.509   5.790
  448   1HD1  ILE  58          1HD1      ILE  58   6.026  -5.852   3.493
  449   2HD1  ILE  58          2HD1      ILE  58   6.462  -4.916   4.923
  450   3HD1  ILE  58          3HD1      ILE  58   5.664  -6.478   5.101
  451    H    TRP  59           H        TRP  59   6.661  -5.243   0.955
  452    HA   TRP  59           HA       TRP  59   5.794  -2.603   0.967
  453   1HB   TRP  59          2HB       TRP  59   4.249  -5.171   0.605
  454   2HB   TRP  59          1HB       TRP  59   3.487  -3.591   0.422
  455    HD1  TRP  59           HD1      TRP  59   4.607  -6.020  -1.772
  456    HE1  TRP  59           HE1      TRP  59   5.722  -5.091  -3.901
  457    HE3  TRP  59           HE3      TRP  59   5.591  -1.239  -0.253
  458    HZ2  TRP  59           HZ2      TRP  59   6.882  -2.654  -4.838
  459    HZ3  TRP  59           HZ3      TRP  59   6.702   0.359  -1.785
  460    HH2  TRP  59           HH2      TRP  59   7.346  -0.341  -4.073
  461    H    GLY  60           H        GLY  60   5.582  -1.486   2.852
  462   1HA   GLY  60          1HA       GLY  60   3.612  -2.553   4.836
  463   2HA   GLY  60          2HA       GLY  60   5.073  -1.701   5.343
  464    H    GLU  61           H        GLU  61   3.429  -0.208   6.380
  465    HA   GLU  61           HA       GLU  61   1.751   1.422   4.656
  466   1HB   GLU  61          2HB       GLU  61   2.665   1.985   7.494
  467   2HB   GLU  61          1HB       GLU  61   1.295   2.725   6.664
  468   1HG   GLU  61          2HG       GLU  61   0.440   0.293   6.359
  469   2HG   GLU  61          1HG       GLU  61   1.595  -0.115   7.627
  470    H    ASP  62           H        ASP  62   4.693   2.176   6.567
  471    HA   ASP  62           HA       ASP  62   5.045   4.723   5.252
  472   1HB   ASP  62          2HB       ASP  62   5.904   3.969   7.580
  473   2HB   ASP  62          1HB       ASP  62   7.237   3.238   6.684
  474    H    THR  63           H        THR  63   6.477   1.497   4.846
  475    HA   THR  63           HA       THR  63   8.506   2.217   3.000
  476    HB   THR  63           HB       THR  63   7.685  -0.283   2.150
  477    HG1  THR  63           HG1      THR  63   7.421  -1.079   4.531
  478   1HG2  THR  63          1HG2      THR  63   9.610   0.796   4.152
  479   2HG2  THR  63          2HG2      THR  63   9.916  -0.138   2.688
  480   3HG2  THR  63          3HG2      THR  63   9.341  -0.946   4.146
  481    H    LEU  64           H        LEU  64   5.066   1.502   2.506
  482    HA   LEU  64           HA       LEU  64   5.275   1.682  -0.398
  483   1HB   LEU  64          2HB       LEU  64   3.354   0.758   1.409
  484   2HB   LEU  64          1HB       LEU  64   2.616   2.181   0.678
  485    HG   LEU  64           HG       LEU  64   3.835  -0.155  -0.822
  486   1HD1  LEU  64          1HD1      LEU  64   1.332   0.100   0.398
  487   2HD1  LEU  64          2HD1      LEU  64   1.770  -1.062  -0.854
  488   3HD1  LEU  64          3HD1      LEU  64   1.033   0.477  -1.299
  489   1HD2  LEU  64          1HD2      LEU  64   2.800   2.539  -1.632
  490   2HD2  LEU  64          2HD2      LEU  64   2.497   1.168  -2.701
  491   3HD2  LEU  64          3HD2      LEU  64   4.152   1.617  -2.289
  492    H    MET  65           H        MET  65   4.399   3.856   2.256
  493    HA   MET  65           HA       MET  65   3.341   5.995   0.736
  494   1HB   MET  65          2HB       MET  65   3.509   5.754   3.302
  495   2HB   MET  65          1HB       MET  65   5.139   6.405   3.128
  496   1HG   MET  65          2HG       MET  65   4.180   8.375   1.928
  497   2HG   MET  65          1HG       MET  65   2.564   7.742   2.248
  498   1HE   MET  65          1HE       MET  65   1.598   7.241   4.264
  499   2HE   MET  65          2HE       MET  65   1.867   8.035   5.814
  500   3HE   MET  65          3HE       MET  65   2.798   6.600   5.393
  501    H    GLU  66           H        GLU  66   6.626   4.892   1.181
  502    HA   GLU  66           HA       GLU  66   7.808   7.291   0.018
  503   1HB   GLU  66          2HB       GLU  66   8.879   5.664   1.740
  504   2HB   GLU  66          1HB       GLU  66   9.217   4.650   0.337
  505   1HG   GLU  66          2HG       GLU  66  10.998   5.924  -0.164
  506   2HG   GLU  66          1HG       GLU  66   9.949   7.333  -0.320
  507    H    TYR  67           H        TYR  67   7.528   3.863  -0.981
  508    HA   TYR  67           HA       TYR  67   8.557   4.211  -3.606
  509   1HB   TYR  67          2HB       TYR  67   8.296   1.978  -2.791
  510   2HB   TYR  67          1HB       TYR  67   6.582   2.227  -2.458
  511    HD1  TYR  67           HD1      TYR  67   5.176   1.124  -3.941
  512    HD2  TYR  67           HD2      TYR  67   8.863   2.774  -5.401
  513    HE1  TYR  67           HE1      TYR  67   4.612   0.357  -6.229
  514    HE2  TYR  67           HE2      TYR  67   8.300   2.006  -7.690
  515    HH   TYR  67           HH       TYR  67   6.738   0.025  -8.630
  516    H    LEU  68           H        LEU  68   5.582   5.231  -2.226
  517    HA   LEU  68           HA       LEU  68   4.304   5.517  -4.887
  518   1HB   LEU  68          2HB       LEU  68   3.270   4.943  -2.368
  519   2HB   LEU  68          1HB       LEU  68   2.853   6.640  -2.611
  520    HG   LEU  68           HG       LEU  68   2.146   5.809  -5.013
  521   1HD1  LEU  68          1HD1      LEU  68   3.053   3.440  -4.176
  522   2HD1  LEU  68          2HD1      LEU  68   1.669   3.561  -5.263
  523   3HD1  LEU  68          3HD1      LEU  68   1.414   3.314  -3.535
  524   1HD2  LEU  68          1HD2      LEU  68   0.576   6.798  -3.461
  525   2HD2  LEU  68          2HD2      LEU  68   0.578   5.347  -2.458
  526   3HD2  LEU  68          3HD2      LEU  68  -0.142   5.307  -4.067
  527    H    GLU  69           H        GLU  69   5.615   7.432  -2.220
  528    HA   GLU  69           HA       GLU  69   4.823  10.005  -3.131
  529   1HB   GLU  69          2HB       GLU  69   6.122   9.161  -0.970
  530   2HB   GLU  69          1HB       GLU  69   7.531   9.567  -1.940
  531   1HG   GLU  69          2HG       GLU  69   6.800  11.846  -2.198
  532   2HG   GLU  69          1HG       GLU  69   5.229  11.480  -1.486
  533    H    ASN  70           H        ASN  70   7.140   7.712  -4.224
  534    HA   ASN  70           HA       ASN  70   7.594   9.025  -6.722
  535   1HB   ASN  70          2HB       ASN  70   8.969  10.416  -4.970
  536   2HB   ASN  70          1HB       ASN  70  10.077   9.044  -5.020
  537   1HD2  ASN  70          1HD2      ASN  70  11.205  11.316  -5.969
  538   2HD2  ASN  70          2HD2      ASN  70  11.259  11.336  -7.666
  539    HA   PRO  71           HA       PRO  71   8.582   4.580  -6.509
  540   1HB   PRO  71          2HB       PRO  71   7.242   3.982  -8.843
  541   2HB   PRO  71          1HB       PRO  71   6.482   4.008  -7.243
  542   1HG   PRO  71          2HG       PRO  71   6.256   5.991  -9.456
  543   2HG   PRO  71          1HG       PRO  71   5.116   5.630  -8.153
  544   1HD   PRO  71          2HD       PRO  71   6.862   7.853  -8.239
  545   2HD   PRO  71          1HD       PRO  71   5.974   7.280  -6.811
  546    H    LYS  72           H        LYS  72   8.727   6.793  -9.297
  547    HA   LYS  72           HA       LYS  72  10.664   5.254 -10.761
  548   1HB   LYS  72          2HB       LYS  72   9.219   7.142 -11.683
  549   2HB   LYS  72          1HB       LYS  72  10.318   8.260 -10.873
  550   1HG   LYS  72          2HG       LYS  72  12.136   6.730 -12.138
  551   2HG   LYS  72          1HG       LYS  72  10.786   6.534 -13.256
  552   1HD   LYS  72          2HD       LYS  72  10.707   8.812 -13.772
  553   2HD   LYS  72          1HD       LYS  72  11.504   9.281 -12.269
  554   1HE   LYS  72          2HE       LYS  72  13.490   7.825 -13.320
  555   2HE   LYS  72          1HE       LYS  72  12.697   8.299 -14.822
  556   1HZ   LYS  72          1HZ       LYS  72  12.720  10.607 -13.468
  557   2HZ   LYS  72          2HZ       LYS  72  13.913  10.146 -14.585
  558   3HZ   LYS  72          3HZ       LYS  72  14.165   9.908 -12.922
  559    H    LYS  73           H        LYS  73  10.832   7.112  -7.912
  560    HA   LYS  73           HA       LYS  73  13.747   7.608  -8.211
  561   1HB   LYS  73          2HB       LYS  73  12.651   9.530  -7.361
  562   2HB   LYS  73          1HB       LYS  73  11.637   8.576  -6.280
  563   1HG   LYS  73          2HG       LYS  73  13.436   9.723  -5.034
  564   2HG   LYS  73          1HG       LYS  73  13.614   7.970  -4.943
  565   1HD   LYS  73          2HD       LYS  73  15.793   8.712  -5.454
  566   2HD   LYS  73          1HD       LYS  73  15.146   8.235  -7.024
  567   1HE   LYS  73          2HE       LYS  73  16.084  10.354  -7.448
  568   2HE   LYS  73          1HE       LYS  73  14.372  10.707  -7.213
  569   1HZ   LYS  73          1HZ       LYS  73  16.362  10.821  -5.020
  570   2HZ   LYS  73          2HZ       LYS  73  14.770  11.413  -5.013
  571   3HZ   LYS  73          3HZ       LYS  73  15.956  12.168  -5.967
  572    H    TYR  74           H        TYR  74  11.414   5.696  -6.395
  573    HA   TYR  74           HA       TYR  74  13.464   4.627  -4.581
  574   1HB   TYR  74          2HB       TYR  74  10.986   4.952  -4.003
  575   2HB   TYR  74          1HB       TYR  74  10.667   3.552  -5.023
  576    HD1  TYR  74           HD1      TYR  74  13.401   4.358  -2.576
  577    HD2  TYR  74           HD2      TYR  74  10.228   1.689  -3.698
  578    HE1  TYR  74           HE1      TYR  74  14.002   2.854  -0.698
  579    HE2  TYR  74           HE2      TYR  74  10.828   0.185  -1.820
  580    HH   TYR  74           HH       TYR  74  12.237  -0.198  -0.151
  581    H    ILE  75           H        ILE  75  11.161   2.881  -6.683
  582    HA   ILE  75           HA       ILE  75  13.129   0.778  -7.138
  583    HB   ILE  75           HB       ILE  75  10.445   1.084  -8.477
  584   1HG1  ILE  75          2HG1      ILE  75  10.069   1.499  -6.104
  585   2HG1  ILE  75          1HG1      ILE  75   9.523  -0.134  -6.488
  586   1HG2  ILE  75          1HG2      ILE  75  11.080  -1.518  -7.515
  587   2HG2  ILE  75          2HG2      ILE  75  12.490  -0.888  -8.365
  588   3HG2  ILE  75          3HG2      ILE  75  10.930  -0.977  -9.186
  589   1HD1  ILE  75          1HD1      ILE  75  12.267   0.513  -5.380
  590   2HD1  ILE  75          2HD1      ILE  75  11.565  -1.088  -5.603
  591   3HD1  ILE  75          3HD1      ILE  75  10.902   0.003  -4.388
  592    HA   PRO  76           HA       PRO  76  14.445   3.016 -10.815
  593   1HB   PRO  76          2HB       PRO  76  16.655   1.441 -11.257
  594   2HB   PRO  76          1HB       PRO  76  16.620   2.772 -10.087
  595   1HG   PRO  76          2HG       PRO  76  16.541  -0.168  -9.589
  596   2HG   PRO  76          1HG       PRO  76  17.137   1.132  -8.542
  597   1HD   PRO  76          2HD       PRO  76  14.646  -0.185  -8.289
  598   2HD   PRO  76          1HD       PRO  76  15.111   1.328  -7.482
  599    H    GLY  77           H        GLY  77  12.530   2.122 -11.968
  600   1HA   GLY  77          2HA       GLY  77  12.724   0.956 -14.321
  601   2HA   GLY  77          1HA       GLY  77  13.011  -0.477 -13.335
  602    H    THR  78           H        THR  78  11.003   1.201 -11.438
  603    HA   THR  78           HA       THR  78   8.774  -0.428 -11.638
  604    HB   THR  78           HB       THR  78   9.102   1.346  -9.900
  605    HG1  THR  78           HG1      THR  78   6.635   2.006 -10.879
  606   1HG2  THR  78          1HG2      THR  78   8.570   3.632 -10.371
  607   2HG2  THR  78          2HG2      THR  78   7.965   3.228 -11.977
  608   3HG2  THR  78          3HG2      THR  78   9.691   3.118 -11.633
  609    H    LYS  79           H        LYS  79   6.874  -0.445 -12.872
  610    HA   LYS  79           HA       LYS  79   7.001   1.177 -15.373
  611   1HB   LYS  79          2HB       LYS  79   5.959  -1.533 -14.690
  612   2HB   LYS  79          1HB       LYS  79   5.080  -0.619 -15.918
  613   1HG   LYS  79          2HG       LYS  79   8.007  -0.529 -16.225
  614   2HG   LYS  79          1HG       LYS  79   7.315  -2.142 -16.411
  615   1HD   LYS  79          2HD       LYS  79   6.271  -1.602 -18.356
  616   2HD   LYS  79          1HD       LYS  79   5.798  -0.008 -17.766
  617   1HE   LYS  79          2HE       LYS  79   8.699  -0.452 -18.273
  618   2HE   LYS  79          1HE       LYS  79   7.650  -0.324 -19.686
  619   1HZ   LYS  79          1HZ       LYS  79   8.428   1.696 -17.777
  620   2HZ   LYS  79          2HZ       LYS  79   6.768   1.687 -18.138
  621   3HZ   LYS  79          3HZ       LYS  79   7.910   1.863 -19.384
  622    H    MET  80           H        MET  80   5.847   1.789 -12.540
  623    HA   MET  80           HA       MET  80   3.013   1.961 -12.738
  624   1HB   MET  80          2HB       MET  80   4.954   3.786 -11.288
  625   2HB   MET  80          1HB       MET  80   3.214   3.778 -11.052
  626   1HG   MET  80          2HG       MET  80   4.186   1.095 -10.843
  627   2HG   MET  80          1HG       MET  80   5.148   2.114  -9.786
  628   1HE   MET  80          1HE       MET  80   1.816   4.140  -9.537
  629   2HE   MET  80          2HE       MET  80   3.524   4.323  -9.144
  630   3HE   MET  80          3HE       MET  80   2.359   4.014  -7.858
  631    H    ILE  81           H        ILE  81   1.780   3.188 -14.081
  632    HA   ILE  81           HA       ILE  81   3.073   5.402 -15.576
  633    HB   ILE  81           HB       ILE  81   0.225   4.406 -15.850
  634   1HG1  ILE  81          2HG1      ILE  81   2.789   3.387 -17.098
  635   2HG1  ILE  81          1HG1      ILE  81   1.589   2.464 -16.195
  636   1HG2  ILE  81          1HG2      ILE  81   0.337   5.432 -18.026
  637   2HG2  ILE  81          2HG2      ILE  81   2.071   5.711 -17.865
  638   3HG2  ILE  81          3HG2      ILE  81   0.936   6.618 -16.866
  639   1HD1  ILE  81          1HD1      ILE  81   0.150   3.676 -18.278
  640   2HD1  ILE  81          2HD1      ILE  81   0.607   1.976 -18.163
  641   3HD1  ILE  81          3HD1      ILE  81   1.647   3.111 -19.023
  642    H    PHE  82           H        PHE  82   2.264   5.338 -12.647
  643    HA   PHE  82           HA       PHE  82   0.026   6.989 -12.143
  644   1HB   PHE  82          2HB       PHE  82   1.898   5.683 -10.629
  645   2HB   PHE  82          1HB       PHE  82   2.355   7.363 -10.370
  646    HD1  PHE  82           HD1      PHE  82  -0.901   5.541 -10.803
  647    HD2  PHE  82           HD2      PHE  82   1.455   8.225  -8.418
  648    HE1  PHE  82           HE1      PHE  82  -2.807   5.823  -9.236
  649    HE2  PHE  82           HE2      PHE  82  -0.449   8.506  -6.850
  650    HZ   PHE  82           HZ       PHE  82  -2.580   7.305  -7.260
  651    H    VAL  83           H        VAL  83   0.049   9.279 -11.470
  652    HA   VAL  83           HA       VAL  83   1.709  10.889 -13.291
  653    HB   VAL  83           HB       VAL  83   0.272  12.737 -12.623
  654   1HG1  VAL  83          1HG1      VAL  83  -0.683  11.275 -14.293
  655   2HG1  VAL  83          2HG1      VAL  83  -1.969  11.718 -13.169
  656   3HG1  VAL  83          3HG1      VAL  83  -1.207  10.131 -13.057
  657   1HG2  VAL  83          1HG2      VAL  83  -1.531  12.322 -10.922
  658   2HG2  VAL  83          2HG2      VAL  83   0.096  12.298 -10.240
  659   3HG2  VAL  83          3HG2      VAL  83  -0.754  10.784 -10.545
  660    H    GLY  84           H        GLY  84   1.268  10.388  -9.804
  661   1HA   GLY  84          2HA       GLY  84   3.438  10.541  -8.510
  662   2HA   GLY  84          1HA       GLY  84   3.720  12.051  -9.376
  663    H    ILE  85           H        ILE  85   2.195  10.597  -6.657
  664    HA   ILE  85           HA       ILE  85   0.689  13.100  -6.058
  665    HB   ILE  85           HB       ILE  85   0.609  10.336  -4.808
  666   1HG1  ILE  85          2HG1      ILE  85  -0.502  10.656  -7.039
  667   2HG1  ILE  85          1HG1      ILE  85  -1.633  10.246  -5.750
  668   1HG2  ILE  85          1HG2      ILE  85  -1.444  11.427  -3.634
  669   2HG2  ILE  85          2HG2      ILE  85  -0.650  12.956  -4.012
  670   3HG2  ILE  85          3HG2      ILE  85   0.163  11.768  -2.994
  671   1HD1  ILE  85          1HD1      ILE  85  -1.204  13.127  -5.963
  672   2HD1  ILE  85          2HD1      ILE  85  -2.715  12.220  -5.941
  673   3HD1  ILE  85          3HD1      ILE  85  -1.837  12.434  -7.455
  674    H    LYS  86           H        LYS  86   1.228  14.334  -4.218
  675    HA   LYS  86           HA       LYS  86   3.543  13.357  -2.606
  676   1HB   LYS  86          2HB       LYS  86   3.772  15.321  -4.548
  677   2HB   LYS  86          1HB       LYS  86   3.564  16.250  -3.063
  678   1HG   LYS  86          2HG       LYS  86   5.400  15.027  -2.003
  679   2HG   LYS  86          1HG       LYS  86   5.581  14.016  -3.438
  680   1HD   LYS  86          2HD       LYS  86   6.992  15.548  -4.287
  681   2HD   LYS  86          1HD       LYS  86   5.655  16.697  -4.343
  682   1HE   LYS  86          2HE       LYS  86   6.127  17.387  -2.033
  683   2HE   LYS  86          1HE       LYS  86   7.442  16.215  -1.939
  684   1HZ   LYS  86          1HZ       LYS  86   8.799  17.542  -3.081
  685   2HZ   LYS  86          2HZ       LYS  86   7.692  18.785  -2.740
  686   3HZ   LYS  86          3HZ       LYS  86   7.613  17.955  -4.220
  687    H    LYS  87           H        LYS  87   0.431  14.096  -2.405
  688    HA   LYS  87           HA       LYS  87   0.663  15.852  -0.016
  689   1HB   LYS  87          2HB       LYS  87  -2.053  15.050  -0.574
  690   2HB   LYS  87          1HB       LYS  87  -1.350  16.664  -0.615
  691   1HG   LYS  87          2HG       LYS  87  -0.476  16.158  -2.916
  692   2HG   LYS  87          1HG       LYS  87  -1.363  14.634  -2.866
  693   1HD   LYS  87          2HD       LYS  87  -3.210  16.611  -2.073
  694   2HD   LYS  87          1HD       LYS  87  -2.352  17.289  -3.457
  695   1HE   LYS  87          2HE       LYS  87  -2.739  14.842  -4.439
  696   2HE   LYS  87          1HE       LYS  87  -4.094  14.867  -3.310
  697   1HZ   LYS  87          1HZ       LYS  87  -4.694  17.066  -4.308
  698   2HZ   LYS  87          2HZ       LYS  87  -4.880  15.731  -5.342
  699   3HZ   LYS  87          3HZ       LYS  87  -3.543  16.765  -5.516
  700    H    LYS  88           H        LYS  88   0.713  14.916   1.958
  701    HA   LYS  88           HA       LYS  88   0.582  12.124   2.402
  702   1HB   LYS  88          2HB       LYS  88   0.997  14.450   3.968
  703   2HB   LYS  88          1HB       LYS  88  -0.295  13.541   4.751
  704   1HG   LYS  88          2HG       LYS  88   1.181  11.477   4.508
  705   2HG   LYS  88          1HG       LYS  88   2.486  12.574   4.053
  706   1HD   LYS  88          2HD       LYS  88   2.892  12.945   6.234
  707   2HD   LYS  88          1HD       LYS  88   1.289  13.664   6.380
  708   1HE   LYS  88          2HE       LYS  88   0.464  11.853   7.454
  709   2HE   LYS  88          1HE       LYS  88   1.206  10.739   6.305
  710   1HZ   LYS  88          1HZ       LYS  88   2.120  11.560   8.887
  711   2HZ   LYS  88          2HZ       LYS  88   3.312  11.772   7.694
  712   3HZ   LYS  88          3HZ       LYS  88   2.611  10.243   7.936
  713    H    GLU  89           H        GLU  89  -1.943  14.401   1.907
  714    HA   GLU  89           HA       GLU  89  -4.047  13.134   3.366
  715   1HB   GLU  89          2HB       GLU  89  -3.895  15.442   2.005
  716   2HB   GLU  89          1HB       GLU  89  -4.669  14.453   0.766
  717   1HG   GLU  89          2HG       GLU  89  -5.697  14.480   3.601
  718   2HG   GLU  89          1HG       GLU  89  -6.207  15.700   2.435
  719    H    GLU  90           H        GLU  90  -3.418  13.013  -0.161
  720    HA   GLU  90           HA       GLU  90  -5.208  10.864  -0.676
  721   1HB   GLU  90          2HB       GLU  90  -3.407  12.448  -2.168
  722   2HB   GLU  90          1HB       GLU  90  -2.928  10.774  -2.448
  723   1HG   GLU  90          2HG       GLU  90  -4.575  11.152  -4.092
  724   2HG   GLU  90          1HG       GLU  90  -5.460  10.330  -2.805
  725    H    ARG  91           H        ARG  91  -1.672  10.812  -0.138
  726    HA   ARG  91           HA       ARG  91  -1.258   8.043  -0.383
  727   1HB   ARG  91          2HB       ARG  91   0.064  10.196   1.236
  728   2HB   ARG  91          1HB       ARG  91   0.534   8.515   1.491
  729   1HG   ARG  91          2HG       ARG  91   1.718   8.483  -0.425
  730   2HG   ARG  91          1HG       ARG  91   0.352   9.120  -1.342
  731   1HD   ARG  91          2HD       ARG  91   2.404  10.603  -1.346
  732   2HD   ARG  91          1HD       ARG  91   0.929  11.388  -0.779
  733    HE   ARG  91           HE       ARG  91   1.967  10.565   1.572
  734   1HH1  ARG  91          1HH1      ARG  91   2.927  12.645  -0.938
  735   2HH1  ARG  91          2HH1      ARG  91   4.393  13.152  -0.169
  736   1HH2  ARG  91          1HH2      ARG  91   4.085  10.928   2.476
  737   2HH2  ARG  91          2HH2      ARG  91   5.052  12.177   1.764
  738    H    ALA  92           H        ALA  92  -2.529   9.881   2.360
  739    HA   ALA  92           HA       ALA  92  -2.497   7.692   4.217
  740   1HB   ALA  92          1HB       ALA  92  -4.099   9.093   5.516
  741   2HB   ALA  92          2HB       ALA  92  -4.199  10.197   4.145
  742   3HB   ALA  92          3HB       ALA  92  -2.672   9.994   5.004
  743    H    ASP  93           H        ASP  93  -5.118   9.064   2.201
  744    HA   ASP  93           HA       ASP  93  -7.107   7.190   3.003
  745   1HB   ASP  93          2HB       ASP  93  -6.771   9.195   0.880
  746   2HB   ASP  93          1HB       ASP  93  -7.798   7.838   0.419
  747    H    LEU  94           H        LEU  94  -4.445   6.920   0.771
  748    HA   LEU  94           HA       LEU  94  -5.468   4.716  -0.775
  749   1HB   LEU  94          2HB       LEU  94  -2.658   5.681  -0.192
  750   2HB   LEU  94          1HB       LEU  94  -3.002   4.327  -1.269
  751    HG   LEU  94           HG       LEU  94  -4.272   7.050  -1.614
  752   1HD1  LEU  94          1HD1      LEU  94  -2.237   6.359  -3.568
  753   2HD1  LEU  94          2HD1      LEU  94  -1.555   6.439  -1.945
  754   3HD1  LEU  94          3HD1      LEU  94  -2.409   7.830  -2.613
  755   1HD2  LEU  94          1HD2      LEU  94  -3.850   4.749  -3.547
  756   2HD2  LEU  94          2HD2      LEU  94  -4.780   6.218  -3.844
  757   3HD2  LEU  94          3HD2      LEU  94  -5.349   5.038  -2.663
  758    H    ILE  95           H        ILE  95  -3.004   4.736   1.827
  759    HA   ILE  95           HA       ILE  95  -2.970   1.900   2.161
  760    HB   ILE  95           HB       ILE  95  -2.218   4.218   3.941
  761   1HG1  ILE  95          2HG1      ILE  95   0.014   3.569   3.432
  762   2HG1  ILE  95          1HG1      ILE  95  -0.497   1.986   2.849
  763   1HG2  ILE  95          1HG2      ILE  95  -1.212   2.524   5.485
  764   2HG2  ILE  95          2HG2      ILE  95  -2.038   1.256   4.578
  765   3HG2  ILE  95          3HG2      ILE  95  -2.974   2.464   5.459
  766   1HD1  ILE  95          1HD1      ILE  95  -1.146   4.638   1.528
  767   2HD1  ILE  95          2HD1      ILE  95  -1.644   3.049   0.946
  768   3HD1  ILE  95          3HD1      ILE  95   0.065   3.483   0.969
  769    H    ALA  96           H        ALA  96  -5.030   4.412   3.506
  770    HA   ALA  96           HA       ALA  96  -6.221   3.038   5.645
  771   1HB   ALA  96          1HB       ALA  96  -8.303   4.431   4.996
  772   2HB   ALA  96          2HB       ALA  96  -7.290   5.086   3.711
  773   3HB   ALA  96          3HB       ALA  96  -6.823   5.303   5.397
  774    H    TYR  97           H        TYR  97  -7.417   3.101   2.250
  775    HA   TYR  97           HA       TYR  97  -9.479   1.179   2.746
  776   1HB   TYR  97          2HB       TYR  97  -9.653   2.602   0.805
  777   2HB   TYR  97          1HB       TYR  97  -8.105   2.026   0.184
  778    HD1  TYR  97           HD1      TYR  97  -8.282   0.536  -1.587
  779    HD2  TYR  97           HD2      TYR  97 -11.249   0.453   1.518
  780    HE1  TYR  97           HE1      TYR  97  -9.432  -1.340  -2.733
  781    HE2  TYR  97           HE2      TYR  97 -12.400  -1.421   0.369
  782    HH   TYR  97           HH       TYR  97 -11.852  -3.203  -1.237
  783    H    LEU  98           H        LEU  98  -6.183   0.859   1.423
  784    HA   LEU  98           HA       LEU  98  -6.453  -2.017   1.111
  785   1HB   LEU  98          2HB       LEU  98  -4.349   0.016   0.678
  786   2HB   LEU  98          1HB       LEU  98  -3.753  -1.581   1.130
  787    HG   LEU  98           HG       LEU  98  -3.908  -1.530  -1.275
  788   1HD1  LEU  98          1HD1      LEU  98  -6.460  -2.933  -0.596
  789   2HD1  LEU  98          2HD1      LEU  98  -4.976  -3.476   0.187
  790   3HD1  LEU  98          3HD1      LEU  98  -5.100  -3.490  -1.571
  791   1HD2  LEU  98          1HD2      LEU  98  -5.761  -0.736  -2.484
  792   2HD2  LEU  98          2HD2      LEU  98  -5.670   0.395  -1.133
  793   3HD2  LEU  98          3HD2      LEU  98  -6.852  -0.913  -1.110
  794    H    LYS  99           H        LYS  99  -6.175  -0.101   3.812
  795    HA   LYS  99           HA       LYS  99  -4.580  -2.093   5.302
  796   1HB   LYS  99          2HB       LYS  99  -4.023   0.335   5.559
  797   2HB   LYS  99          1HB       LYS  99  -5.620   0.582   6.263
  798   1HG   LYS  99          2HG       LYS  99  -4.156  -1.655   7.472
  799   2HG   LYS  99          1HG       LYS  99  -3.344  -0.101   7.676
  800   1HD   LYS  99          2HD       LYS  99  -6.104   0.358   8.134
  801   2HD   LYS  99          1HD       LYS  99  -5.676  -1.096   9.035
  802   1HE   LYS  99          2HE       LYS  99  -3.606   0.929   9.276
  803   2HE   LYS  99          1HE       LYS  99  -5.169   1.551   9.806
  804   1HZ   LYS  99          1HZ       LYS  99  -5.313   0.042  11.481
  805   2HZ   LYS  99          2HZ       LYS  99  -3.622   0.194  11.411
  806   3HZ   LYS  99          3HZ       LYS  99  -4.391  -1.130  10.676
  807    H    LYS 100           H        LYS 100  -7.785  -1.152   4.671
  808    HA   LYS 100           HA       LYS 100  -8.763  -2.478   7.156
  809   1HB   LYS 100          2HB       LYS 100  -9.685  -0.225   6.587
  810   2HB   LYS 100          1HB       LYS 100 -10.324  -0.903   5.088
  811   1HG   LYS 100          2HG       LYS 100 -11.338  -2.708   6.771
  812   2HG   LYS 100          1HG       LYS 100 -11.204  -1.363   7.900
  813   1HD   LYS 100          2HD       LYS 100 -12.507   0.067   6.383
  814   2HD   LYS 100          1HD       LYS 100 -12.617  -1.256   5.221
  815   1HE   LYS 100          2HE       LYS 100 -14.537  -1.820   6.281
  816   2HE   LYS 100          1HE       LYS 100 -13.499  -2.426   7.572
  817   1HZ   LYS 100          1HZ       LYS 100 -13.522  -0.005   8.371
  818   2HZ   LYS 100          2HZ       LYS 100 -14.900  -0.958   8.651
  819   3HZ   LYS 100          3HZ       LYS 100 -14.888   0.169   7.380
  820    H    ALA 101           H        ALA 101  -8.741  -2.695   3.664
  821    HA   ALA 101           HA       ALA 101 -10.695  -4.816   3.499
  822   1HB   ALA 101          1HB       ALA 101 -10.594  -3.794   1.458
  823   2HB   ALA 101          2HB       ALA 101  -9.363  -5.021   1.159
  824   3HB   ALA 101          3HB       ALA 101  -8.885  -3.390   1.631
  825    H    THR 102           H        THR 102  -7.146  -4.846   2.897
  826    HA   THR 102           HA       THR 102  -7.197  -7.785   3.185
  827    HB   THR 102           HB       THR 102  -5.870  -6.479   1.401
  828    HG1  THR 102           HG1      THR 102  -4.438  -8.311   3.017
  829   1HG2  THR 102          1HG2      THR 102  -3.985  -6.173   3.753
  830   2HG2  THR 102          2HG2      THR 102  -4.881  -4.855   2.999
  831   3HG2  THR 102          3HG2      THR 102  -3.649  -5.722   2.083
  832    H    ASN 103           H        ASN 103  -5.494  -5.042   4.759
  833    HA   ASN 103           HA       ASN 103  -4.262  -6.724   6.738
  834   1HB   ASN 103          2HB       ASN 103  -3.585  -4.337   6.027
  835   2HB   ASN 103          1HB       ASN 103  -4.846  -3.794   7.131
  836   1HD2  ASN 103          1HD2      ASN 103  -2.382  -6.429   7.347
  837   2HD2  ASN 103          2HD2      ASN 103  -1.777  -5.933   8.854
  838    H    GLU 104           HN       GLU 104  -7.475  -5.923   6.322
  839    HA   GLU 104           HA       GLU 104  -8.053  -6.677   9.132
  840   1HB   GLU 104          2HB       GLU 104  -9.105  -4.193   7.758
  841   2HB   GLU 104          1HB       GLU 104  -9.827  -4.872   9.216
  842   1HG   GLU 104          2HG       GLU 104  -6.877  -4.278   9.113
  843   2HG   GLU 104          1HG       GLU 104  -8.034  -2.997   9.475
  844    HHA  HEC 105           HHA      HEC 105   4.300  -2.786  -8.789
  845    HHB  HEC 105           HHB      HEC 105   1.097   0.630  -4.554
  846    HHC  HEC 105           HHC      HEC 105  -2.064   3.484  -9.232
  847    HHD  HEC 105           HHD      HEC 105   1.140   0.073 -13.476
  848   1HMA  HEC 105          1HMA      HEC 105   3.353  -0.314  -3.616
  849   2HMA  HEC 105          2HMA      HEC 105   3.712  -2.036  -3.736
  850   3HMA  HEC 105          3HMA      HEC 105   2.044  -1.494  -3.555
  851   1HAA  HEC 105          1HAA      HEC 105   4.745  -3.018  -5.076
  852   2HAA  HEC 105          2HAA      HEC 105   5.489  -2.672  -6.624
  853   1HBA  HEC 105          1HBA      HEC 105   4.141  -4.330  -7.724
  854   2HBA  HEC 105          2HBA      HEC 105   3.143  -4.551  -6.288
  855   1HMB  HEC 105          1HMB      HEC 105  -0.154   1.911  -3.698
  856   2HMB  HEC 105          2HMB      HEC 105  -1.872   2.198  -3.966
  857   3HMB  HEC 105          3HMB      HEC 105  -0.737   3.547  -4.001
  858    HAB  HEC 105           HAB      HEC 105  -2.552   4.476  -7.495
  859   1HBB  HEC 105          1HBB      HEC 105  -2.789   5.837  -5.634
  860   2HBB  HEC 105          2HBB      HEC 105  -1.090   5.364  -5.675
  861   3HBB  HEC 105          3HBB      HEC 105  -2.194   4.591  -4.539
  862   1HMC  HEC 105          1HMC      HEC 105  -2.033   4.312 -12.634
  863   2HMC  HEC 105          2HMC      HEC 105  -3.254   3.063 -12.389
  864   3HMC  HEC 105          3HMC      HEC 105  -2.712   4.044 -11.028
  865    HAC  HEC 105           HAC      HEC 105   0.003   1.517 -14.544
  866   1HBC  HEC 105          1HBC      HEC 105  -0.737   3.923 -14.149
  867   2HBC  HEC 105          2HBC      HEC 105  -2.364   3.304 -14.430
  868   3HBC  HEC 105          3HBC      HEC 105  -1.130   3.135 -15.678
  869   1HMD  HEC 105          1HMD      HEC 105   4.182  -1.932 -14.002
  870   2HMD  HEC 105          2HMD      HEC 105   2.551  -2.589 -14.138
  871   3HMD  HEC 105          3HMD      HEC 105   2.821  -0.854 -14.316
  872   1HAD  HEC 105          1HAD      HEC 105   5.647  -2.728 -11.470
  873   2HAD  HEC 105          2HAD      HEC 105   4.640  -3.871 -10.601
  874   1HBD  HEC 105          1HBD      HEC 105   3.634  -3.867 -13.215
  875   2HBD  HEC 105          2HBD      HEC 105   4.607  -5.121 -12.458
  Start of MODEL    4
    1   1H    GLY   1          1HT       GLY   1 -10.291   6.710  10.012
    2   2H    GLY   1          2HT       GLY   1  -8.604   6.894  10.088
    3   3H    GLY   1          3HT       GLY   1  -9.305   5.360  10.291
    4   1HA   GLY   1          1HA       GLY   1  -8.812   6.881   7.849
    5   2HA   GLY   1          2HA       GLY   1  -8.699   5.143   8.134
    6    H    ASP   2           H        ASP   2 -10.427   7.314   6.432
    7    HA   ASP   2           HA       ASP   2 -13.130   6.322   6.946
    8   1HB   ASP   2          2HB       ASP   2 -12.395   8.644   5.987
    9   2HB   ASP   2          1HB       ASP   2 -12.307   7.788   4.448
   10    H    VAL   3           H        VAL   3 -13.866   4.408   6.164
   11    HA   VAL   3           HA       VAL   3 -12.322   2.974   4.118
   12    HB   VAL   3           HB       VAL   3 -13.398   1.863   6.132
   13   1HG1  VAL   3          1HG1      VAL   3 -15.580   3.278   5.584
   14   2HG1  VAL   3          2HG1      VAL   3 -15.703   1.677   6.315
   15   3HG1  VAL   3          3HG1      VAL   3 -15.960   1.876   4.582
   16   1HG2  VAL   3          1HG2      VAL   3 -13.383   1.042   3.336
   17   2HG2  VAL   3          2HG2      VAL   3 -14.648   0.216   4.245
   18   3HG2  VAL   3          3HG2      VAL   3 -12.969   0.109   4.774
   19    H    GLU   4           H        GLU   4 -15.320   4.786   4.353
   20    HA   GLU   4           HA       GLU   4 -16.358   3.906   1.781
   21   1HB   GLU   4          2HB       GLU   4 -17.753   4.873   3.664
   22   2HB   GLU   4          1HB       GLU   4 -17.050   6.446   3.284
   23   1HG   GLU   4          2HG       GLU   4 -18.296   4.821   1.087
   24   2HG   GLU   4          1HG       GLU   4 -19.331   5.740   2.178
   25    H    LYS   5           H        LYS   5 -14.662   6.820   2.944
   26    HA   LYS   5           HA       LYS   5 -14.506   7.977   0.273
   27   1HB   LYS   5          2HB       LYS   5 -14.517   9.367   2.337
   28   2HB   LYS   5          1HB       LYS   5 -12.957   8.678   2.787
   29   1HG   LYS   5          2HG       LYS   5 -12.503  10.780   1.712
   30   2HG   LYS   5          1HG       LYS   5 -12.067   9.515   0.562
   31   1HD   LYS   5          2HD       LYS   5 -13.457  10.477  -0.922
   32   2HD   LYS   5          1HD       LYS   5 -14.802  10.014   0.123
   33   1HE   LYS   5          2HE       LYS   5 -13.191  12.541   0.552
   34   2HE   LYS   5          1HE       LYS   5 -14.655  12.497  -0.432
   35   1HZ   LYS   5          1HZ       LYS   5 -14.352  12.325   2.444
   36   2HZ   LYS   5          2HZ       LYS   5 -15.478  11.245   1.772
   37   3HZ   LYS   5          3HZ       LYS   5 -15.645  12.916   1.521
   38    H    GLY   6           H        GLY   6 -12.274   6.223   2.425
   39   1HA   GLY   6          1HA       GLY   6  -9.938   6.447   0.831
   40   2HA   GLY   6          2HA       GLY   6 -10.266   5.110   1.935
   41    H    LYS   7           H        LYS   7 -12.537   4.000   0.752
   42    HA   LYS   7           HA       LYS   7 -11.413   2.392  -1.316
   43   1HB   LYS   7          2HB       LYS   7 -13.390   1.787   0.135
   44   2HB   LYS   7          1HB       LYS   7 -14.362   2.894  -0.835
   45   1HG   LYS   7          2HG       LYS   7 -14.231   1.560  -2.738
   46   2HG   LYS   7          1HG       LYS   7 -12.728   0.794  -2.221
   47   1HD   LYS   7          2HD       LYS   7 -14.234  -0.922  -1.807
   48   2HD   LYS   7          1HD       LYS   7 -14.244  -0.104  -0.244
   49   1HE   LYS   7          2HE       LYS   7 -16.136   1.306  -1.696
   50   2HE   LYS   7          1HE       LYS   7 -16.388  -0.358  -2.224
   51   1HZ   LYS   7          1HZ       LYS   7 -16.109   0.322   0.637
   52   2HZ   LYS   7          2HZ       LYS   7 -16.797  -1.066  -0.063
   53   3HZ   LYS   7          3HZ       LYS   7 -17.609   0.424  -0.149
   54    H    LYS   8           H        LYS   8 -13.282   5.375  -1.403
   55    HA   LYS   8           HA       LYS   8 -13.851   5.331  -4.225
   56   1HB   LYS   8          2HB       LYS   8 -14.849   6.839  -2.344
   57   2HB   LYS   8          1HB       LYS   8 -13.450   7.868  -2.651
   58   1HG   LYS   8          2HG       LYS   8 -14.189   7.578  -5.175
   59   2HG   LYS   8          1HG       LYS   8 -15.758   7.225  -4.450
   60   1HD   LYS   8          2HD       LYS   8 -14.275   9.606  -3.431
   61   2HD   LYS   8          1HD       LYS   8 -15.018   9.729  -5.026
   62   1HE   LYS   8          2HE       LYS   8 -17.163   9.543  -4.193
   63   2HE   LYS   8          1HE       LYS   8 -16.656   8.566  -2.816
   64   1HZ   LYS   8          1HZ       LYS   8 -16.917  11.404  -3.029
   65   2HZ   LYS   8          2HZ       LYS   8 -15.385  10.951  -2.453
   66   3HZ   LYS   8          3HZ       LYS   8 -16.787  10.433  -1.644
   67    H    ILE   9           H        ILE   9 -11.036   6.164  -2.345
   68    HA   ILE   9           HA       ILE   9  -9.730   7.684  -4.460
   69    HB   ILE   9           HB       ILE   9  -8.292   6.320  -2.192
   70   1HG1  ILE   9          2HG1      ILE   9 -10.179   7.294  -1.084
   71   2HG1  ILE   9          1HG1      ILE   9  -8.851   8.434  -0.877
   72   1HG2  ILE   9          1HG2      ILE   9  -7.414   7.942  -4.195
   73   2HG2  ILE   9          2HG2      ILE   9  -6.651   7.853  -2.608
   74   3HG2  ILE   9          3HG2      ILE   9  -7.806   9.139  -2.961
   75   1HD1  ILE   9          1HD1      ILE   9 -10.837   9.671  -1.537
   76   2HD1  ILE   9          2HD1      ILE   9 -11.079   8.611  -2.925
   77   3HD1  ILE   9          3HD1      ILE   9  -9.688   9.694  -2.873
   78    H    PHE  10           H        PHE  10  -8.697   4.600  -2.952
   79    HA   PHE  10           HA       PHE  10  -6.967   3.804  -5.023
   80   1HB   PHE  10          2HB       PHE  10  -7.227   2.701  -2.758
   81   2HB   PHE  10          1HB       PHE  10  -8.670   1.907  -3.385
   82    HD1  PHE  10           HD1      PHE  10  -5.000   2.141  -3.619
   83    HD2  PHE  10           HD2      PHE  10  -8.518   0.175  -5.106
   84    HE1  PHE  10           HE1      PHE  10  -3.582   0.403  -4.679
   85    HE2  PHE  10           HE2      PHE  10  -7.090  -1.562  -6.165
   86    HZ   PHE  10           HZ       PHE  10  -4.639  -1.449  -5.957
   87    H    ILE  11           H        ILE  11 -10.432   3.037  -4.637
   88    HA   ILE  11           HA       ILE  11 -10.718   1.400  -6.919
   89    HB   ILE  11           HB       ILE  11 -12.422   2.018  -5.054
   90   1HG1  ILE  11          2HG1      ILE  11 -13.443   1.878  -7.902
   91   2HG1  ILE  11          1HG1      ILE  11 -12.772   0.489  -7.046
   92   1HG2  ILE  11          1HG2      ILE  11 -13.051   4.141  -7.125
   93   2HG2  ILE  11          2HG2      ILE  11 -12.440   4.443  -5.498
   94   3HG2  ILE  11          3HG2      ILE  11 -14.046   3.751  -5.722
   95   1HD1  ILE  11          1HD1      ILE  11 -15.284   0.660  -6.911
   96   2HD1  ILE  11          2HD1      ILE  11 -15.075   2.153  -5.995
   97   3HD1  ILE  11          3HD1      ILE  11 -14.479   0.625  -5.343
   98    H    MET  12           H        MET  12 -10.937   4.948  -6.657
   99    HA   MET  12           HA       MET  12 -11.088   5.082  -9.632
  100   1HB   MET  12          2HB       MET  12 -12.777   6.340  -8.248
  101   2HB   MET  12          1HB       MET  12 -11.452   7.329  -7.633
  102   1HG   MET  12          2HG       MET  12 -11.115   7.305 -10.423
  103   2HG   MET  12          1HG       MET  12 -12.846   7.523 -10.167
  104   1HE   MET  12          1HE       MET  12 -13.318   9.595 -10.893
  105   2HE   MET  12          2HE       MET  12 -11.737   9.996 -11.558
  106   3HE   MET  12          3HE       MET  12 -12.559  11.145 -10.505
  107    H    LYS  13           H        LYS  13  -8.655   4.733  -7.654
  108    HA   LYS  13           HA       LYS  13  -7.017   6.874  -8.950
  109   1HB   LYS  13          2HB       LYS  13  -7.236   7.223  -6.505
  110   2HB   LYS  13          1HB       LYS  13  -6.582   5.608  -6.228
  111   1HG   LYS  13          2HG       LYS  13  -4.602   6.752  -6.098
  112   2HG   LYS  13          1HG       LYS  13  -4.661   6.595  -7.854
  113   1HD   LYS  13          2HD       LYS  13  -6.054   8.920  -6.578
  114   2HD   LYS  13          1HD       LYS  13  -4.298   8.967  -6.728
  115   1HE   LYS  13          2HE       LYS  13  -4.992   8.097  -9.216
  116   2HE   LYS  13          1HE       LYS  13  -6.373   9.122  -8.830
  117   1HZ   LYS  13          1HZ       LYS  13  -4.813  10.900  -8.254
  118   2HZ   LYS  13          2HZ       LYS  13  -4.649  10.413  -9.874
  119   3HZ   LYS  13          3HZ       LYS  13  -3.513   9.913  -8.714
  120    H    CYS  14           H        CYS  14  -6.352   3.837  -7.163
  121    HA   CYS  14           HA       CYS  14  -4.595   3.058  -9.455
  122   1HB   CYS  14          2HB       CYS  14  -4.172   1.562  -6.971
  123   2HB   CYS  14          1HB       CYS  14  -2.996   2.375  -7.992
  124    H    SER  15           H        SER  15  -7.439   2.535  -9.405
  125    HA   SER  15           HA       SER  15  -7.629  -0.337  -8.694
  126   1HB   SER  15          2HB       SER  15  -9.460   1.499  -8.309
  127   2HB   SER  15          1HB       SER  15  -9.829   1.234 -10.010
  128    HG   SER  15           HG       SER  15  -9.725  -0.736  -7.963
  129    H    GLN  16           H        GLN  16  -8.059   1.738 -11.565
  130    HA   GLN  16           HA       GLN  16  -8.601  -0.256 -13.462
  131   1HB   GLN  16          2HB       GLN  16  -6.825   2.155 -13.938
  132   2HB   GLN  16          1HB       GLN  16  -7.793   1.292 -15.134
  133   1HG   GLN  16          2HG       GLN  16  -9.496   2.065 -12.957
  134   2HG   GLN  16          1HG       GLN  16  -8.594   3.479 -13.502
  135   1HE2  GLN  16          1HE2      GLN  16 -11.300   3.539 -14.032
  136   2HE2  GLN  16          2HE2      GLN  16 -11.600   3.247 -15.677
  137    H    CYS  17           H        CYS  17  -5.510   0.675 -12.014
  138    HA   CYS  17           HA       CYS  17  -4.144  -1.327 -13.727
  139   1HB   CYS  17          2HB       CYS  17  -3.160   0.911 -11.955
  140   2HB   CYS  17          1HB       CYS  17  -2.069  -0.356 -12.519
  141    H    HIS  18           H        HIS  18  -4.898  -0.636 -10.314
  142    HA   HIS  18           HA       HIS  18  -3.954  -3.415  -9.690
  143   1HB   HIS  18          2HB       HIS  18  -4.267  -1.087  -7.771
  144   2HB   HIS  18          1HB       HIS  18  -3.759  -2.709  -7.343
  145    HD1  HIS  18           HD1      HIS  18  -1.344  -3.315  -7.700
  146    HD2  HIS  18           HD2      HIS  18  -2.332   0.360  -9.366
  147    HE1  HIS  18           HE1      HIS  18   0.846  -2.194  -8.289
  148    H    THR  19           H        THR  19  -6.217  -3.958 -10.558
  149    HA   THR  19           HA       THR  19  -8.463  -3.086  -8.912
  150    HB   THR  19           HB       THR  19  -9.003  -5.494 -10.434
  151    HG1  THR  19           HG1      THR  19  -7.885  -5.119 -12.148
  152   1HG2  THR  19          1HG2      THR  19 -10.897  -4.325 -10.719
  153   2HG2  THR  19          2HG2      THR  19 -10.025  -3.062 -11.589
  154   3HG2  THR  19          3HG2      THR  19 -10.162  -2.990  -9.832
  155    H    VAL  20           H        VAL  20  -8.120  -3.746  -6.797
  156    HA   VAL  20           HA       VAL  20  -7.369  -6.531  -6.225
  157    HB   VAL  20           HB       VAL  20  -7.148  -5.818  -3.965
  158   1HG1  VAL  20          1HG1      VAL  20  -5.590  -4.081  -4.163
  159   2HG1  VAL  20          2HG1      VAL  20  -6.530  -3.249  -5.401
  160   3HG1  VAL  20          3HG1      VAL  20  -5.645  -4.721  -5.805
  161   1HG2  VAL  20          1HG2      VAL  20  -8.042  -3.209  -3.748
  162   2HG2  VAL  20          2HG2      VAL  20  -8.912  -4.628  -3.164
  163   3HG2  VAL  20          3HG2      VAL  20  -9.283  -3.958  -4.753
  164    H    GLU  21           H        GLU  21 -10.026  -5.803  -7.502
  165    HA   GLU  21           HA       GLU  21 -11.698  -7.323  -5.569
  166   1HB   GLU  21          2HB       GLU  21 -12.388  -4.679  -6.862
  167   2HB   GLU  21          1HB       GLU  21 -13.631  -5.777  -6.265
  168   1HG   GLU  21          2HG       GLU  21 -11.381  -5.208  -4.409
  169   2HG   GLU  21          1HG       GLU  21 -12.499  -3.879  -4.714
  170    H    LYS  22           H        LYS  22 -10.345  -7.377  -8.478
  171    HA   LYS  22           HA       LYS  22 -12.696  -8.100 -10.090
  172   1HB   LYS  22          2HB       LYS  22 -10.800  -6.959 -11.166
  173   2HB   LYS  22          1HB       LYS  22  -9.730  -8.283 -10.712
  174   1HG   LYS  22          2HG       LYS  22 -10.266  -9.101 -12.772
  175   2HG   LYS  22          1HG       LYS  22 -11.734  -9.651 -11.962
  176   1HD   LYS  22          2HD       LYS  22 -12.748  -7.383 -12.540
  177   2HD   LYS  22          1HD       LYS  22 -11.356  -7.131 -13.592
  178   1HE   LYS  22          2HE       LYS  22 -11.917  -9.285 -14.751
  179   2HE   LYS  22          1HE       LYS  22 -13.386  -9.374 -13.779
  180   1HZ   LYS  22          1HZ       LYS  22 -12.722  -7.014 -15.438
  181   2HZ   LYS  22          2HZ       LYS  22 -14.220  -7.426 -14.749
  182   3HZ   LYS  22          3HZ       LYS  22 -13.602  -8.330 -16.049
  183    H    GLY  23           H        GLY  23  -9.715 -10.003 -10.061
  184   1HA   GLY  23          2HA       GLY  23 -11.027 -12.250  -8.696
  185   2HA   GLY  23          1HA       GLY  23 -10.727 -12.503 -10.416
  186    H    GLY  24           H        GLY  24  -8.655 -10.700  -8.160
  187   1HA   GLY  24          1HA       GLY  24  -6.457 -11.126  -7.449
  188   2HA   GLY  24          2HA       GLY  24  -6.775 -12.838  -7.735
  189    H    LYS  25           H        LYS  25  -7.421 -10.866 -10.444
  190    HA   LYS  25           HA       LYS  25  -4.953 -11.886 -11.753
  191   1HB   LYS  25          2HB       LYS  25  -7.307 -12.234 -12.732
  192   2HB   LYS  25          1HB       LYS  25  -7.275 -10.512 -13.113
  193   1HG   LYS  25          2HG       LYS  25  -5.573 -10.747 -14.678
  194   2HG   LYS  25          1HG       LYS  25  -4.938 -12.206 -13.918
  195   1HD   LYS  25          2HD       LYS  25  -6.103 -12.665 -16.086
  196   2HD   LYS  25          1HD       LYS  25  -6.834 -13.507 -14.719
  197   1HE   LYS  25          2HE       LYS  25  -8.583 -12.488 -16.102
  198   2HE   LYS  25          1HE       LYS  25  -8.520 -11.692 -14.530
  199   1HZ   LYS  25          1HZ       LYS  25  -8.334 -10.479 -16.978
  200   2HZ   LYS  25          2HZ       LYS  25  -6.738 -10.485 -16.396
  201   3HZ   LYS  25          3HZ       LYS  25  -7.979  -9.775 -15.476
  202    H    HIS  26           H        HIS  26  -3.987 -10.290 -13.417
  203    HA   HIS  26           HA       HIS  26  -4.238  -7.466 -12.542
  204   1HB   HIS  26          2HB       HIS  26  -1.529  -7.654 -12.852
  205   2HB   HIS  26          1HB       HIS  26  -2.346  -7.721 -11.294
  206    HD1  HIS  26           HD1      HIS  26  -2.184 -10.444 -13.950
  207    HD2  HIS  26           HD2      HIS  26  -0.932  -9.767 -10.028
  208    HE1  HIS  26           HE1      HIS  26  -1.209 -12.630 -13.120
  209    H    LYS  27           H        LYS  27  -4.594  -6.348 -14.391
  210    HA   LYS  27           HA       LYS  27  -3.625  -7.427 -16.948
  211   1HB   LYS  27          2HB       LYS  27  -5.991  -6.410 -16.491
  212   2HB   LYS  27          1HB       LYS  27  -5.168  -4.860 -16.662
  213   1HG   LYS  27          2HG       LYS  27  -4.387  -6.703 -18.770
  214   2HG   LYS  27          1HG       LYS  27  -6.134  -6.462 -18.743
  215   1HD   LYS  27          2HD       LYS  27  -5.889  -4.075 -18.920
  216   2HD   LYS  27          1HD       LYS  27  -4.147  -4.178 -18.664
  217   1HE   LYS  27          2HE       LYS  27  -4.192  -5.720 -20.781
  218   2HE   LYS  27          1HE       LYS  27  -5.746  -4.946 -21.091
  219   1HZ   LYS  27          1HZ       LYS  27  -3.464  -3.929 -21.921
  220   2HZ   LYS  27          2HZ       LYS  27  -3.517  -3.207 -20.384
  221   3HZ   LYS  27          3HZ       LYS  27  -4.784  -2.956 -21.488
  222    H    THR  28           H        THR  28  -3.771  -4.062 -15.758
  223    HA   THR  28           HA       THR  28  -1.134  -3.568 -17.023
  224    HB   THR  28           HB       THR  28  -3.209  -1.728 -15.794
  225    HG1  THR  28           HG1      THR  28  -3.789  -1.440 -17.792
  226   1HG2  THR  28          1HG2      THR  28  -0.483  -1.110 -16.958
  227   2HG2  THR  28          2HG2      THR  28  -1.032  -0.790 -15.314
  228   3HG2  THR  28          3HG2      THR  28  -1.726   0.105 -16.665
  229    H    GLY  29           H        GLY  29  -2.712  -2.776 -13.914
  230   1HA   GLY  29          2HA       GLY  29  -0.058  -2.706 -12.612
  231   2HA   GLY  29          1HA       GLY  29  -1.577  -2.193 -11.883
  232    HA   PRO  30           HA       PRO  30  -0.391  -6.756 -10.956
  233   1HB   PRO  30          2HB       PRO  30   0.844  -6.372  -8.518
  234   2HB   PRO  30          1HB       PRO  30   1.704  -6.516 -10.062
  235   1HG   PRO  30          2HG       PRO  30   1.069  -4.037  -8.488
  236   2HG   PRO  30          1HG       PRO  30   2.501  -4.411  -9.466
  237   1HD   PRO  30          2HD       PRO  30   0.457  -2.787 -10.366
  238   2HD   PRO  30          1HD       PRO  30   1.502  -3.739 -11.437
  239    H    ASN  31           H        ASN  31  -1.704  -7.975  -9.567
  240    HA   ASN  31           HA       ASN  31  -4.055  -6.717  -8.540
  241   1HB   ASN  31          2HB       ASN  31  -4.076  -9.040  -9.274
  242   2HB   ASN  31          1HB       ASN  31  -2.914  -9.476  -8.019
  243   1HD2  ASN  31          1HD2      ASN  31  -6.078  -7.709  -8.174
  244   2HD2  ASN  31          2HD2      ASN  31  -6.725  -8.470  -6.800
  245    H    LEU  32           H        LEU  32  -3.702  -5.218  -6.927
  246    HA   LEU  32           HA       LEU  32  -1.932  -5.780  -4.678
  247   1HB   LEU  32          2HB       LEU  32  -3.469  -3.488  -5.696
  248   2HB   LEU  32          1HB       LEU  32  -3.414  -3.585  -3.941
  249    HG   LEU  32           HG       LEU  32  -1.111  -3.288  -3.857
  250   1HD1  LEU  32          1HD1      LEU  32  -1.181  -4.757  -6.432
  251   2HD1  LEU  32          2HD1      LEU  32  -0.042  -4.887  -5.092
  252   3HD1  LEU  32          3HD1      LEU  32   0.118  -3.576  -6.261
  253   1HD2  LEU  32          1HD2      LEU  32  -2.391  -1.798  -6.076
  254   2HD2  LEU  32          2HD2      LEU  32  -0.628  -1.758  -6.050
  255   3HD2  LEU  32          3HD2      LEU  32  -1.543  -1.191  -4.653
  256    H    HIS  33           H        HIS  33  -4.083  -7.708  -4.935
  257    HA   HIS  33           HA       HIS  33  -5.997  -6.974  -2.804
  258   1HB   HIS  33          2HB       HIS  33  -6.603  -8.285  -4.944
  259   2HB   HIS  33          1HB       HIS  33  -5.802  -9.657  -4.176
  260    HD1  HIS  33           HD1      HIS  33  -7.855 -11.045  -3.597
  261    HD2  HIS  33           HD2      HIS  33  -8.117  -7.129  -2.193
  262    HE1  HIS  33           HE1      HIS  33  -9.883 -10.961  -2.083
  263    H    GLY  34           H        GLY  34  -3.217  -7.188  -2.097
  264   1HA   GLY  34          2HA       GLY  34  -3.228  -8.484   0.330
  265   2HA   GLY  34          1HA       GLY  34  -2.783  -9.765  -0.800
  266    H    LEU  35           H        LEU  35  -1.927  -6.340  -1.097
  267    HA   LEU  35           HA       LEU  35   0.866  -7.043  -1.451
  268   1HB   LEU  35          2HB       LEU  35  -0.284  -5.182  -2.694
  269   2HB   LEU  35          1HB       LEU  35  -0.349  -4.286  -1.176
  270    HG   LEU  35           HG       LEU  35   2.264  -4.953  -1.174
  271   1HD1  LEU  35          1HD1      LEU  35   1.302  -5.414  -3.893
  272   2HD1  LEU  35          2HD1      LEU  35   2.857  -5.828  -3.171
  273   3HD1  LEU  35          3HD1      LEU  35   2.596  -4.219  -3.839
  274   1HD2  LEU  35          1HD2      LEU  35   1.009  -2.665  -1.141
  275   2HD2  LEU  35          2HD2      LEU  35   1.359  -2.631  -2.869
  276   3HD2  LEU  35          3HD2      LEU  35   2.680  -2.697  -1.703
  277    H    PHE  36           H        PHE  36  -1.151  -5.949   1.161
  278    HA   PHE  36           HA       PHE  36   1.002  -4.915   2.812
  279   1HB   PHE  36          2HB       PHE  36  -1.839  -5.767   3.419
  280   2HB   PHE  36          1HB       PHE  36  -0.747  -5.126   4.647
  281    HD1  PHE  36           HD1      PHE  36  -2.037  -4.327   1.213
  282    HD2  PHE  36           HD2      PHE  36  -0.644  -2.818   4.985
  283    HE1  PHE  36           HE1      PHE  36  -2.556  -2.018   0.481
  284    HE2  PHE  36           HE2      PHE  36  -1.165  -0.507   4.251
  285    HZ   PHE  36           HZ       PHE  36  -2.122  -0.107   1.999
  286    H    GLY  37           H        GLY  37   2.421  -6.096   4.001
  287   1HA   GLY  37          2HA       GLY  37   3.264  -7.891   5.282
  288   2HA   GLY  37          1HA       GLY  37   1.671  -8.647   5.197
  289    H    ARG  38           H        ARG  38   2.891  -7.681   2.157
  290    HA   ARG  38           HA       ARG  38   4.013 -10.400   1.655
  291   1HB   ARG  38          2HB       ARG  38   1.699 -10.421   0.849
  292   2HB   ARG  38          1HB       ARG  38   1.989  -8.945  -0.076
  293   1HG   ARG  38          2HG       ARG  38   3.831 -10.197  -1.292
  294   2HG   ARG  38          1HG       ARG  38   3.243 -11.666  -0.511
  295   1HD   ARG  38          2HD       ARG  38   1.348 -11.750  -1.788
  296   2HD   ARG  38          1HD       ARG  38   1.185  -9.994  -1.843
  297    HE   ARG  38           HE       ARG  38   2.661 -11.645  -3.757
  298   1HH1  ARG  38          1HH1      ARG  38   2.882  -8.663  -2.097
  299   2HH1  ARG  38          2HH1      ARG  38   3.269  -7.738  -3.509
  300   1HH2  ARG  38          1HH2      ARG  38   2.877 -10.406  -5.690
  301   2HH2  ARG  38          2HH2      ARG  38   3.267  -8.725  -5.542
  302    H    LYS  39           H        LYS  39   5.866 -10.352   0.432
  303    HA   LYS  39           HA       LYS  39   7.046  -7.776  -0.205
  304   1HB   LYS  39          2HB       LYS  39   7.867 -10.623  -0.318
  305   2HB   LYS  39          1HB       LYS  39   8.655  -9.556  -1.481
  306   1HG   LYS  39          2HG       LYS  39   8.761  -8.029   0.784
  307   2HG   LYS  39          1HG       LYS  39   8.913  -9.651   1.461
  308   1HD   LYS  39          2HD       LYS  39  10.545  -9.540  -0.875
  309   2HD   LYS  39          1HD       LYS  39  10.902  -8.110   0.095
  310   1HE   LYS  39          2HE       LYS  39  11.275  -9.519   2.071
  311   2HE   LYS  39          1HE       LYS  39  10.869 -10.958   1.138
  312   1HZ   LYS  39          1HZ       LYS  39  13.336 -10.213   1.434
  313   2HZ   LYS  39          2HZ       LYS  39  12.972  -9.177   0.138
  314   3HZ   LYS  39          3HZ       LYS  39  12.803 -10.859  -0.041
  315    H    THR  40           H        THR  40   8.181  -7.814  -2.590
  316    HA   THR  40           HA       THR  40   5.871  -7.814  -4.445
  317    HB   THR  40           HB       THR  40   6.943  -6.154  -5.578
  318    HG1  THR  40           HG1      THR  40   8.545  -7.056  -6.599
  319   1HG2  THR  40          1HG2      THR  40   7.384  -5.863  -2.951
  320   2HG2  THR  40          2HG2      THR  40   7.998  -4.710  -4.135
  321   3HG2  THR  40          3HG2      THR  40   9.060  -5.961  -3.490
  322    H    GLY  41           H        GLY  41   6.847  -8.343  -6.869
  323   1HA   GLY  41          2HA       GLY  41   7.445 -10.095  -8.303
  324   2HA   GLY  41          1HA       GLY  41   8.718 -10.458  -7.138
  325    H    GLN  42           H        GLN  42   5.405 -11.179  -8.080
  326    HA   GLN  42           HA       GLN  42   5.630 -13.760  -6.650
  327   1HB   GLN  42          2HB       GLN  42   4.259 -11.665  -5.461
  328   2HB   GLN  42          1HB       GLN  42   2.981 -12.564  -6.280
  329   1HG   GLN  42          2HG       GLN  42   3.305 -13.460  -4.023
  330   2HG   GLN  42          1HG       GLN  42   3.808 -14.656  -5.219
  331   1HE2  GLN  42          1HE2      GLN  42   5.579 -11.747  -4.052
  332   2HE2  GLN  42          2HE2      GLN  42   6.925 -12.611  -3.483
  333    H    ALA  43           H        ALA  43   3.619 -11.678  -8.741
  334    HA   ALA  43           HA       ALA  43   2.162 -13.918  -9.864
  335   1HB   ALA  43          1HB       ALA  43   2.531 -11.092 -10.900
  336   2HB   ALA  43          2HB       ALA  43   1.211 -11.650  -9.873
  337   3HB   ALA  43          3HB       ALA  43   1.362 -12.255 -11.523
  338    HA   PRO  44           HA       PRO  44   5.334 -15.152 -12.696
  339   1HB   PRO  44          2HB       PRO  44   3.791 -16.911 -14.141
  340   2HB   PRO  44          1HB       PRO  44   4.459 -17.277 -12.541
  341   1HG   PRO  44          2HG       PRO  44   1.651 -16.605 -13.294
  342   2HG   PRO  44          1HG       PRO  44   2.248 -17.566 -11.931
  343   1HD   PRO  44          2HD       PRO  44   1.358 -14.886 -11.796
  344   2HD   PRO  44          1HD       PRO  44   2.277 -15.742 -10.539
  345    H    GLY  45           H        GLY  45   2.376 -15.389 -14.652
  346   1HA   GLY  45          2HA       GLY  45   3.328 -14.405 -17.039
  347   2HA   GLY  45          1HA       GLY  45   1.671 -14.101 -16.511
  348    H    TYR  46           H        TYR  46   2.589 -12.547 -14.159
  349    HA   TYR  46           HA       TYR  46   2.852  -9.956 -15.500
  350   1HB   TYR  46          2HB       TYR  46   1.553 -10.560 -13.292
  351   2HB   TYR  46          1HB       TYR  46   3.132 -10.364 -12.534
  352    HD1  TYR  46           HD1      TYR  46   0.292  -8.672 -12.727
  353    HD2  TYR  46           HD2      TYR  46   4.339  -8.137 -14.035
  354    HE1  TYR  46           HE1      TYR  46  -0.039  -6.218 -12.746
  355    HE2  TYR  46           HE2      TYR  46   4.014  -5.688 -14.055
  356    HH   TYR  46           HH       TYR  46   2.244  -4.070 -14.175
  357    H    SER  47           H        SER  47   4.799  -9.011 -15.939
  358    HA   SER  47           HA       SER  47   7.254 -10.217 -14.831
  359   1HB   SER  47          2HB       SER  47   6.570  -8.711 -17.188
  360   2HB   SER  47          1HB       SER  47   7.838  -7.854 -16.314
  361    HG   SER  47           HG       SER  47   8.927  -9.310 -17.501
  362    H    TYR  48           H        TYR  48   5.987  -9.314 -12.716
  363    HA   TYR  48           HA       TYR  48   5.803  -6.758 -11.820
  364   1HB   TYR  48          2HB       TYR  48   6.874  -9.239 -10.530
  365   2HB   TYR  48          1HB       TYR  48   7.048  -7.716  -9.663
  366    HD1  TYR  48           HD1      TYR  48   4.291  -8.948 -11.899
  367    HD2  TYR  48           HD2      TYR  48   5.456  -7.725  -7.961
  368    HE1  TYR  48           HE1      TYR  48   1.929  -9.113 -11.139
  369    HE2  TYR  48           HE2      TYR  48   3.107  -7.890  -7.203
  370    HH   TYR  48           HH       TYR  48   0.720  -9.466  -8.969
  371    H    THR  49           H        THR  49   7.298  -5.249 -10.750
  372    HA   THR  49           HA       THR  49   9.649  -4.722 -12.270
  373    HB   THR  49           HB       THR  49   9.747  -3.661  -9.545
  374    HG1  THR  49           HG1      THR  49   7.657  -3.512  -9.379
  375   1HG2  THR  49          1HG2      THR  49  10.966  -2.637 -11.361
  376   2HG2  THR  49          2HG2      THR  49   9.698  -1.518 -10.862
  377   3HG2  THR  49          3HG2      THR  49   9.496  -2.485 -12.323
  378    H    ALA  50           H        ALA  50  10.901  -6.680 -12.268
  379    HA   ALA  50           HA       ALA  50  11.740  -8.204 -10.095
  380   1HB   ALA  50          1HB       ALA  50  13.554  -8.908 -11.418
  381   2HB   ALA  50          2HB       ALA  50  13.739  -7.322 -12.167
  382   3HB   ALA  50          3HB       ALA  50  12.389  -8.360 -12.622
  383    H    ALA  51           H        ALA  51  12.849  -5.018 -11.117
  384    HA   ALA  51           HA       ALA  51  15.119  -4.660  -9.530
  385   1HB   ALA  51          1HB       ALA  51  14.864  -2.648 -10.525
  386   2HB   ALA  51          2HB       ALA  51  13.693  -2.258  -9.266
  387   3HB   ALA  51          3HB       ALA  51  13.145  -2.939 -10.797
  388    H    ASN  52           H        ASN  52  11.795  -3.738  -8.524
  389    HA   ASN  52           HA       ASN  52  12.397  -3.269  -5.809
  390   1HB   ASN  52          2HB       ASN  52  10.123  -3.139  -7.325
  391   2HB   ASN  52          1HB       ASN  52   9.783  -4.550  -6.325
  392   1HD2  ASN  52          1HD2      ASN  52  11.592  -3.366  -4.138
  393   2HD2  ASN  52          2HD2      ASN  52  10.629  -2.180  -3.403
  394    H    LYS  53           H        LYS  53  11.177  -6.262  -7.333
  395    HA   LYS  53           HA       LYS  53  10.947  -7.976  -5.203
  396   1HB   LYS  53          2HB       LYS  53  10.685  -8.645  -7.587
  397   2HB   LYS  53          1HB       LYS  53  12.441  -8.638  -7.759
  398   1HG   LYS  53          2HG       LYS  53  12.682 -10.412  -6.144
  399   2HG   LYS  53          1HG       LYS  53  10.973 -10.321  -5.713
  400   1HD   LYS  53          2HD       LYS  53  11.032 -12.145  -7.189
  401   2HD   LYS  53          1HD       LYS  53  10.555 -10.812  -8.241
  402   1HE   LYS  53          2HE       LYS  53  13.476 -11.208  -7.924
  403   2HE   LYS  53          1HE       LYS  53  12.623 -12.482  -8.795
  404   1HZ   LYS  53          1HZ       LYS  53  13.214  -9.804  -9.609
  405   2HZ   LYS  53          2HZ       LYS  53  11.566 -10.180  -9.790
  406   3HZ   LYS  53          3HZ       LYS  53  12.747 -11.141 -10.545
  407    H    ASN  54           H        ASN  54  13.918  -6.626  -6.470
  408    HA   ASN  54           HA       ASN  54  15.540  -8.274  -4.660
  409   1HB   ASN  54          2HB       ASN  54  16.209  -6.256  -6.803
  410   2HB   ASN  54          1HB       ASN  54  17.439  -6.897  -5.714
  411   1HD2  ASN  54          1HD2      ASN  54  17.759  -7.483  -8.404
  412   2HD2  ASN  54          2HD2      ASN  54  17.386  -9.113  -8.702
  413    H    LYS  55           H        LYS  55  14.587  -4.867  -5.103
  414    HA   LYS  55           HA       LYS  55  16.210  -3.769  -3.059
  415   1HB   LYS  55          2HB       LYS  55  14.612  -2.583  -4.740
  416   2HB   LYS  55          1HB       LYS  55  13.372  -2.862  -3.518
  417   1HG   LYS  55          2HG       LYS  55  14.298  -0.682  -3.087
  418   2HG   LYS  55          1HG       LYS  55  14.922  -1.761  -1.838
  419   1HD   LYS  55          2HD       LYS  55  16.875  -0.692  -2.519
  420   2HD   LYS  55          1HD       LYS  55  16.892  -2.118  -3.555
  421   1HE   LYS  55          2HE       LYS  55  15.308  -0.127  -4.844
  422   2HE   LYS  55          1HE       LYS  55  16.821   0.628  -4.341
  423   1HZ   LYS  55          1HZ       LYS  55  16.536  -0.821  -6.568
  424   2HZ   LYS  55          2HZ       LYS  55  17.088  -2.013  -5.490
  425   3HZ   LYS  55          3HZ       LYS  55  18.011  -0.612  -5.756
  426    H    GLY  56           H        GLY  56  16.298  -5.195  -1.287
  427   1HA   GLY  56          1HA       GLY  56  14.385  -6.639   0.016
  428   2HA   GLY  56          2HA       GLY  56  15.616  -5.752   0.913
  429    H    ILE  57           H        ILE  57  12.292  -5.725  -0.183
  430    HA   ILE  57           HA       ILE  57  11.734  -3.633   1.850
  431    HB   ILE  57           HB       ILE  57  12.009  -2.642  -0.528
  432   1HG1  ILE  57          2HG1      ILE  57  10.857  -1.575   1.477
  433   2HG1  ILE  57          1HG1      ILE  57  10.306  -1.012  -0.101
  434   1HG2  ILE  57          1HG2      ILE  57   9.387  -4.134  -0.802
  435   2HG2  ILE  57          2HG2      ILE  57  10.806  -4.247  -1.842
  436   3HG2  ILE  57          3HG2      ILE  57   9.833  -2.777  -1.833
  437   1HD1  ILE  57          1HD1      ILE  57   8.786  -2.308   1.985
  438   2HD1  ILE  57          2HD1      ILE  57   8.713  -3.264   0.507
  439   3HD1  ILE  57          3HD1      ILE  57   8.212  -1.576   0.488
  440    H    ILE  58           H        ILE  58   9.678  -3.794   2.756
  441    HA   ILE  58           HA       ILE  58   8.034  -6.120   1.842
  442    HB   ILE  58           HB       ILE  58   8.894  -6.705   3.991
  443   1HG1  ILE  58          2HG1      ILE  58   6.923  -6.853   5.333
  444   2HG1  ILE  58          1HG1      ILE  58   6.259  -5.370   4.649
  445   1HG2  ILE  58          1HG2      ILE  58   9.822  -4.981   5.127
  446   2HG2  ILE  58          2HG2      ILE  58   8.212  -4.737   5.803
  447   3HG2  ILE  58          3HG2      ILE  58   8.730  -3.803   4.398
  448   1HD1  ILE  58          1HD1      ILE  58   5.388  -7.696   3.787
  449   2HD1  ILE  58          2HD1      ILE  58   6.875  -7.684   2.838
  450   3HD1  ILE  58          3HD1      ILE  58   5.687  -6.396   2.633
  451    H    TRP  59           H        TRP  59   6.515  -5.020   0.617
  452    HA   TRP  59           HA       TRP  59   5.560  -2.488   0.745
  453   1HB   TRP  59          2HB       TRP  59   3.965  -5.013   0.305
  454   2HB   TRP  59          1HB       TRP  59   3.303  -3.400   0.039
  455    HD1  TRP  59           HD1      TRP  59   4.391  -5.904  -2.056
  456    HE1  TRP  59           HE1      TRP  59   5.733  -5.087  -4.099
  457    HE3  TRP  59           HE3      TRP  59   5.649  -1.195  -0.479
  458    HZ2  TRP  59           HZ2      TRP  59   7.155  -2.756  -4.949
  459    HZ3  TRP  59           HZ3      TRP  59   6.993   0.290  -1.928
  460    HH2  TRP  59           HH2      TRP  59   7.746  -0.482  -4.161
  461    H    GLY  60           H        GLY  60   5.489  -1.529   2.735
  462   1HA   GLY  60          1HA       GLY  60   3.334  -2.496   4.574
  463   2HA   GLY  60          2HA       GLY  60   4.839  -1.798   5.171
  464    H    GLU  61           H        GLU  61   3.284  -0.257   6.247
  465    HA   GLU  61           HA       GLU  61   1.717   1.580   4.683
  466   1HB   GLU  61          2HB       GLU  61   2.298   1.131   7.459
  467   2HB   GLU  61          1HB       GLU  61   2.527   2.844   7.099
  468   1HG   GLU  61          2HG       GLU  61   0.105   1.507   5.971
  469   2HG   GLU  61          1HG       GLU  61   0.117   1.853   7.702
  470    H    ASP  62           H        ASP  62   4.414   2.667   6.730
  471    HA   ASP  62           HA       ASP  62   5.010   4.909   5.096
  472   1HB   ASP  62          2HB       ASP  62   7.236   4.879   6.343
  473   2HB   ASP  62          1HB       ASP  62   5.794   4.927   7.358
  474    H    THR  63           H        THR  63   6.042   1.573   4.886
  475    HA   THR  63           HA       THR  63   8.354   1.923   3.267
  476    HB   THR  63           HB       THR  63   7.160  -0.430   2.361
  477    HG1  THR  63           HG1      THR  63   6.632  -1.185   4.663
  478   1HG2  THR  63          1HG2      THR  63   8.901  -0.005   4.805
  479   2HG2  THR  63          2HG2      THR  63   9.487  -0.108   3.144
  480   3HG2  THR  63          3HG2      THR  63   8.734  -1.510   3.903
  481    H    LEU  64           H        LEU  64   4.912   1.669   2.430
  482    HA   LEU  64           HA       LEU  64   5.414   1.835  -0.435
  483   1HB   LEU  64          2HB       LEU  64   3.189   1.302   1.264
  484   2HB   LEU  64          1HB       LEU  64   2.759   2.681   0.252
  485    HG   LEU  64           HG       LEU  64   3.939   0.103  -0.815
  486   1HD1  LEU  64          1HD1      LEU  64   1.244   0.546  -1.647
  487   2HD1  LEU  64          2HD1      LEU  64   1.291   0.668   0.111
  488   3HD1  LEU  64          3HD1      LEU  64   1.879  -0.790  -0.687
  489   1HD2  LEU  64          1HD2      LEU  64   4.359   1.619  -2.495
  490   2HD2  LEU  64          2HD2      LEU  64   3.087   2.718  -1.963
  491   3HD2  LEU  64          3HD2      LEU  64   2.675   1.274  -2.887
  492    H    MET  65           H        MET  65   4.711   4.090   2.171
  493    HA   MET  65           HA       MET  65   3.984   6.372   0.678
  494   1HB   MET  65          2HB       MET  65   4.000   6.173   3.195
  495   2HB   MET  65          1HB       MET  65   5.752   6.370   3.141
  496   1HG   MET  65          2HG       MET  65   4.773   8.448   1.546
  497   2HG   MET  65          1HG       MET  65   3.667   8.390   2.920
  498   1HE   MET  65          1HE       MET  65   3.764   9.311   4.623
  499   2HE   MET  65          2HE       MET  65   4.959  10.490   5.156
  500   3HE   MET  65          3HE       MET  65   4.983   8.858   5.821
  501    H    GLU  66           H        GLU  66   7.181   5.012   1.358
  502    HA   GLU  66           HA       GLU  66   8.601   7.222   0.137
  503   1HB   GLU  66          2HB       GLU  66   9.486   5.557   1.897
  504   2HB   GLU  66          1HB       GLU  66   9.715   4.450   0.544
  505   1HG   GLU  66          2HG       GLU  66  11.767   5.479   0.466
  506   2HG   GLU  66          1HG       GLU  66  10.867   6.644  -0.507
  507    H    TYR  67           H        TYR  67   8.147   3.803  -0.860
  508    HA   TYR  67           HA       TYR  67   9.261   4.067  -3.442
  509   1HB   TYR  67          2HB       TYR  67   8.816   1.861  -2.698
  510   2HB   TYR  67          1HB       TYR  67   7.132   2.235  -2.332
  511    HD1  TYR  67           HD1      TYR  67   9.336   2.749  -5.339
  512    HD2  TYR  67           HD2      TYR  67   5.677   1.124  -3.778
  513    HE1  TYR  67           HE1      TYR  67   8.674   2.040  -7.620
  514    HE2  TYR  67           HE2      TYR  67   5.020   0.415  -6.060
  515    HH   TYR  67           HH       TYR  67   5.521   0.498  -8.224
  516    H    LEU  68           H        LEU  68   6.271   5.309  -2.228
  517    HA   LEU  68           HA       LEU  68   5.159   5.604  -4.951
  518   1HB   LEU  68          2HB       LEU  68   4.034   5.401  -2.359
  519   2HB   LEU  68          1HB       LEU  68   3.639   7.012  -2.959
  520    HG   LEU  68           HG       LEU  68   2.932   5.879  -5.135
  521   1HD1  LEU  68          1HD1      LEU  68   3.328   3.671  -5.335
  522   2HD1  LEU  68          2HD1      LEU  68   2.207   3.372  -4.007
  523   3HD1  LEU  68          3HD1      LEU  68   3.924   3.604  -3.677
  524   1HD2  LEU  68          1HD2      LEU  68   1.245   4.882  -2.860
  525   2HD2  LEU  68          2HD2      LEU  68   0.746   5.675  -4.355
  526   3HD2  LEU  68          3HD2      LEU  68   1.477   6.619  -3.058
  527    H    GLU  69           H        GLU  69   6.536   7.606  -2.367
  528    HA   GLU  69           HA       GLU  69   5.954  10.147  -3.502
  529   1HB   GLU  69          2HB       GLU  69   7.124   9.433  -1.239
  530   2HB   GLU  69          1HB       GLU  69   8.593   9.605  -2.189
  531   1HG   GLU  69          2HG       GLU  69   8.167  11.897  -2.644
  532   2HG   GLU  69          1HG       GLU  69   6.487  11.768  -2.121
  533    H    ASN  70           H        ASN  70   8.163   7.631  -4.310
  534    HA   ASN  70           HA       ASN  70   8.774   8.784  -6.885
  535   1HB   ASN  70          2HB       ASN  70  10.343   9.867  -4.953
  536   2HB   ASN  70          1HB       ASN  70  11.286   8.425  -5.334
  537   1HD2  ASN  70          1HD2      ASN  70  11.748  11.386  -6.024
  538   2HD2  ASN  70          2HD2      ASN  70  11.976  11.387  -7.706
  539    HA   PRO  71           HA       PRO  71   9.094   4.247  -6.487
  540   1HB   PRO  71          2HB       PRO  71   7.596   3.753  -8.748
  541   2HB   PRO  71          1HB       PRO  71   6.906   3.948  -7.129
  542   1HG   PRO  71          2HG       PRO  71   6.870   5.850  -9.419
  543   2HG   PRO  71          1HG       PRO  71   5.751   5.715  -8.057
  544   1HD   PRO  71          2HD       PRO  71   7.801   7.651  -8.325
  545   2HD   PRO  71          1HD       PRO  71   6.890   7.292  -6.844
  546    H    LYS  72           H        LYS  72   9.676   6.490  -9.113
  547    HA   LYS  72           HA       LYS  72  11.206   4.640 -10.737
  548   1HB   LYS  72          2HB       LYS  72  10.182   6.621 -11.760
  549   2HB   LYS  72          1HB       LYS  72  11.116   7.675 -10.697
  550   1HG   LYS  72          2HG       LYS  72  13.034   6.020 -11.884
  551   2HG   LYS  72          1HG       LYS  72  11.916   6.403 -13.193
  552   1HD   LYS  72          2HD       LYS  72  12.515   8.595 -13.228
  553   2HD   LYS  72          1HD       LYS  72  12.595   8.698 -11.469
  554   1HE   LYS  72          2HE       LYS  72  14.816   8.141 -11.401
  555   2HE   LYS  72          1HE       LYS  72  14.689   7.046 -12.778
  556   1HZ   LYS  72          1HZ       LYS  72  15.725   9.570 -12.816
  557   2HZ   LYS  72          2HZ       LYS  72  14.184   9.761 -13.506
  558   3HZ   LYS  72          3HZ       LYS  72  15.285   8.650 -14.171
  559    H    LYS  73           H        LYS  73  11.752   6.512  -7.910
  560    HA   LYS  73           HA       LYS  73  14.688   6.532  -8.215
  561   1HB   LYS  73          2HB       LYS  73  13.876   8.480  -7.143
  562   2HB   LYS  73          1HB       LYS  73  12.760   7.562  -6.133
  563   1HG   LYS  73          2HG       LYS  73  14.750   8.357  -4.864
  564   2HG   LYS  73          1HG       LYS  73  14.623   6.598  -4.884
  565   1HD   LYS  73          2HD       LYS  73  16.308   6.405  -6.578
  566   2HD   LYS  73          1HD       LYS  73  16.291   8.141  -6.883
  567   1HE   LYS  73          2HE       LYS  73  17.133   8.541  -4.588
  568   2HE   LYS  73          1HE       LYS  73  17.183   6.800  -4.313
  569   1HZ   LYS  73          1HZ       LYS  73  18.961   6.536  -5.673
  570   2HZ   LYS  73          2HZ       LYS  73  19.272   8.128  -5.165
  571   3HZ   LYS  73          3HZ       LYS  73  18.550   7.840  -6.677
  572    H    TYR  74           H        TYR  74  12.236   5.003  -6.115
  573    HA   TYR  74           HA       TYR  74  14.169   3.429  -4.643
  574   1HB   TYR  74          2HB       TYR  74  11.766   4.036  -3.943
  575   2HB   TYR  74          1HB       TYR  74  11.246   2.748  -5.027
  576    HD1  TYR  74           HD1      TYR  74  10.521   0.988  -3.649
  577    HD2  TYR  74           HD2      TYR  74  14.243   2.953  -2.790
  578    HE1  TYR  74           HE1      TYR  74  10.998  -0.688  -1.885
  579    HE2  TYR  74           HE2      TYR  74  14.720   1.274  -1.025
  580    HH   TYR  74           HH       TYR  74  12.616  -0.538   0.403
  581    H    ILE  75           H        ILE  75  11.644   2.348  -6.924
  582    HA   ILE  75           HA       ILE  75  13.261  -0.024  -7.584
  583    HB   ILE  75           HB       ILE  75  10.546   0.556  -8.718
  584   1HG1  ILE  75          2HG1      ILE  75  10.234   1.184  -6.413
  585   2HG1  ILE  75          1HG1      ILE  75   9.599  -0.451  -6.589
  586   1HG2  ILE  75          1HG2      ILE  75  11.980  -1.506  -9.178
  587   2HG2  ILE  75          2HG2      ILE  75  10.327  -1.799  -8.634
  588   3HG2  ILE  75          3HG2      ILE  75  11.670  -1.955  -7.502
  589   1HD1  ILE  75          1HD1      ILE  75  12.010  -1.193  -5.915
  590   2HD1  ILE  75          2HD1      ILE  75  10.918  -0.621  -4.654
  591   3HD1  ILE  75          3HD1      ILE  75  12.161   0.450  -5.296
  592    HA   PRO  76           HA       PRO  76  14.363   2.379 -11.258
  593   1HB   PRO  76          2HB       PRO  76  16.576   0.859 -11.840
  594   2HB   PRO  76          1HB       PRO  76  16.582   2.183 -10.662
  595   1HG   PRO  76          2HG       PRO  76  16.619  -0.758 -10.179
  596   2HG   PRO  76          1HG       PRO  76  17.220   0.555  -9.154
  597   1HD   PRO  76          2HD       PRO  76  14.785  -0.851  -8.804
  598   2HD   PRO  76          1HD       PRO  76  15.258   0.647  -7.981
  599    H    GLY  77           H        GLY  77  12.364   1.375 -12.240
  600   1HA   GLY  77          2HA       GLY  77  12.628   0.139 -14.638
  601   2HA   GLY  77          1HA       GLY  77  12.718  -1.242 -13.545
  602    H    THR  78           H        THR  78  10.843   0.420 -11.698
  603    HA   THR  78           HA       THR  78   8.445  -0.889 -12.161
  604    HB   THR  78           HB       THR  78   8.869   0.540 -10.179
  605    HG1  THR  78           HG1      THR  78   6.649   1.791 -10.833
  606   1HG2  THR  78          1HG2      THR  78   9.676   2.440 -11.910
  607   2HG2  THR  78          2HG2      THR  78   9.105   2.817 -10.284
  608   3HG2  THR  78          3HG2      THR  78   8.014   2.972 -11.661
  609    H    LYS  79           H        LYS  79   6.846  -0.776 -13.649
  610    HA   LYS  79           HA       LYS  79   7.105   1.240 -15.810
  611   1HB   LYS  79          2HB       LYS  79   6.650  -1.410 -16.001
  612   2HB   LYS  79          1HB       LYS  79   4.981  -0.854 -15.879
  613   1HG   LYS  79          2HG       LYS  79   6.129   0.938 -17.669
  614   2HG   LYS  79          1HG       LYS  79   6.859  -0.607 -18.106
  615   1HD   LYS  79          2HD       LYS  79   4.809  -1.587 -18.628
  616   2HD   LYS  79          1HD       LYS  79   3.903  -0.473 -17.604
  617   1HE   LYS  79          2HE       LYS  79   3.402   0.371 -19.715
  618   2HE   LYS  79          1HE       LYS  79   4.814   1.340 -19.294
  619   1HZ   LYS  79          1HZ       LYS  79   5.303  -1.222 -20.594
  620   2HZ   LYS  79          2HZ       LYS  79   6.118   0.258 -20.767
  621   3HZ   LYS  79          3HZ       LYS  79   4.634   0.003 -21.554
  622    H    MET  80           H        MET  80   6.050   1.703 -13.013
  623    HA   MET  80           HA       MET  80   3.232   2.027 -13.008
  624   1HB   MET  80          2HB       MET  80   5.489   3.436 -11.613
  625   2HB   MET  80          1HB       MET  80   3.836   3.980 -11.399
  626   1HG   MET  80          2HG       MET  80   4.142   1.083 -11.086
  627   2HG   MET  80          1HG       MET  80   5.065   2.009  -9.907
  628   1HE   MET  80          1HE       MET  80   3.941   2.932  -7.690
  629   2HE   MET  80          2HE       MET  80   2.568   4.011  -7.920
  630   3HE   MET  80          3HE       MET  80   4.021   4.227  -8.892
  631    H    ILE  81           H        ILE  81   2.023   3.293 -14.364
  632    HA   ILE  81           HA       ILE  81   3.327   5.590 -15.725
  633    HB   ILE  81           HB       ILE  81   0.493   4.574 -16.099
  634   1HG1  ILE  81          2HG1      ILE  81   2.731   3.868 -17.964
  635   2HG1  ILE  81          1HG1      ILE  81   2.541   2.926 -16.485
  636   1HG2  ILE  81          1HG2      ILE  81   1.574   6.883 -16.961
  637   2HG2  ILE  81          2HG2      ILE  81   0.403   5.976 -17.918
  638   3HG2  ILE  81          3HG2      ILE  81   2.128   5.821 -18.255
  639   1HD1  ILE  81          1HD1      ILE  81   0.089   3.460 -18.103
  640   2HD1  ILE  81          2HD1      ILE  81   0.515   2.042 -17.144
  641   3HD1  ILE  81          3HD1      ILE  81   1.241   2.283 -18.734
  642    H    PHE  82           H        PHE  82   2.612   5.456 -12.841
  643    HA   PHE  82           HA       PHE  82   0.306   6.958 -12.203
  644   1HB   PHE  82          2HB       PHE  82   2.270   5.725 -10.789
  645   2HB   PHE  82          1HB       PHE  82   2.719   7.411 -10.552
  646    HD1  PHE  82           HD1      PHE  82   2.089   7.851  -8.333
  647    HD2  PHE  82           HD2      PHE  82  -0.695   5.967 -11.006
  648    HE1  PHE  82           HE1      PHE  82   0.302   8.080  -6.633
  649    HE2  PHE  82           HE2      PHE  82  -2.483   6.200  -9.306
  650    HZ   PHE  82           HZ       PHE  82  -1.977   7.251  -7.121
  651    H    VAL  83           H        VAL  83   0.249   9.198 -11.404
  652    HA   VAL  83           HA       VAL  83   1.866  10.988 -13.147
  653    HB   VAL  83           HB       VAL  83  -0.461  11.396 -13.424
  654   1HG1  VAL  83          1HG1      VAL  83  -0.531  11.007 -10.442
  655   2HG1  VAL  83          2HG1      VAL  83  -1.504  10.222 -11.686
  656   3HG1  VAL  83          3HG1      VAL  83  -1.822  11.900 -11.244
  657   1HG2  VAL  83          1HG2      VAL  83   0.209  13.396 -11.266
  658   2HG2  VAL  83          2HG2      VAL  83  -0.675  13.654 -12.772
  659   3HG2  VAL  83          3HG2      VAL  83   1.072  13.408 -12.805
  660    H    GLY  84           H        GLY  84   1.068  10.302  -9.780
  661   1HA   GLY  84          2HA       GLY  84   2.851  10.732  -8.103
  662   2HA   GLY  84          1HA       GLY  84   3.216  12.220  -8.976
  663    H    ILE  85           H        ILE  85   1.054  10.700  -6.689
  664    HA   ILE  85           HA       ILE  85  -0.961  12.719  -6.564
  665    HB   ILE  85           HB       ILE  85   0.093  10.856  -4.415
  666   1HG1  ILE  85          2HG1      ILE  85  -2.549  10.603  -5.814
  667   2HG1  ILE  85          1HG1      ILE  85  -1.091  10.075  -6.655
  668   1HG2  ILE  85          1HG2      ILE  85  -1.925  13.007  -4.373
  669   2HG2  ILE  85          2HG2      ILE  85  -1.092  12.219  -3.033
  670   3HG2  ILE  85          3HG2      ILE  85  -2.506  11.458  -3.763
  671   1HD1  ILE  85          1HD1      ILE  85  -2.435   8.901  -4.291
  672   2HD1  ILE  85          2HD1      ILE  85  -0.673   8.956  -4.213
  673   3HD1  ILE  85          3HD1      ILE  85  -1.471   8.118  -5.544
  674    H    LYS  86           H        LYS  86  -0.816  14.791  -5.846
  675    HA   LYS  86           HA       LYS  86   1.645  15.589  -4.383
  676   1HB   LYS  86          2HB       LYS  86   0.668  16.794  -6.500
  677   2HB   LYS  86          1HB       LYS  86  -0.452  17.517  -5.346
  678   1HG   LYS  86          2HG       LYS  86   1.197  18.726  -4.287
  679   2HG   LYS  86          1HG       LYS  86   2.443  17.523  -4.625
  680   1HD   LYS  86          2HD       LYS  86   2.837  18.332  -6.768
  681   2HD   LYS  86          1HD       LYS  86   1.223  19.028  -6.915
  682   1HE   LYS  86          2HE       LYS  86   3.172  20.094  -4.881
  683   2HE   LYS  86          1HE       LYS  86   3.230  20.643  -6.555
  684   1HZ   LYS  86          1HZ       LYS  86   0.562  20.663  -5.711
  685   2HZ   LYS  86          2HZ       LYS  86   1.540  21.984  -6.140
  686   3HZ   LYS  86          3HZ       LYS  86   1.483  21.455  -4.527
  687    H    LYS  87           H        LYS  87  -0.732  14.154  -3.190
  688    HA   LYS  87           HA       LYS  87  -1.208  16.111  -0.991
  689   1HB   LYS  87          2HB       LYS  87  -3.185  14.906  -2.773
  690   2HB   LYS  87          1HB       LYS  87  -3.518  14.557  -1.077
  691   1HG   LYS  87          2HG       LYS  87  -4.104  16.698  -0.648
  692   2HG   LYS  87          1HG       LYS  87  -2.702  17.333  -1.512
  693   1HD   LYS  87          2HD       LYS  87  -4.137  16.447  -3.614
  694   2HD   LYS  87          1HD       LYS  87  -5.458  16.805  -2.502
  695   1HE   LYS  87          2HE       LYS  87  -4.477  19.080  -2.150
  696   2HE   LYS  87          1HE       LYS  87  -3.274  18.712  -3.385
  697   1HZ   LYS  87          1HZ       LYS  87  -5.006  18.423  -4.994
  698   2HZ   LYS  87          2HZ       LYS  87  -5.207  19.936  -4.247
  699   3HZ   LYS  87          3HZ       LYS  87  -6.208  18.632  -3.817
  700    H    LYS  88           H        LYS  88  -0.070  15.143   0.647
  701    HA   LYS  88           HA       LYS  88   0.410  12.343   0.888
  702   1HB   LYS  88          2HB       LYS  88   1.783  13.962   2.085
  703   2HB   LYS  88          1HB       LYS  88   0.383  14.516   3.003
  704   1HG   LYS  88          2HG       LYS  88   0.483  12.764   4.439
  705   2HG   LYS  88          1HG       LYS  88   0.816  11.610   3.147
  706   1HD   LYS  88          2HD       LYS  88   2.905  11.533   4.036
  707   2HD   LYS  88          1HD       LYS  88   3.140  13.067   3.195
  708   1HE   LYS  88          2HE       LYS  88   3.797  13.352   5.518
  709   2HE   LYS  88          1HE       LYS  88   2.306  14.251   5.240
  710   1HZ   LYS  88          1HZ       LYS  88   1.071  12.762   6.426
  711   2HZ   LYS  88          2HZ       LYS  88   2.539  12.668   7.278
  712   3HZ   LYS  88          3HZ       LYS  88   2.131  11.468   6.146
  713    H    GLU  89           H        GLU  89  -2.308  14.323   1.811
  714    HA   GLU  89           HA       GLU  89  -3.457  12.497   3.709
  715   1HB   GLU  89          2HB       GLU  89  -4.325  14.930   2.250
  716   2HB   GLU  89          1HB       GLU  89  -5.612  13.849   2.786
  717   1HG   GLU  89          2HG       GLU  89  -5.081  14.112   5.041
  718   2HG   GLU  89          1HG       GLU  89  -3.414  14.577   4.697
  719    H    GLU  90           H        GLU  90  -3.832  12.938   0.203
  720    HA   GLU  90           HA       GLU  90  -5.976  11.073  -0.131
  721   1HB   GLU  90          2HB       GLU  90  -4.836  12.791  -1.811
  722   2HB   GLU  90          1HB       GLU  90  -3.895  11.368  -2.262
  723   1HG   GLU  90          2HG       GLU  90  -5.800  10.174  -2.960
  724   2HG   GLU  90          1HG       GLU  90  -6.896  11.217  -2.055
  725    H    ARG  91           H        ARG  91  -2.440  10.631  -0.537
  726    HA   ARG  91           HA       ARG  91  -2.491   7.872  -1.147
  727   1HB   ARG  91          2HB       ARG  91  -0.501   9.683  -0.843
  728   2HB   ARG  91          1HB       ARG  91  -0.324   8.791   0.670
  729   1HG   ARG  91          2HG       ARG  91  -0.390   6.658  -0.729
  730   2HG   ARG  91          1HG       ARG  91  -0.214   7.693  -2.147
  731   1HD   ARG  91          2HD       ARG  91   1.946   6.725  -1.113
  732   2HD   ARG  91          1HD       ARG  91   1.923   8.451  -1.469
  733    HE   ARG  91           HE       ARG  91   2.168   8.827   0.837
  734   1HH1  ARG  91          1HH1      ARG  91   1.744   5.515   0.304
  735   2HH1  ARG  91          2HH1      ARG  91   1.248   5.149   1.923
  736   1HH2  ARG  91          1HH2      ARG  91   1.090   8.473   2.907
  737   2HH2  ARG  91          2HH2      ARG  91   0.877   6.825   3.398
  738    H    ALA  92           H        ALA  92  -2.392   9.482   2.030
  739    HA   ALA  92           HA       ALA  92  -2.224   7.196   3.666
  740   1HB   ALA  92          1HB       ALA  92  -4.104   9.313   4.558
  741   2HB   ALA  92          2HB       ALA  92  -2.473   9.851   4.154
  742   3HB   ALA  92          3HB       ALA  92  -2.714   8.618   5.392
  743    H    ASP  93           H        ASP  93  -5.051   8.668   2.111
  744    HA   ASP  93           HA       ASP  93  -7.017   6.988   3.324
  745   1HB   ASP  93          2HB       ASP  93  -7.179   8.156   0.539
  746   2HB   ASP  93          1HB       ASP  93  -8.511   7.794   1.637
  747    H    LEU  94           H        LEU  94  -4.996   6.617   0.441
  748    HA   LEU  94           HA       LEU  94  -6.283   4.303  -0.621
  749   1HB   LEU  94          2HB       LEU  94  -3.406   5.240  -0.775
  750   2HB   LEU  94          1HB       LEU  94  -4.030   3.867  -1.687
  751    HG   LEU  94           HG       LEU  94  -5.085   6.707  -1.837
  752   1HD1  LEU  94          1HD1      LEU  94  -3.372   5.029  -3.687
  753   2HD1  LEU  94          2HD1      LEU  94  -2.973   6.593  -2.973
  754   3HD1  LEU  94          3HD1      LEU  94  -4.216   6.483  -4.220
  755   1HD2  LEU  94          1HD2      LEU  94  -6.876   5.108  -2.202
  756   2HD2  LEU  94          2HD2      LEU  94  -5.858   4.151  -3.278
  757   3HD2  LEU  94          3HD2      LEU  94  -6.393   5.758  -3.769
  758    H    ILE  95           H        ILE  95  -3.992   4.723   2.006
  759    HA   ILE  95           HA       ILE  95  -3.398   1.869   2.236
  760    HB   ILE  95           HB       ILE  95  -3.010   3.848   4.468
  761   1HG1  ILE  95          2HG1      ILE  95  -2.246   5.103   2.565
  762   2HG1  ILE  95          1HG1      ILE  95  -0.809   4.419   3.327
  763   1HG2  ILE  95          1HG2      ILE  95  -0.880   2.002   3.581
  764   2HG2  ILE  95          2HG2      ILE  95  -2.347   1.215   4.160
  765   3HG2  ILE  95          3HG2      ILE  95  -1.475   2.335   5.206
  766   1HD1  ILE  95          1HD1      ILE  95  -0.996   2.479   1.716
  767   2HD1  ILE  95          2HD1      ILE  95  -0.604   4.026   0.963
  768   3HD1  ILE  95          3HD1      ILE  95  -2.247   3.391   0.871
  769    H    ALA  96           H        ALA  96  -5.359   4.220   4.048
  770    HA   ALA  96           HA       ALA  96  -6.355   2.540   6.059
  771   1HB   ALA  96          1HB       ALA  96  -7.491   4.413   6.552
  772   2HB   ALA  96          2HB       ALA  96  -8.498   4.200   5.120
  773   3HB   ALA  96          3HB       ALA  96  -6.988   5.105   5.009
  774    H    TYR  97           H        TYR  97  -7.705   3.015   2.774
  775    HA   TYR  97           HA       TYR  97  -9.839   1.128   3.177
  776   1HB   TYR  97          2HB       TYR  97 -10.153   2.726   1.435
  777   2HB   TYR  97          1HB       TYR  97  -8.590   2.349   0.710
  778    HD1  TYR  97           HD1      TYR  97  -8.605   0.997  -1.187
  779    HD2  TYR  97           HD2      TYR  97 -11.724   0.540   1.732
  780    HE1  TYR  97           HE1      TYR  97  -9.669  -0.746  -2.594
  781    HE2  TYR  97           HE2      TYR  97 -12.788  -1.199   0.324
  782    HH   TYR  97           HH       TYR  97 -11.601  -2.912  -1.688
  783    H    LEU  98           H        LEU  98  -6.684   0.929   1.528
  784    HA   LEU  98           HA       LEU  98  -7.005  -1.866   0.885
  785   1HB   LEU  98          2HB       LEU  98  -4.928   0.195   0.589
  786   2HB   LEU  98          1HB       LEU  98  -4.282  -1.421   0.873
  787    HG   LEU  98           HG       LEU  98  -4.537  -1.160  -1.513
  788   1HD1  LEU  98          1HD1      LEU  98  -7.020  -2.669  -1.161
  789   2HD1  LEU  98          2HD1      LEU  98  -5.755  -3.166  -0.038
  790   3HD1  LEU  98          3HD1      LEU  98  -5.457  -3.209  -1.775
  791   1HD2  LEU  98          1HD2      LEU  98  -6.447  -0.295  -2.569
  792   2HD2  LEU  98          2HD2      LEU  98  -6.342   0.699  -1.115
  793   3HD2  LEU  98          3HD2      LEU  98  -7.485  -0.642  -1.186
  794    H    LYS  99           H        LYS  99  -6.577  -0.377   3.826
  795    HA   LYS  99           HA       LYS  99  -4.778  -2.397   4.947
  796   1HB   LYS  99          2HB       LYS  99  -5.657   0.217   5.722
  797   2HB   LYS  99          1HB       LYS  99  -6.070  -0.915   7.009
  798   1HG   LYS  99          2HG       LYS  99  -3.447  -1.551   6.035
  799   2HG   LYS  99          1HG       LYS  99  -3.512   0.173   6.407
  800   1HD   LYS  99          2HD       LYS  99  -3.668  -0.201   8.637
  801   2HD   LYS  99          1HD       LYS  99  -4.839  -1.503   8.421
  802   1HE   LYS  99          2HE       LYS  99  -3.223  -3.024   8.776
  803   2HE   LYS  99          1HE       LYS  99  -2.324  -2.396   7.395
  804   1HZ   LYS  99          1HZ       LYS  99  -2.036  -0.595   9.510
  805   2HZ   LYS  99          2HZ       LYS  99  -0.842  -1.566   8.790
  806   3HZ   LYS  99          3HZ       LYS  99  -1.724  -2.146  10.121
  807    H    LYS 100           H        LYS 100  -8.145  -1.346   5.571
  808    HA   LYS 100           HA       LYS 100  -8.735  -3.748   7.097
  809   1HB   LYS 100          2HB       LYS 100 -10.366  -1.464   6.002
  810   2HB   LYS 100          1HB       LYS 100 -11.168  -2.888   6.664
  811   1HG   LYS 100          2HG       LYS 100 -10.739  -2.236   8.777
  812   2HG   LYS 100          1HG       LYS 100  -9.027  -2.010   8.414
  813   1HD   LYS 100          2HD       LYS 100 -10.276   0.085   9.151
  814   2HD   LYS 100          1HD       LYS 100  -9.392   0.223   7.632
  815   1HE   LYS 100          2HE       LYS 100 -11.292   0.709   6.533
  816   2HE   LYS 100          1HE       LYS 100 -12.029  -0.790   7.096
  817   1HZ   LYS 100          1HZ       LYS 100 -11.989   1.829   8.485
  818   2HZ   LYS 100          2HZ       LYS 100 -12.490   0.384   9.226
  819   3HZ   LYS 100          3HZ       LYS 100 -13.342   0.997   7.891
  820    H    ALA 101           H        ALA 101  -8.963  -2.782   3.743
  821    HA   ALA 101           HA       ALA 101 -10.746  -4.875   2.903
  822   1HB   ALA 101          1HB       ALA 101  -8.749  -3.150   1.429
  823   2HB   ALA 101          2HB       ALA 101 -10.506  -3.001   1.442
  824   3HB   ALA 101          3HB       ALA 101  -9.742  -4.356   0.611
  825    H    THR 102           H        THR 102  -7.184  -4.538   2.751
  826    HA   THR 102           HA       THR 102  -7.063  -7.521   2.538
  827    HB   THR 102           HB       THR 102  -6.398  -6.108   0.460
  828    HG1  THR 102           HG1      THR 102  -5.582  -7.983   0.075
  829   1HG2  THR 102          1HG2      THR 102  -4.724  -4.903   2.363
  830   2HG2  THR 102          2HG2      THR 102  -4.671  -4.677   0.616
  831   3HG2  THR 102          3HG2      THR 102  -3.657  -5.901   1.377
  832    H    ASN 103           H        ASN 103  -7.033  -6.144   5.022
  833    HA   ASN 103           HA       ASN 103  -4.716  -7.247   6.235
  834   1HB   ASN 103          2HB       ASN 103  -3.884  -5.114   4.876
  835   2HB   ASN 103          1HB       ASN 103  -4.469  -4.269   6.309
  836   1HD2  ASN 103          1HD2      ASN 103  -2.608  -7.308   5.671
  837   2HD2  ASN 103          2HD2      ASN 103  -1.438  -7.007   6.863
  838    H    GLU 104           HN       GLU 104  -7.338  -7.377   6.939
  839    HA   GLU 104           HA       GLU 104  -7.804  -5.388   9.086
  840   1HB   GLU 104          2HB       GLU 104  -9.614  -6.247   7.447
  841   2HB   GLU 104          1HB       GLU 104  -9.595  -7.724   8.411
  842   1HG   GLU 104          2HG       GLU 104 -10.039  -6.368  10.450
  843   2HG   GLU 104          1HG       GLU 104 -10.142  -4.924   9.441
  844    HHA  HEC 105           HHA      HEC 105   4.144  -2.468  -9.193
  845    HHB  HEC 105           HHB      HEC 105   1.411   1.162  -4.830
  846    HHC  HEC 105           HHC      HEC 105  -2.075   3.951  -9.313
  847    HHD  HEC 105           HHD      HEC 105   0.679   0.317 -13.688
  848   1HMA  HEC 105          1HMA      HEC 105   2.408  -0.519  -3.834
  849   2HMA  HEC 105          2HMA      HEC 105   4.071  -0.003  -4.118
  850   3HMA  HEC 105          3HMA      HEC 105   3.674  -1.721  -4.080
  851   1HAA  HEC 105          1HAA      HEC 105   4.885  -2.620  -5.522
  852   2HAA  HEC 105          2HAA      HEC 105   5.575  -2.262  -7.093
  853   1HBA  HEC 105          1HBA      HEC 105   5.066  -4.530  -7.279
  854   2HBA  HEC 105          2HBA      HEC 105   3.641  -3.778  -7.993
  855   1HMB  HEC 105          1HMB      HEC 105   0.094   3.895  -4.135
  856   2HMB  HEC 105          2HMB      HEC 105  -0.154   2.168  -3.888
  857   3HMB  HEC 105          3HMB      HEC 105  -1.539   3.233  -4.129
  858    HAB  HEC 105           HAB      HEC 105  -2.330   5.065  -7.522
  859   1HBB  HEC 105          1HBB      HEC 105  -0.769   5.922  -5.825
  860   2HBB  HEC 105          2HBB      HEC 105  -1.704   5.064  -4.599
  861   3HBB  HEC 105          3HBB      HEC 105  -2.460   6.344  -5.549
  862   1HMC  HEC 105          1HMC      HEC 105  -3.344   3.942 -11.154
  863   2HMC  HEC 105          2HMC      HEC 105  -2.206   4.915 -12.086
  864   3HMC  HEC 105          3HMC      HEC 105  -3.198   3.701 -12.894
  865    HAC  HEC 105           HAC      HEC 105  -0.627   1.521 -14.675
  866   1HBC  HEC 105          1HBC      HEC 105  -0.926   3.409 -15.724
  867   2HBC  HEC 105          2HBC      HEC 105  -1.088   4.178 -14.145
  868   3HBC  HEC 105          3HBC      HEC 105  -2.524   3.639 -15.015
  869   1HMD  HEC 105          1HMD      HEC 105   1.635  -2.092 -14.426
  870   2HMD  HEC 105          2HMD      HEC 105   2.704  -0.703 -14.621
  871   3HMD  HEC 105          3HMD      HEC 105   3.383  -2.298 -14.302
  872   1HAD  HEC 105          1HAD      HEC 105   3.716  -4.016 -11.568
  873   2HAD  HEC 105          2HAD      HEC 105   4.413  -3.166 -12.937
  874   1HBD  HEC 105          1HBD      HEC 105   6.297  -3.356 -11.658
  875   2HBD  HEC 105          2HBD      HEC 105   5.403  -3.385 -10.143
  Start of MODEL    5
    1   1H    GLY   1          1HT       GLY   1  -8.897   9.286   8.948
    2   2H    GLY   1          2HT       GLY   1  -9.574   7.816   9.466
    3   3H    GLY   1          3HT       GLY   1 -10.491   9.244   9.530
    4   1HA   GLY   1          1HA       GLY   1 -10.461   9.403   7.117
    5   2HA   GLY   1          2HA       GLY   1  -9.521   7.911   7.060
    6    H    ASP   2           H        ASP   2 -11.644   7.474   5.707
    7    HA   ASP   2           HA       ASP   2 -13.536   6.096   7.560
    8   1HB   ASP   2          2HB       ASP   2 -14.210   8.363   6.128
    9   2HB   ASP   2          1HB       ASP   2 -14.755   7.063   5.068
   10    H    VAL   3           H        VAL   3 -15.014   4.602   6.010
   11    HA   VAL   3           HA       VAL   3 -13.102   2.824   4.687
   12    HB   VAL   3           HB       VAL   3 -16.081   2.446   4.592
   13   1HG1  VAL   3          1HG1      VAL   3 -13.928   0.435   5.233
   14   2HG1  VAL   3          2HG1      VAL   3 -14.265   0.900   3.565
   15   3HG1  VAL   3          3HG1      VAL   3 -15.528   0.155   4.546
   16   1HG2  VAL   3          1HG2      VAL   3 -16.200   2.636   6.842
   17   2HG2  VAL   3          2HG2      VAL   3 -14.449   2.790   6.986
   18   3HG2  VAL   3          3HG2      VAL   3 -15.192   1.191   6.926
   19    H    GLU   4           H        GLU   4 -16.148   4.398   3.613
   20    HA   GLU   4           HA       GLU   4 -15.748   3.821   0.845
   21   1HB   GLU   4          2HB       GLU   4 -17.917   4.556   1.878
   22   2HB   GLU   4          1HB       GLU   4 -17.246   6.182   2.014
   23   1HG   GLU   4          2HG       GLU   4 -17.446   6.592  -0.217
   24   2HG   GLU   4          1HG       GLU   4 -16.979   4.949  -0.659
   25    H    LYS   5           H        LYS   5 -14.495   6.351   2.914
   26    HA   LYS   5           HA       LYS   5 -13.745   8.257   0.953
   27   1HB   LYS   5          2HB       LYS   5 -13.199   7.769   3.729
   28   2HB   LYS   5          1HB       LYS   5 -11.683   8.146   2.909
   29   1HG   LYS   5          2HG       LYS   5 -13.381   9.993   1.798
   30   2HG   LYS   5          1HG       LYS   5 -14.009   9.877   3.442
   31   1HD   LYS   5          2HD       LYS   5 -11.048  10.063   3.103
   32   2HD   LYS   5          1HD       LYS   5 -11.997  11.526   2.834
   33   1HE   LYS   5          2HE       LYS   5 -13.141  10.624   5.127
   34   2HE   LYS   5          1HE       LYS   5 -11.493  10.035   5.345
   35   1HZ   LYS   5          1HZ       LYS   5 -10.838  12.394   4.624
   36   2HZ   LYS   5          2HZ       LYS   5 -11.415  12.164   6.206
   37   3HZ   LYS   5          3HZ       LYS   5 -12.436  12.809   5.011
   38    H    GLY   6           H        GLY   6 -11.593   5.795   2.432
   39   1HA   GLY   6          1HA       GLY   6  -9.533   6.129   0.470
   40   2HA   GLY   6          2HA       GLY   6  -9.689   4.744   1.551
   41    H    LYS   7           H        LYS   7 -12.314   3.935   0.654
   42    HA   LYS   7           HA       LYS   7 -11.624   2.214  -1.493
   43   1HB   LYS   7          2HB       LYS   7 -13.597   2.019   0.137
   44   2HB   LYS   7          1HB       LYS   7 -14.440   3.152  -0.920
   45   1HG   LYS   7          2HG       LYS   7 -13.496   1.376  -2.753
   46   2HG   LYS   7          1HG       LYS   7 -13.748   0.310  -1.371
   47   1HD   LYS   7          2HD       LYS   7 -15.797   2.148  -2.641
   48   2HD   LYS   7          1HD       LYS   7 -15.802   0.384  -2.664
   49   1HE   LYS   7          2HE       LYS   7 -15.591   1.362   0.055
   50   2HE   LYS   7          1HE       LYS   7 -17.007   2.047  -0.742
   51   1HZ   LYS   7          1HZ       LYS   7 -17.978   0.110  -0.298
   52   2HZ   LYS   7          2HZ       LYS   7 -16.507  -0.649   0.090
   53   3HZ   LYS   7          3HZ       LYS   7 -17.016  -0.553  -1.528
   54    H    LYS   8           H        LYS   8 -12.792   5.510  -1.501
   55    HA   LYS   8           HA       LYS   8 -13.534   5.456  -4.335
   56   1HB   LYS   8          2HB       LYS   8 -13.372   7.587  -2.214
   57   2HB   LYS   8          1HB       LYS   8 -13.565   8.030  -3.910
   58   1HG   LYS   8          2HG       LYS   8 -15.478   6.194  -3.829
   59   2HG   LYS   8          1HG       LYS   8 -15.459   6.575  -2.106
   60   1HD   LYS   8          2HD       LYS   8 -15.486   9.069  -2.965
   61   2HD   LYS   8          1HD       LYS   8 -16.154   8.342  -4.427
   62   1HE   LYS   8          2HE       LYS   8 -17.946   7.299  -3.121
   63   2HE   LYS   8          1HE       LYS   8 -17.261   7.949  -1.632
   64   1HZ   LYS   8          1HZ       LYS   8 -17.832   9.831  -3.789
   65   2HZ   LYS   8          2HZ       LYS   8 -17.952  10.038  -2.107
   66   3HZ   LYS   8          3HZ       LYS   8 -19.158   9.189  -2.950
   67    H    ILE   9           H        ILE   9 -10.813   6.674  -2.390
   68    HA   ILE   9           HA       ILE   9  -9.436   7.992  -4.506
   69    HB   ILE   9           HB       ILE   9  -8.108   6.560  -2.198
   70   1HG1  ILE   9          2HG1      ILE   9  -9.889   7.812  -1.194
   71   2HG1  ILE   9          1HG1      ILE   9  -8.440   8.803  -1.022
   72   1HG2  ILE   9          1HG2      ILE   9  -6.352   8.083  -2.513
   73   2HG2  ILE   9          2HG2      ILE   9  -7.378   9.235  -3.370
   74   3HG2  ILE   9          3HG2      ILE   9  -6.858   7.751  -4.171
   75   1HD1  ILE   9          1HD1      ILE   9 -10.731   9.148  -2.952
   76   2HD1  ILE   9          2HD1      ILE   9  -9.157   9.879  -3.268
   77   3HD1  ILE   9          3HD1      ILE   9 -10.060  10.322  -1.820
   78    H    PHE  10           H        PHE  10  -8.747   4.729  -3.158
   79    HA   PHE  10           HA       PHE  10  -6.923   4.014  -5.235
   80   1HB   PHE  10          2HB       PHE  10  -7.185   2.819  -3.032
   81   2HB   PHE  10          1HB       PHE  10  -8.677   2.114  -3.657
   82    HD1  PHE  10           HD1      PHE  10  -5.111   1.815  -3.506
   83    HD2  PHE  10           HD2      PHE  10  -8.533   0.837  -5.911
   84    HE1  PHE  10           HE1      PHE  10  -3.796   0.060  -4.666
   85    HE2  PHE  10           HE2      PHE  10  -7.210  -0.921  -7.067
   86    HZ   PHE  10           HZ       PHE  10  -4.857  -1.307  -6.448
   87    H    ILE  11           H        ILE  11 -10.432   3.520  -4.919
   88    HA   ILE  11           HA       ILE  11 -10.690   1.977  -7.337
   89    HB   ILE  11           HB       ILE  11 -12.667   3.615  -5.737
   90   1HG1  ILE  11          2HG1      ILE  11 -11.674   1.486  -4.784
   91   2HG1  ILE  11          1HG1      ILE  11 -13.430   1.464  -4.959
   92   1HG2  ILE  11          1HG2      ILE  11 -14.226   1.983  -7.215
   93   2HG2  ILE  11          2HG2      ILE  11 -12.923   2.256  -8.371
   94   3HG2  ILE  11          3HG2      ILE  11 -13.825   3.624  -7.720
   95   1HD1  ILE  11          1HD1      ILE  11 -11.902   0.532  -7.321
   96   2HD1  ILE  11          2HD1      ILE  11 -13.379  -0.116  -6.608
   97   3HD1  ILE  11          3HD1      ILE  11 -11.812  -0.507  -5.899
   98    H    MET  12           H        MET  12 -10.019   5.277  -6.826
   99    HA   MET  12           HA       MET  12 -10.691   5.817  -9.683
  100   1HB   MET  12          2HB       MET  12 -12.345   6.869  -8.070
  101   2HB   MET  12          1HB       MET  12 -11.013   7.861  -7.475
  102   1HG   MET  12          2HG       MET  12 -10.770   8.171 -10.194
  103   2HG   MET  12          1HG       MET  12 -12.519   8.060  -9.998
  104   1HE   MET  12          1HE       MET  12 -13.479  10.843  -7.625
  105   2HE   MET  12          2HE       MET  12 -13.159   9.155  -7.234
  106   3HE   MET  12          3HE       MET  12 -13.982   9.563  -8.738
  107    H    LYS  13           H        LYS  13  -8.161   5.231  -7.985
  108    HA   LYS  13           HA       LYS  13  -6.601   7.518  -9.109
  109   1HB   LYS  13          2HB       LYS  13  -6.925   7.494  -6.512
  110   2HB   LYS  13          1HB       LYS  13  -5.758   6.172  -6.550
  111   1HG   LYS  13          2HG       LYS  13  -4.188   7.807  -6.508
  112   2HG   LYS  13          1HG       LYS  13  -4.584   8.026  -8.213
  113   1HD   LYS  13          2HD       LYS  13  -6.148   9.781  -7.708
  114   2HD   LYS  13          1HD       LYS  13  -6.045   9.453  -5.978
  115   1HE   LYS  13          2HE       LYS  13  -3.982  10.469  -5.766
  116   2HE   LYS  13          1HE       LYS  13  -3.509  10.093  -7.423
  117   1HZ   LYS  13          1HZ       LYS  13  -5.788  11.833  -7.248
  118   2HZ   LYS  13          2HZ       LYS  13  -4.370  11.990  -8.170
  119   3HZ   LYS  13          3HZ       LYS  13  -4.392  12.498  -6.550
  120    H    CYS  14           H        CYS  14  -6.516   4.163  -7.918
  121    HA   CYS  14           HA       CYS  14  -4.492   3.590 -10.034
  122   1HB   CYS  14          2HB       CYS  14  -4.217   1.935  -7.609
  123   2HB   CYS  14          1HB       CYS  14  -2.970   2.695  -8.591
  124    H    SER  15           H        SER  15  -7.458   3.213  -9.699
  125    HA   SER  15           HA       SER  15  -7.777   0.300  -9.440
  126   1HB   SER  15          2HB       SER  15  -9.486   2.139  -8.749
  127   2HB   SER  15          1HB       SER  15  -9.882   2.201 -10.464
  128    HG   SER  15           HG       SER  15 -10.620   0.170 -10.379
  129    H    GLN  16           H        GLN  16  -6.381   1.989 -11.755
  130    HA   GLN  16           HA       GLN  16  -7.809   0.719 -14.038
  131   1HB   GLN  16          2HB       GLN  16  -5.993   3.057 -13.712
  132   2HB   GLN  16          1HB       GLN  16  -5.836   2.144 -15.213
  133   1HG   GLN  16          2HG       GLN  16  -8.611   2.415 -14.762
  134   2HG   GLN  16          1HG       GLN  16  -7.908   4.000 -14.434
  135   1HE2  GLN  16          1HE2      GLN  16  -9.543   3.176 -16.814
  136   2HE2  GLN  16          2HE2      GLN  16  -8.559   3.474 -18.165
  137    H    CYS  17           H        CYS  17  -4.600   0.980 -12.537
  138    HA   CYS  17           HA       CYS  17  -3.671  -1.300 -14.202
  139   1HB   CYS  17          2HB       CYS  17  -2.266   0.771 -12.511
  140   2HB   CYS  17          1HB       CYS  17  -1.437  -0.695 -13.033
  141    H    HIS  18           H        HIS  18  -4.675  -0.471 -10.979
  142    HA   HIS  18           HA       HIS  18  -3.781  -3.175 -10.043
  143   1HB   HIS  18          2HB       HIS  18  -4.297  -0.655  -8.445
  144   2HB   HIS  18          1HB       HIS  18  -3.924  -2.228  -7.746
  145    HD1  HIS  18           HD1      HIS  18  -1.508  -3.007  -7.801
  146    HD2  HIS  18           HD2      HIS  18  -2.107   0.536  -9.886
  147    HE1  HIS  18           HE1      HIS  18   0.790  -2.035  -8.228
  148    H    THR  19           H        THR  19  -5.866  -3.984 -11.003
  149    HA   THR  19           HA       THR  19  -8.340  -3.031  -9.769
  150    HB   THR  19           HB       THR  19  -9.394  -4.915 -11.006
  151    HG1  THR  19           HG1      THR  19  -6.777  -5.455 -11.932
  152   1HG2  THR  19          1HG2      THR  19  -8.283  -4.208 -13.333
  153   2HG2  THR  19          2HG2      THR  19  -7.582  -2.947 -12.319
  154   3HG2  THR  19          3HG2      THR  19  -9.334  -3.114 -12.433
  155    H    VAL  20           H        VAL  20  -8.319  -3.417  -7.567
  156    HA   VAL  20           HA       VAL  20  -7.369  -5.980  -6.507
  157    HB   VAL  20           HB       VAL  20  -7.744  -5.024  -4.348
  158   1HG1  VAL  20          1HG1      VAL  20  -6.603  -2.847  -4.530
  159   2HG1  VAL  20          2HG1      VAL  20  -6.963  -2.799  -6.256
  160   3HG1  VAL  20          3HG1      VAL  20  -5.871  -4.027  -5.617
  161   1HG2  VAL  20          1HG2      VAL  20  -8.920  -2.589  -4.539
  162   2HG2  VAL  20          2HG2      VAL  20  -9.822  -4.068  -4.202
  163   3HG2  VAL  20          3HG2      VAL  20  -9.754  -3.430  -5.845
  164    H    GLU  21           H        GLU  21  -9.972  -5.466  -8.228
  165    HA   GLU  21           HA       GLU  21 -11.745  -7.080  -6.439
  166   1HB   GLU  21          2HB       GLU  21 -12.570  -5.098  -8.585
  167   2HB   GLU  21          1HB       GLU  21 -13.666  -6.046  -7.579
  168   1HG   GLU  21          2HG       GLU  21 -13.056  -4.881  -5.612
  169   2HG   GLU  21          1HG       GLU  21 -11.597  -4.223  -6.353
  170    H    LYS  22           H        LYS  22  -9.678  -7.676  -8.695
  171    HA   LYS  22           HA       LYS  22 -11.407  -8.972 -10.702
  172   1HB   LYS  22          2HB       LYS  22  -9.019  -7.784 -10.967
  173   2HB   LYS  22          1HB       LYS  22  -8.460  -9.418 -10.616
  174   1HG   LYS  22          2HG       LYS  22  -8.762  -9.797 -12.835
  175   2HG   LYS  22          1HG       LYS  22 -10.481  -9.870 -12.438
  176   1HD   LYS  22          2HD       LYS  22 -10.656  -7.424 -12.835
  177   2HD   LYS  22          1HD       LYS  22  -8.954  -7.394 -13.300
  178   1HE   LYS  22          2HE       LYS  22 -10.031  -7.591 -15.372
  179   2HE   LYS  22          1HE       LYS  22  -9.644  -9.268 -14.988
  180   1HZ   LYS  22          1HZ       LYS  22 -12.141  -8.426 -13.871
  181   2HZ   LYS  22          2HZ       LYS  22 -11.785  -9.786 -14.826
  182   3HZ   LYS  22          3HZ       LYS  22 -12.119  -8.291 -15.562
  183    H    GLY  23           H        GLY  23 -10.468 -11.336 -11.272
  184   1HA   GLY  23          2HA       GLY  23 -10.895 -12.909  -8.819
  185   2HA   GLY  23          1HA       GLY  23 -10.825 -13.550 -10.461
  186    H    GLY  24           H        GLY  24  -8.558 -11.649  -8.436
  187   1HA   GLY  24          1HA       GLY  24  -6.360 -12.173  -7.765
  188   2HA   GLY  24          2HA       GLY  24  -6.645 -13.831  -8.295
  189    H    LYS  25           H        LYS  25  -7.473 -11.687 -10.749
  190    HA   LYS  25           HA       LYS  25  -4.938 -12.311 -12.172
  191   1HB   LYS  25          2HB       LYS  25  -7.334 -12.754 -13.103
  192   2HB   LYS  25          1HB       LYS  25  -7.357 -11.019 -13.419
  193   1HG   LYS  25          2HG       LYS  25  -5.914 -11.203 -15.157
  194   2HG   LYS  25          1HG       LYS  25  -4.874 -12.331 -14.286
  195   1HD   LYS  25          2HD       LYS  25  -5.722 -13.678 -16.003
  196   2HD   LYS  25          1HD       LYS  25  -6.833 -14.027 -14.677
  197   1HE   LYS  25          2HE       LYS  25  -8.017 -11.829 -15.798
  198   2HE   LYS  25          1HE       LYS  25  -7.324 -12.610 -17.220
  199   1HZ   LYS  25          1HZ       LYS  25  -9.046 -13.943 -15.200
  200   2HZ   LYS  25          2HZ       LYS  25  -8.411 -14.659 -16.604
  201   3HZ   LYS  25          3HZ       LYS  25  -9.561 -13.415 -16.726
  202    H    HIS  26           H        HIS  26  -3.923 -10.549 -13.455
  203    HA   HIS  26           HA       HIS  26  -4.608  -7.819 -12.520
  204   1HB   HIS  26          2HB       HIS  26  -1.926  -7.604 -12.506
  205   2HB   HIS  26          1HB       HIS  26  -2.858  -8.000 -11.071
  206    HD1  HIS  26           HD1      HIS  26  -2.164 -10.413 -13.903
  207    HD2  HIS  26           HD2      HIS  26  -0.983  -9.790  -9.945
  208    HE1  HIS  26           HE1      HIS  26  -0.834 -12.456 -13.220
  209    H    LYS  27           H        LYS  27  -5.078  -6.832 -14.429
  210    HA   LYS  27           HA       LYS  27  -3.958  -7.587 -16.956
  211   1HB   LYS  27          2HB       LYS  27  -5.405  -5.104 -16.007
  212   2HB   LYS  27          1HB       LYS  27  -4.855  -5.293 -17.673
  213   1HG   LYS  27          2HG       LYS  27  -6.804  -6.367 -18.057
  214   2HG   LYS  27          1HG       LYS  27  -6.129  -7.706 -17.128
  215   1HD   LYS  27          2HD       LYS  27  -8.359  -6.983 -16.277
  216   2HD   LYS  27          1HD       LYS  27  -7.085  -6.810 -15.068
  217   1HE   LYS  27          2HE       LYS  27  -7.346  -4.570 -14.978
  218   2HE   LYS  27          1HE       LYS  27  -7.344  -4.427 -16.736
  219   1HZ   LYS  27          1HZ       LYS  27  -9.695  -5.427 -16.531
  220   2HZ   LYS  27          2HZ       LYS  27  -9.467  -3.780 -16.178
  221   3HZ   LYS  27          3HZ       LYS  27  -9.608  -4.911 -14.917
  222    H    THR  28           H        THR  28  -3.610  -4.256 -15.822
  223    HA   THR  28           HA       THR  28  -0.801  -4.289 -16.732
  224    HB   THR  28           HB       THR  28  -2.585  -2.066 -15.690
  225    HG1  THR  28           HG1      THR  28  -1.872  -1.500 -18.046
  226   1HG2  THR  28          1HG2      THR  28   0.328  -2.139 -16.427
  227   2HG2  THR  28          2HG2      THR  28  -0.455  -1.326 -15.072
  228   3HG2  THR  28          3HG2      THR  28  -0.613  -0.672 -16.700
  229    H    GLY  29           H        GLY  29  -1.690  -2.273 -14.014
  230   1HA   GLY  29          2HA       GLY  29   0.492  -2.965 -12.393
  231   2HA   GLY  29          1HA       GLY  29  -1.025  -2.340 -11.759
  232    HA   PRO  30           HA       PRO  30  -0.358  -6.983 -10.826
  233   1HB   PRO  30          2HB       PRO  30   0.558  -6.750  -8.247
  234   2HB   PRO  30          1HB       PRO  30   1.615  -6.883  -9.664
  235   1HG   PRO  30          2HG       PRO  30   0.883  -4.434  -8.093
  236   2HG   PRO  30          1HG       PRO  30   2.426  -4.864  -8.849
  237   1HD   PRO  30          2HD       PRO  30   0.639  -3.091  -9.989
  238   2HD   PRO  30          1HD       PRO  30   1.780  -4.066 -10.931
  239    H    ASN  31           H        ASN  31  -1.837  -8.144  -9.530
  240    HA   ASN  31           HA       ASN  31  -4.248  -6.804  -8.807
  241   1HB   ASN  31          2HB       ASN  31  -4.316  -9.140  -9.395
  242   2HB   ASN  31          1HB       ASN  31  -3.175  -9.553  -8.114
  243   1HD2  ASN  31          1HD2      ASN  31  -6.159  -7.509  -8.130
  244   2HD2  ASN  31          2HD2      ASN  31  -6.906  -8.335  -6.848
  245    H    LEU  32           H        LEU  32  -4.090  -5.253  -7.249
  246    HA   LEU  32           HA       LEU  32  -2.467  -5.624  -4.860
  247   1HB   LEU  32          2HB       LEU  32  -3.878  -3.441  -6.184
  248   2HB   LEU  32          1HB       LEU  32  -4.123  -3.417  -4.438
  249    HG   LEU  32           HG       LEU  32  -1.825  -3.175  -3.994
  250   1HD1  LEU  32          1HD1      LEU  32  -0.274  -3.389  -6.193
  251   2HD1  LEU  32          2HD1      LEU  32  -1.540  -4.545  -6.613
  252   3HD1  LEU  32          3HD1      LEU  32  -0.613  -4.754  -5.128
  253   1HD2  LEU  32          1HD2      LEU  32  -1.037  -1.536  -5.948
  254   2HD2  LEU  32          2HD2      LEU  32  -2.301  -1.063  -4.814
  255   3HD2  LEU  32          3HD2      LEU  32  -2.733  -1.668  -6.413
  256    H    HIS  33           H        HIS  33  -4.133  -7.724  -4.746
  257    HA   HIS  33           HA       HIS  33  -6.460  -6.962  -3.063
  258   1HB   HIS  33          2HB       HIS  33  -6.746  -8.579  -4.982
  259   2HB   HIS  33          1HB       HIS  33  -5.692  -9.700  -4.120
  260    HD1  HIS  33           HD1      HIS  33  -7.846  -7.700  -1.914
  261    HD2  HIS  33           HD2      HIS  33  -8.121 -11.360  -3.893
  262    HE1  HIS  33           HE1      HIS  33  -9.785  -8.942  -0.859
  263    H    GLY  34           H        GLY  34  -3.940  -6.561  -1.907
  264   1HA   GLY  34          2HA       GLY  34  -3.786  -7.240   0.588
  265   2HA   GLY  34          1HA       GLY  34  -3.622  -8.877  -0.049
  266    H    LEU  35           H        LEU  35  -2.245  -5.772  -1.129
  267    HA   LEU  35           HA       LEU  35   0.288  -6.908  -1.793
  268   1HB   LEU  35          2HB       LEU  35  -0.831  -4.670  -2.547
  269   2HB   LEU  35          1HB       LEU  35  -0.056  -4.003  -1.110
  270    HG   LEU  35           HG       LEU  35   1.603  -5.697  -2.928
  271   1HD1  LEU  35          1HD1      LEU  35   1.412  -4.342  -4.714
  272   2HD1  LEU  35          2HD1      LEU  35   1.813  -2.943  -3.716
  273   3HD1  LEU  35          3HD1      LEU  35   0.135  -3.455  -3.881
  274   1HD2  LEU  35          1HD2      LEU  35   3.004  -4.942  -1.301
  275   2HD2  LEU  35          2HD2      LEU  35   1.919  -3.627  -0.849
  276   3HD2  LEU  35          3HD2      LEU  35   3.005  -3.441  -2.226
  277    H    PHE  36           H        PHE  36  -0.924  -5.366   1.152
  278    HA   PHE  36           HA       PHE  36   1.571  -4.945   2.446
  279   1HB   PHE  36          2HB       PHE  36  -1.086  -5.693   3.702
  280   2HB   PHE  36          1HB       PHE  36   0.285  -4.971   4.541
  281    HD1  PHE  36           HD1      PHE  36   1.182  -3.101   2.313
  282    HD2  PHE  36           HD2      PHE  36  -2.688  -3.936   3.974
  283    HE1  PHE  36           HE1      PHE  36   0.408  -0.841   1.645
  284    HE2  PHE  36           HE2      PHE  36  -3.463  -1.678   3.307
  285    HZ   PHE  36           HZ       PHE  36  -1.916  -0.130   2.146
  286    H    GLY  37           H        GLY  37   2.894  -6.288   3.655
  287   1HA   GLY  37          2HA       GLY  37   3.762  -8.286   4.534
  288   2HA   GLY  37          1HA       GLY  37   2.112  -8.911   4.562
  289    H    ARG  38           H        ARG  38   3.274  -7.704   1.537
  290    HA   ARG  38           HA       ARG  38   3.907 -10.483   0.646
  291   1HB   ARG  38          2HB       ARG  38   1.519  -9.582   0.073
  292   2HB   ARG  38          1HB       ARG  38   2.365  -8.594  -1.118
  293   1HG   ARG  38          2HG       ARG  38   3.476 -10.754  -1.918
  294   2HG   ARG  38          1HG       ARG  38   2.294 -11.612  -0.928
  295   1HD   ARG  38          2HD       ARG  38   1.639 -11.279  -3.367
  296   2HD   ARG  38          1HD       ARG  38   0.459 -10.717  -2.184
  297    HE   ARG  38           HE       ARG  38   0.740  -8.599  -3.155
  298   1HH1  ARG  38          1HH1      ARG  38   2.696 -10.154  -5.113
  299   2HH1  ARG  38          2HH1      ARG  38   4.021  -9.038  -5.110
  300   1HH2  ARG  38          1HH2      ARG  38   2.866  -7.260  -2.366
  301   2HH2  ARG  38          2HH2      ARG  38   4.118  -7.401  -3.555
  302    H    LYS  39           H        LYS  39   6.122 -10.112   0.381
  303    HA   LYS  39           HA       LYS  39   7.288  -7.721  -0.635
  304   1HB   LYS  39          2HB       LYS  39   9.284  -9.111  -1.073
  305   2HB   LYS  39          1HB       LYS  39   8.593  -9.486   0.506
  306   1HG   LYS  39          2HG       LYS  39   7.228 -11.278  -0.919
  307   2HG   LYS  39          1HG       LYS  39   8.624 -11.131  -1.988
  308   1HD   LYS  39          2HD       LYS  39   9.666 -11.276   0.634
  309   2HD   LYS  39          1HD       LYS  39   8.419 -12.519   0.536
  310   1HE   LYS  39          2HE       LYS  39  10.598 -13.410  -0.197
  311   2HE   LYS  39          1HE       LYS  39   9.444 -13.393  -1.531
  312   1HZ   LYS  39          1HZ       LYS  39  11.927 -12.061  -1.315
  313   2HZ   LYS  39          2HZ       LYS  39  10.686 -10.921  -1.532
  314   3HZ   LYS  39          3HZ       LYS  39  10.894 -12.178  -2.655
  315    H    THR  40           H        THR  40   8.488  -7.682  -2.839
  316    HA   THR  40           HA       THR  40   6.523  -8.014  -4.930
  317    HB   THR  40           HB       THR  40   9.278  -7.737  -5.866
  318    HG1  THR  40           HG1      THR  40   8.431  -5.574  -4.344
  319   1HG2  THR  40          1HG2      THR  40   8.295  -6.221  -7.258
  320   2HG2  THR  40          2HG2      THR  40   7.357  -5.487  -5.957
  321   3HG2  THR  40          3HG2      THR  40   6.806  -6.987  -6.703
  322    H    GLY  41           H        GLY  41   7.243  -9.206  -7.038
  323   1HA   GLY  41          2HA       GLY  41   7.861 -11.196  -8.117
  324   2HA   GLY  41          1HA       GLY  41   8.930 -11.527  -6.758
  325    H    GLN  42           H        GLN  42   5.458 -11.536  -7.625
  326    HA   GLN  42           HA       GLN  42   5.198 -14.014  -5.983
  327   1HB   GLN  42          2HB       GLN  42   3.171 -11.758  -5.999
  328   2HB   GLN  42          1HB       GLN  42   3.087 -13.244  -5.054
  329   1HG   GLN  42          2HG       GLN  42   5.113 -11.012  -4.771
  330   2HG   GLN  42          1HG       GLN  42   3.900 -11.508  -3.590
  331   1HE2  GLN  42          1HE2      GLN  42   6.921 -11.507  -3.351
  332   2HE2  GLN  42          2HE2      GLN  42   7.333 -13.104  -2.956
  333    H    ALA  43           H        ALA  43   3.422 -11.907  -8.285
  334    HA   ALA  43           HA       ALA  43   1.819 -14.092  -9.280
  335   1HB   ALA  43          1HB       ALA  43   0.971 -11.852  -9.526
  336   2HB   ALA  43          2HB       ALA  43   1.296 -12.463 -11.149
  337   3HB   ALA  43          3HB       ALA  43   2.422 -11.338 -10.387
  338    HA   PRO  44           HA       PRO  44   4.854 -15.788 -12.024
  339   1HB   PRO  44          2HB       PRO  44   3.157 -17.525 -13.312
  340   2HB   PRO  44          1HB       PRO  44   3.800 -17.812 -11.686
  341   1HG   PRO  44          2HG       PRO  44   1.054 -16.994 -12.498
  342   2HG   PRO  44          1HG       PRO  44   1.584 -17.851 -11.042
  343   1HD   PRO  44          2HD       PRO  44   0.918 -15.096 -11.212
  344   2HD   PRO  44          1HD       PRO  44   1.716 -15.904  -9.846
  345    H    GLY  45           H        GLY  45   1.837 -15.897 -13.902
  346   1HA   GLY  45          2HA       GLY  45   2.821 -15.214 -16.383
  347   2HA   GLY  45          1HA       GLY  45   1.209 -14.727 -15.857
  348    H    TYR  46           H        TYR  46   2.189 -13.011 -13.703
  349    HA   TYR  46           HA       TYR  46   2.709 -10.614 -15.296
  350   1HB   TYR  46          2HB       TYR  46   1.297 -10.872 -13.095
  351   2HB   TYR  46          1HB       TYR  46   2.856 -10.729 -12.291
  352    HD1  TYR  46           HD1      TYR  46   0.252  -8.822 -12.552
  353    HD2  TYR  46           HD2      TYR  46   4.224  -8.778 -14.136
  354    HE1  TYR  46           HE1      TYR  46   0.119  -6.365 -12.806
  355    HE2  TYR  46           HE2      TYR  46   4.105  -6.328 -14.389
  356    HH   TYR  46           HH       TYR  46   1.831  -4.440 -12.896
  357    H    SER  47           H        SER  47   4.738  -9.969 -15.845
  358    HA   SER  47           HA       SER  47   7.079 -11.146 -14.492
  359   1HB   SER  47          2HB       SER  47   6.614 -10.225 -17.080
  360   2HB   SER  47          1HB       SER  47   7.596  -8.951 -16.366
  361    HG   SER  47           HG       SER  47   8.806 -10.702 -17.322
  362    H    TYR  48           H        TYR  48   6.067  -9.989 -12.487
  363    HA   TYR  48           HA       TYR  48   5.862  -7.348 -11.932
  364   1HB   TYR  48          2HB       TYR  48   7.056  -9.596 -10.373
  365   2HB   TYR  48          1HB       TYR  48   7.186  -7.962  -9.725
  366    HD1  TYR  48           HD1      TYR  48   4.361  -8.878 -11.874
  367    HD2  TYR  48           HD2      TYR  48   5.707  -8.489  -7.856
  368    HE1  TYR  48           HE1      TYR  48   2.025  -9.018 -11.056
  369    HE2  TYR  48           HE2      TYR  48   3.393  -8.627  -7.041
  370    HH   TYR  48           HH       TYR  48   0.911  -9.782  -8.784
  371    H    THR  49           H        THR  49   7.354  -5.749 -10.994
  372    HA   THR  49           HA       THR  49   9.647  -5.327 -12.682
  373    HB   THR  49           HB       THR  49  10.028  -3.342 -11.339
  374    HG1  THR  49           HG1      THR  49   8.330  -4.694  -9.533
  375   1HG2  THR  49          1HG2      THR  49   8.265  -2.788 -12.698
  376   2HG2  THR  49          2HG2      THR  49   7.447  -2.644 -11.143
  377   3HG2  THR  49          3HG2      THR  49   7.258  -4.109 -12.106
  378    H    ALA  50           H        ALA  50  10.963  -7.175 -12.372
  379    HA   ALA  50           HA       ALA  50  11.871  -8.469 -10.151
  380   1HB   ALA  50          1HB       ALA  50  13.290  -9.298 -11.685
  381   2HB   ALA  50          2HB       ALA  50  14.230  -7.807 -11.609
  382   3HB   ALA  50          3HB       ALA  50  12.911  -7.959 -12.768
  383    H    ALA  51           H        ALA  51  12.735  -5.184 -11.102
  384    HA   ALA  51           HA       ALA  51  14.895  -4.686  -9.380
  385   1HB   ALA  51          1HB       ALA  51  12.618  -2.935 -10.304
  386   2HB   ALA  51          2HB       ALA  51  14.299  -2.919 -10.835
  387   3HB   ALA  51          3HB       ALA  51  13.874  -2.309  -9.236
  388    H    ASN  52           H        ASN  52  11.495  -3.851  -8.580
  389    HA   ASN  52           HA       ASN  52  11.687  -3.275  -5.910
  390   1HB   ASN  52          2HB       ASN  52   9.642  -4.476  -7.620
  391   2HB   ASN  52          1HB       ASN  52   9.497  -4.978  -5.934
  392   1HD2  ASN  52          1HD2      ASN  52   8.223  -2.749  -7.911
  393   2HD2  ASN  52          2HD2      ASN  52   8.067  -1.431  -6.852
  394    H    LYS  53           H        LYS  53  11.270  -6.627  -7.116
  395    HA   LYS  53           HA       LYS  53  11.489  -7.947  -4.648
  396   1HB   LYS  53          2HB       LYS  53  11.302  -8.723  -7.292
  397   2HB   LYS  53          1HB       LYS  53  12.887  -9.337  -6.820
  398   1HG   LYS  53          2HG       LYS  53  10.381  -9.785  -5.179
  399   2HG   LYS  53          1HG       LYS  53  10.961 -10.929  -6.391
  400   1HD   LYS  53          2HD       LYS  53  13.113 -10.110  -4.617
  401   2HD   LYS  53          1HD       LYS  53  11.763 -10.791  -3.708
  402   1HE   LYS  53          2HE       LYS  53  11.964 -12.871  -4.694
  403   2HE   LYS  53          1HE       LYS  53  12.623 -12.213  -6.191
  404   1HZ   LYS  53          1HZ       LYS  53  14.647 -12.635  -5.444
  405   2HZ   LYS  53          2HZ       LYS  53  14.010 -13.264  -4.000
  406   3HZ   LYS  53          3HZ       LYS  53  14.396 -11.613  -4.114
  407    H    ASN  54           H        ASN  54  14.106  -6.919  -6.829
  408    HA   ASN  54           HA       ASN  54  16.222  -8.067  -5.288
  409   1HB   ASN  54          2HB       ASN  54  16.114  -6.944  -7.736
  410   2HB   ASN  54          1HB       ASN  54  16.749  -5.574  -6.823
  411   1HD2  ASN  54          1HD2      ASN  54  18.557  -6.507  -8.581
  412   2HD2  ASN  54          2HD2      ASN  54  19.732  -7.482  -7.840
  413    H    LYS  55           H        LYS  55  14.419  -5.092  -5.003
  414    HA   LYS  55           HA       LYS  55  16.302  -3.768  -3.270
  415   1HB   LYS  55          2HB       LYS  55  14.209  -2.891  -4.684
  416   2HB   LYS  55          1HB       LYS  55  13.392  -3.143  -3.144
  417   1HG   LYS  55          2HG       LYS  55  14.157  -0.925  -2.972
  418   2HG   LYS  55          1HG       LYS  55  15.409  -1.838  -2.130
  419   1HD   LYS  55          2HD       LYS  55  16.373  -1.964  -4.658
  420   2HD   LYS  55          1HD       LYS  55  15.535  -0.415  -4.734
  421   1HE   LYS  55          2HE       LYS  55  16.790   0.446  -2.869
  422   2HE   LYS  55          1HE       LYS  55  17.473  -1.144  -2.524
  423   1HZ   LYS  55          1HZ       LYS  55  19.166  -0.354  -3.748
  424   2HZ   LYS  55          2HZ       LYS  55  18.209   0.793  -4.558
  425   3HZ   LYS  55          3HZ       LYS  55  18.203  -0.831  -5.061
  426    H    GLY  56           H        GLY  56  14.538  -6.520  -2.784
  427   1HA   GLY  56          1HA       GLY  56  13.687  -7.609  -0.877
  428   2HA   GLY  56          2HA       GLY  56  15.077  -6.862  -0.085
  429    H    ILE  57           H        ILE  57  12.599  -4.913  -1.566
  430    HA   ILE  57           HA       ILE  57  12.065  -3.618   1.004
  431    HB   ILE  57           HB       ILE  57  12.186  -2.460  -1.286
  432   1HG1  ILE  57          2HG1      ILE  57  11.298  -1.432   0.829
  433   2HG1  ILE  57          1HG1      ILE  57  10.542  -0.799  -0.633
  434   1HG2  ILE  57          1HG2      ILE  57  10.258  -2.505  -2.687
  435   2HG2  ILE  57          2HG2      ILE  57   9.303  -3.350  -1.469
  436   3HG2  ILE  57          3HG2      ILE  57  10.600  -4.194  -2.314
  437   1HD1  ILE  57          1HD1      ILE  57   8.597  -1.267   0.449
  438   2HD1  ILE  57          2HD1      ILE  57   9.366  -2.412   1.546
  439   3HD1  ILE  57          3HD1      ILE  57   8.905  -2.919  -0.077
  440    H    ILE  58           H        ILE  58  10.467  -4.195   2.383
  441    HA   ILE  58           HA       ILE  58   8.410  -6.123   1.439
  442    HB   ILE  58           HB       ILE  58   9.430  -6.772   3.523
  443   1HG1  ILE  58          2HG1      ILE  58   7.521  -6.914   4.955
  444   2HG1  ILE  58          1HG1      ILE  58   6.854  -5.403   4.335
  445   1HG2  ILE  58          1HG2      ILE  58   8.894  -4.857   5.423
  446   2HG2  ILE  58          2HG2      ILE  58   9.306  -3.870   4.021
  447   3HG2  ILE  58          3HG2      ILE  58  10.452  -5.067   4.624
  448   1HD1  ILE  58          1HD1      ILE  58   7.327  -7.712   2.465
  449   2HD1  ILE  58          2HD1      ILE  58   6.188  -6.376   2.311
  450   3HD1  ILE  58          3HD1      ILE  58   5.876  -7.672   3.466
  451    H    TRP  59           H        TRP  59   6.886  -4.921   0.362
  452    HA   TRP  59           HA       TRP  59   6.070  -2.340   0.569
  453   1HB   TRP  59          2HB       TRP  59   4.313  -4.784   0.290
  454   2HB   TRP  59          1HB       TRP  59   3.742  -3.136   0.021
  455    HD1  TRP  59           HD1      TRP  59   4.701  -5.826  -2.003
  456    HE1  TRP  59           HE1      TRP  59   5.900  -5.107  -4.169
  457    HE3  TRP  59           HE3      TRP  59   5.950  -1.032  -0.767
  458    HZ2  TRP  59           HZ2      TRP  59   7.213  -2.799  -5.232
  459    HZ3  TRP  59           HZ3      TRP  59   7.175   0.402  -2.373
  460    HH2  TRP  59           HH2      TRP  59   7.808  -0.475  -4.604
  461    H    GLY  60           H        GLY  60   5.842  -1.173   2.391
  462   1HA   GLY  60          1HA       GLY  60   3.948  -2.205   4.462
  463   2HA   GLY  60          2HA       GLY  60   5.470  -1.450   4.935
  464    H    GLU  61           H        GLU  61   4.241   0.215   6.051
  465    HA   GLU  61           HA       GLU  61   2.450   1.940   4.503
  466   1HB   GLU  61          2HB       GLU  61   1.930   1.651   6.840
  467   2HB   GLU  61          1HB       GLU  61   3.562   2.128   7.315
  468   1HG   GLU  61          2HG       GLU  61   2.985   4.302   7.300
  469   2HG   GLU  61          1HG       GLU  61   2.394   4.172   5.643
  470    H    ASP  62           H        ASP  62   5.492   2.578   6.295
  471    HA   ASP  62           HA       ASP  62   5.937   5.075   4.936
  472   1HB   ASP  62          2HB       ASP  62   8.109   5.068   6.041
  473   2HB   ASP  62          1HB       ASP  62   6.885   4.514   7.183
  474    H    THR  63           H        THR  63   7.026   1.759   4.409
  475    HA   THR  63           HA       THR  63   9.008   2.357   2.436
  476    HB   THR  63           HB       THR  63   7.942  -0.144   1.767
  477    HG1  THR  63           HG1      THR  63   8.173  -0.307   4.493
  478   1HG2  THR  63          1HG2      THR  63  10.020  -0.888   2.424
  479   2HG2  THR  63          2HG2      THR  63  10.006   0.064   3.909
  480   3HG2  THR  63          3HG2      THR  63  10.351   0.844   2.365
  481    H    LEU  64           H        LEU  64   5.569   1.411   2.098
  482    HA   LEU  64           HA       LEU  64   5.583   1.648  -0.778
  483   1HB   LEU  64          2HB       LEU  64   3.851   0.568   0.996
  484   2HB   LEU  64          1HB       LEU  64   3.040   2.104   0.686
  485    HG   LEU  64           HG       LEU  64   4.017   0.256  -1.503
  486   1HD1  LEU  64          1HD1      LEU  64   2.057  -0.454   0.187
  487   2HD1  LEU  64          2HD1      LEU  64   1.979  -0.811  -1.538
  488   3HD1  LEU  64          3HD1      LEU  64   1.119   0.584  -0.887
  489   1HD2  LEU  64          1HD2      LEU  64   3.683   2.207  -2.640
  490   2HD2  LEU  64          2HD2      LEU  64   2.699   2.901  -1.352
  491   3HD2  LEU  64          3HD2      LEU  64   1.979   1.776  -2.503
  492    H    MET  65           H        MET  65   4.961   3.891   1.866
  493    HA   MET  65           HA       MET  65   3.737   5.975   0.373
  494   1HB   MET  65          2HB       MET  65   3.828   6.025   2.822
  495   2HB   MET  65          1HB       MET  65   5.587   6.149   2.772
  496   1HG   MET  65          2HG       MET  65   4.237   8.176   1.135
  497   2HG   MET  65          1HG       MET  65   3.848   8.294   2.851
  498   1HE   MET  65          1HE       MET  65   5.008  10.693   1.947
  499   2HE   MET  65          2HE       MET  65   5.774  10.016   0.512
  500   3HE   MET  65          3HE       MET  65   6.751  10.870   1.703
  501    H    GLU  66           H        GLU  66   7.104   5.029   0.777
  502    HA   GLU  66           HA       GLU  66   8.160   7.369  -0.575
  503   1HB   GLU  66          2HB       GLU  66   9.343   5.774   1.125
  504   2HB   GLU  66          1HB       GLU  66   9.644   4.770  -0.292
  505   1HG   GLU  66          2HG       GLU  66  10.938   6.437  -1.351
  506   2HG   GLU  66          1HG       GLU  66  10.316   7.709  -0.298
  507    H    TYR  67           H        TYR  67   7.892   3.908  -1.454
  508    HA   TYR  67           HA       TYR  67   8.777   4.174  -4.132
  509   1HB   TYR  67          2HB       TYR  67   8.507   1.979  -3.110
  510   2HB   TYR  67          1HB       TYR  67   6.769   2.236  -2.943
  511    HD1  TYR  67           HD1      TYR  67   5.483   1.096  -4.505
  512    HD2  TYR  67           HD2      TYR  67   9.318   2.633  -5.679
  513    HE1  TYR  67           HE1      TYR  67   5.128   0.233  -6.802
  514    HE2  TYR  67           HE2      TYR  67   8.963   1.770  -7.974
  515    HH   TYR  67           HH       TYR  67   6.386  -0.383  -8.750
  516    H    LEU  68           H        LEU  68   5.871   5.285  -2.666
  517    HA   LEU  68           HA       LEU  68   4.430   5.383  -5.249
  518   1HB   LEU  68          2HB       LEU  68   3.594   5.177  -2.585
  519   2HB   LEU  68          1HB       LEU  68   3.152   6.816  -3.067
  520    HG   LEU  68           HG       LEU  68   2.189   5.754  -5.200
  521   1HD1  LEU  68          1HD1      LEU  68   1.833   3.246  -3.645
  522   2HD1  LEU  68          2HD1      LEU  68   3.429   3.507  -4.349
  523   3HD1  LEU  68          3HD1      LEU  68   2.002   3.477  -5.386
  524   1HD2  LEU  68          1HD2      LEU  68   1.099   6.266  -2.688
  525   2HD2  LEU  68          2HD2      LEU  68   0.529   4.640  -3.064
  526   3HD2  LEU  68          3HD2      LEU  68   0.186   5.972  -4.168
  527    H    GLU  69           H        GLU  69   5.878   7.604  -2.875
  528    HA   GLU  69           HA       GLU  69   5.098  10.037  -4.119
  529   1HB   GLU  69          2HB       GLU  69   6.444   9.465  -1.890
  530   2HB   GLU  69          1HB       GLU  69   7.826   9.749  -2.936
  531   1HG   GLU  69          2HG       GLU  69   5.808  11.798  -3.326
  532   2HG   GLU  69          1HG       GLU  69   6.284  11.703  -1.631
  533    H    ASN  70           H        ASN  70   7.337   7.573  -4.948
  534    HA   ASN  70           HA       ASN  70   7.793   8.597  -7.595
  535   1HB   ASN  70          2HB       ASN  70  10.291   8.912  -7.313
  536   2HB   ASN  70          1HB       ASN  70   9.309  10.163  -6.549
  537   1HD2  ASN  70          1HD2      ASN  70  11.585  10.224  -5.304
  538   2HD2  ASN  70          2HD2      ASN  70  11.645   9.293  -3.887
  539    HA   PRO  71           HA       PRO  71   8.381   4.134  -7.070
  540   1HB   PRO  71          2HB       PRO  71   7.273   3.512  -9.516
  541   2HB   PRO  71          1HB       PRO  71   6.332   3.723  -8.031
  542   1HG   PRO  71          2HG       PRO  71   6.611   5.572 -10.354
  543   2HG   PRO  71          1HG       PRO  71   5.272   5.404  -9.207
  544   1HD   PRO  71          2HD       PRO  71   7.219   7.444  -9.156
  545   2HD   PRO  71          1HD       PRO  71   6.124   7.026  -7.821
  546    H    LYS  72           H        LYS  72   9.068   6.059  -9.999
  547    HA   LYS  72           HA       LYS  72  11.028   4.214 -11.019
  548   1HB   LYS  72          2HB       LYS  72   9.904   5.953 -12.420
  549   2HB   LYS  72          1HB       LYS  72  10.804   7.192 -11.544
  550   1HG   LYS  72          2HG       LYS  72  11.928   6.603 -13.669
  551   2HG   LYS  72          1HG       LYS  72  12.927   6.183 -12.278
  552   1HD   LYS  72          2HD       LYS  72  12.955   4.025 -12.908
  553   2HD   LYS  72          1HD       LYS  72  11.192   3.974 -12.882
  554   1HE   LYS  72          2HE       LYS  72  11.358   5.197 -15.179
  555   2HE   LYS  72          1HE       LYS  72  13.023   4.617 -15.184
  556   1HZ   LYS  72          1HZ       LYS  72  11.118   3.173 -16.182
  557   2HZ   LYS  72          2HZ       LYS  72  10.859   2.732 -14.561
  558   3HZ   LYS  72          3HZ       LYS  72  12.366   2.444 -15.294
  559    H    LYS  73           H        LYS  73  11.026   6.273  -8.347
  560    HA   LYS  73           HA       LYS  73  13.918   6.847  -8.411
  561   1HB   LYS  73          2HB       LYS  73  12.559   8.587  -7.470
  562   2HB   LYS  73          1HB       LYS  73  11.713   7.447  -6.426
  563   1HG   LYS  73          2HG       LYS  73  13.226   7.892  -4.822
  564   2HG   LYS  73          1HG       LYS  73  14.452   7.128  -5.832
  565   1HD   LYS  73          2HD       LYS  73  13.935   9.765  -6.841
  566   2HD   LYS  73          1HD       LYS  73  14.265   9.867  -5.111
  567   1HE   LYS  73          2HE       LYS  73  16.039   8.045  -6.625
  568   2HE   LYS  73          1HE       LYS  73  16.213   9.757  -7.011
  569   1HZ   LYS  73          1HZ       LYS  73  17.660   9.278  -5.216
  570   2HZ   LYS  73          2HZ       LYS  73  16.440   8.478  -4.346
  571   3HZ   LYS  73          3HZ       LYS  73  16.362  10.160  -4.572
  572    H    TYR  74           H        TYR  74  11.680   5.076  -6.230
  573    HA   TYR  74           HA       TYR  74  13.828   3.812  -4.769
  574   1HB   TYR  74          2HB       TYR  74  11.284   4.122  -4.152
  575   2HB   TYR  74          1HB       TYR  74  11.088   2.595  -5.009
  576    HD1  TYR  74           HD1      TYR  74  10.424   2.716  -2.163
  577    HD2  TYR  74           HD2      TYR  74  14.224   2.058  -4.057
  578    HE1  TYR  74           HE1      TYR  74  11.209   1.486  -0.160
  579    HE2  TYR  74           HE2      TYR  74  15.010   0.827  -2.051
  580    HH   TYR  74           HH       TYR  74  13.262   0.850   0.916
  581    H    ILE  75           H        ILE  75  11.424   2.339  -6.966
  582    HA   ILE  75           HA       ILE  75  13.347   0.198  -7.596
  583    HB   ILE  75           HB       ILE  75  10.532   0.355  -8.620
  584   1HG1  ILE  75          2HG1      ILE  75  10.420   0.981  -6.223
  585   2HG1  ILE  75          1HG1      ILE  75   9.732  -0.615  -6.498
  586   1HG2  ILE  75          1HG2      ILE  75  12.245  -1.899  -7.560
  587   2HG2  ILE  75          2HG2      ILE  75  12.085  -1.469  -9.263
  588   3HG2  ILE  75          3HG2      ILE  75  10.684  -2.057  -8.367
  589   1HD1  ILE  75          1HD1      ILE  75  11.115  -0.988  -4.649
  590   2HD1  ILE  75          2HD1      ILE  75  12.357   0.118  -5.237
  591   3HD1  ILE  75          3HD1      ILE  75  12.154  -1.463  -5.994
  592    HA   PRO  76           HA       PRO  76  13.925   2.627 -11.370
  593   1HB   PRO  76          2HB       PRO  76  16.316   1.433 -12.012
  594   2HB   PRO  76          1HB       PRO  76  16.175   2.787 -10.878
  595   1HG   PRO  76          2HG       PRO  76  16.655  -0.102 -10.301
  596   2HG   PRO  76          1HG       PRO  76  17.127   1.323  -9.360
  597   1HD   PRO  76          2HD       PRO  76  14.940  -0.377  -8.794
  598   2HD   PRO  76          1HD       PRO  76  15.219   1.230  -8.094
  599    H    GLY  77           H        GLY  77  12.022   1.181 -12.043
  600   1HA   GLY  77          2HA       GLY  77  12.516  -0.178 -14.440
  601   2HA   GLY  77          1HA       GLY  77  12.538  -1.417 -13.187
  602    H    THR  78           H        THR  78  10.507   0.288 -11.620
  603    HA   THR  78           HA       THR  78   8.165  -1.035 -12.043
  604    HB   THR  78           HB       THR  78   8.534   0.857 -10.391
  605    HG1  THR  78           HG1      THR  78   6.447  -0.155 -11.041
  606   1HG2  THR  78          1HG2      THR  78   8.225   3.095 -11.055
  607   2HG2  THR  78          2HG2      THR  78   7.474   2.635 -12.581
  608   3HG2  THR  78          3HG2      THR  78   9.211   2.424 -12.354
  609    H    LYS  79           H        LYS  79   6.265  -0.731 -13.323
  610    HA   LYS  79           HA       LYS  79   6.835   0.511 -15.974
  611   1HB   LYS  79          2HB       LYS  79   5.785  -2.002 -15.268
  612   2HB   LYS  79          1HB       LYS  79   4.402  -1.072 -15.846
  613   1HG   LYS  79          2HG       LYS  79   6.988  -1.066 -17.389
  614   2HG   LYS  79          1HG       LYS  79   5.831  -2.382 -17.588
  615   1HD   LYS  79          2HD       LYS  79   4.610   0.294 -17.660
  616   2HD   LYS  79          1HD       LYS  79   5.747  -0.008 -18.974
  617   1HE   LYS  79          2HE       LYS  79   4.488  -1.747 -19.850
  618   2HE   LYS  79          1HE       LYS  79   3.760  -2.141 -18.293
  619   1HZ   LYS  79          1HZ       LYS  79   3.011  -0.076 -20.229
  620   2HZ   LYS  79          2HZ       LYS  79   2.764   0.249 -18.580
  621   3HZ   LYS  79          3HZ       LYS  79   2.025  -1.099 -19.302
  622    H    MET  80           H        MET  80   5.670   1.585 -13.234
  623    HA   MET  80           HA       MET  80   3.254   2.830 -14.473
  624   1HB   MET  80          2HB       MET  80   2.268   3.001 -12.300
  625   2HB   MET  80          1HB       MET  80   2.936   1.389 -12.428
  626   1HG   MET  80          2HG       MET  80   4.849   1.964 -11.124
  627   2HG   MET  80          1HG       MET  80   4.392   3.656 -11.121
  628   1HE   MET  80          1HE       MET  80   3.302   4.180  -8.063
  629   2HE   MET  80          2HE       MET  80   1.886   4.421  -9.081
  630   3HE   MET  80          3HE       MET  80   3.494   4.724  -9.734
  631    H    ILE  81           H        ILE  81   3.441   4.917 -14.955
  632    HA   ILE  81           HA       ILE  81   5.710   6.474 -13.851
  633    HB   ILE  81           HB       ILE  81   3.710   7.272 -15.987
  634   1HG1  ILE  81          2HG1      ILE  81   6.473   6.065 -16.331
  635   2HG1  ILE  81          1HG1      ILE  81   4.966   5.173 -16.547
  636   1HG2  ILE  81          1HG2      ILE  81   4.763   9.255 -15.574
  637   2HG2  ILE  81          2HG2      ILE  81   6.067   8.542 -16.524
  638   3HG2  ILE  81          3HG2      ILE  81   6.121   8.477 -14.762
  639   1HD1  ILE  81          1HD1      ILE  81   4.555   7.431 -18.087
  640   2HD1  ILE  81          2HD1      ILE  81   5.064   5.860 -18.704
  641   3HD1  ILE  81          3HD1      ILE  81   6.267   7.096 -18.342
  642    H    PHE  82           H        PHE  82   3.717   5.906 -11.999
  643    HA   PHE  82           HA       PHE  82   1.636   7.821 -11.770
  644   1HB   PHE  82          2HB       PHE  82   1.947   5.722 -10.411
  645   2HB   PHE  82          1HB       PHE  82   3.183   6.572  -9.487
  646    HD1  PHE  82           HD1      PHE  82   2.367   7.194  -7.405
  647    HD2  PHE  82           HD2      PHE  82  -0.177   7.551 -10.847
  648    HE1  PHE  82           HE1      PHE  82   0.596   8.194  -5.990
  649    HE2  PHE  82           HE2      PHE  82  -1.949   8.554  -9.431
  650    HZ   PHE  82           HZ       PHE  82  -1.558   8.868  -7.004
  651    H    VAL  83           H        VAL  83   1.546   9.826 -10.698
  652    HA   VAL  83           HA       VAL  83   4.155  11.227 -10.520
  653    HB   VAL  83           HB       VAL  83   2.493  12.400 -11.804
  654   1HG1  VAL  83          1HG1      VAL  83   0.459  11.374 -11.120
  655   2HG1  VAL  83          2HG1      VAL  83   0.313  13.057 -10.611
  656   3HG1  VAL  83          3HG1      VAL  83   0.716  11.810  -9.431
  657   1HG2  VAL  83          1HG2      VAL  83   2.428  13.691  -9.065
  658   2HG2  VAL  83          2HG2      VAL  83   2.399  14.490 -10.638
  659   3HG2  VAL  83          3HG2      VAL  83   3.871  13.694 -10.079
  660    H    GLY  84           H        GLY  84   1.592  10.010  -8.499
  661   1HA   GLY  84          2HA       GLY  84   2.284   9.591  -6.121
  662   2HA   GLY  84          1HA       GLY  84   2.975  11.214  -6.133
  663    H    ILE  85           H        ILE  85   1.413  11.272  -4.172
  664    HA   ILE  85           HA       ILE  85  -1.371  11.877  -5.062
  665    HB   ILE  85           HB       ILE  85  -0.200  11.240  -2.341
  666   1HG1  ILE  85          2HG1      ILE  85  -2.393   9.612  -2.905
  667   2HG1  ILE  85          1HG1      ILE  85  -1.559   9.746  -4.453
  668   1HG2  ILE  85          1HG2      ILE  85  -3.041  12.016  -3.071
  669   2HG2  ILE  85          2HG2      ILE  85  -1.914  13.013  -2.151
  670   3HG2  ILE  85          3HG2      ILE  85  -2.495  11.489  -1.479
  671   1HD1  ILE  85          1HD1      ILE  85  -0.178   8.132  -3.671
  672   2HD1  ILE  85          2HD1      ILE  85  -0.734   8.348  -2.012
  673   3HD1  ILE  85          3HD1      ILE  85   0.525   9.398  -2.664
  674    H    LYS  86           H        LYS  86  -2.088  13.970  -4.987
  675    HA   LYS  86           HA       LYS  86  -0.177  16.067  -4.247
  676   1HB   LYS  86          2HB       LYS  86  -3.043  16.204  -5.234
  677   2HB   LYS  86          1HB       LYS  86  -1.999  17.606  -4.995
  678   1HG   LYS  86          2HG       LYS  86  -1.482  15.293  -6.889
  679   2HG   LYS  86          1HG       LYS  86  -1.946  16.932  -7.348
  680   1HD   LYS  86          2HD       LYS  86   0.245  17.383  -5.743
  681   2HD   LYS  86          1HD       LYS  86   0.688  15.885  -6.563
  682   1HE   LYS  86          2HE       LYS  86  -0.541  17.882  -8.338
  683   2HE   LYS  86          1HE       LYS  86   0.986  18.407  -7.631
  684   1HZ   LYS  86          1HZ       LYS  86   1.664  17.269  -9.496
  685   2HZ   LYS  86          2HZ       LYS  86   0.442  16.094  -9.370
  686   3HZ   LYS  86          3HZ       LYS  86   1.770  16.060  -8.310
  687    H    LYS  87           H        LYS  87  -3.294  14.844  -3.051
  688    HA   LYS  87           HA       LYS  87  -3.157  16.706  -0.753
  689   1HB   LYS  87          2HB       LYS  87  -5.271  15.640  -2.197
  690   2HB   LYS  87          1HB       LYS  87  -5.283  14.693  -0.710
  691   1HG   LYS  87          2HG       LYS  87  -6.410  16.440   0.189
  692   2HG   LYS  87          1HG       LYS  87  -4.846  17.253   0.224
  693   1HD   LYS  87          2HD       LYS  87  -5.266  18.212  -1.995
  694   2HD   LYS  87          1HD       LYS  87  -6.810  17.364  -2.084
  695   1HE   LYS  87          2HE       LYS  87  -7.827  18.762  -0.561
  696   2HE   LYS  87          1HE       LYS  87  -6.325  19.083   0.306
  697   1HZ   LYS  87          1HZ       LYS  87  -5.627  20.584  -1.328
  698   2HZ   LYS  87          2HZ       LYS  87  -7.265  20.957  -1.080
  699   3HZ   LYS  87          3HZ       LYS  87  -6.792  20.064  -2.445
  700    H    LYS  88           H        LYS  88  -2.204  16.075   1.116
  701    HA   LYS  88           HA       LYS  88  -0.976  13.556   1.494
  702   1HB   LYS  88          2HB       LYS  88  -1.972  15.384   3.697
  703   2HB   LYS  88          1HB       LYS  88  -0.639  14.232   3.790
  704   1HG   LYS  88          2HG       LYS  88  -0.767  16.779   2.160
  705   2HG   LYS  88          1HG       LYS  88   0.362  16.384   3.457
  706   1HD   LYS  88          2HD       LYS  88   1.270  14.531   2.066
  707   2HD   LYS  88          1HD       LYS  88   0.189  15.013   0.758
  708   1HE   LYS  88          2HE       LYS  88   1.381  16.932   0.289
  709   2HE   LYS  88          1HE       LYS  88   1.939  17.119   1.952
  710   1HZ   LYS  88          1HZ       LYS  88   3.510  15.392   1.663
  711   2HZ   LYS  88          2HZ       LYS  88   3.675  16.420   0.320
  712   3HZ   LYS  88          3HZ       LYS  88   2.857  14.940   0.164
  713    H    GLU  89           H        GLU  89  -4.008  14.747   2.999
  714    HA   GLU  89           HA       GLU  89  -4.768  12.435   4.355
  715   1HB   GLU  89          2HB       GLU  89  -7.182  13.177   3.627
  716   2HB   GLU  89          1HB       GLU  89  -6.228  14.229   4.672
  717   1HG   GLU  89          2HG       GLU  89  -5.890  15.791   3.024
  718   2HG   GLU  89          1HG       GLU  89  -5.852  14.580   1.741
  719    H    GLU  90           H        GLU  90  -4.678  12.971   0.911
  720    HA   GLU  90           HA       GLU  90  -6.411  10.748   0.216
  721   1HB   GLU  90          2HB       GLU  90  -5.116  12.847  -1.163
  722   2HB   GLU  90          1HB       GLU  90  -4.475  11.349  -1.840
  723   1HG   GLU  90          2HG       GLU  90  -7.093  10.694  -1.697
  724   2HG   GLU  90          1HG       GLU  90  -7.238  12.437  -1.929
  725    H    ARG  91           H        ARG  91  -2.866  11.189   0.332
  726    HA   ARG  91           HA       ARG  91  -2.163   8.570  -0.518
  727   1HB   ARG  91          2HB       ARG  91  -0.588  10.532  -0.178
  728   2HB   ARG  91          1HB       ARG  91  -0.677  10.209   1.554
  729   1HG   ARG  91          2HG       ARG  91  -0.054   7.762   0.870
  730   2HG   ARG  91          1HG       ARG  91   0.518   8.511  -0.622
  731   1HD   ARG  91          2HD       ARG  91   2.443   8.653   0.655
  732   2HD   ARG  91          1HD       ARG  91   1.685  10.188   1.079
  733    HE   ARG  91           HE       ARG  91   1.666   9.355   3.273
  734   1HH1  ARG  91          1HH1      ARG  91   2.150   6.728   1.192
  735   2HH1  ARG  91          2HH1      ARG  91   1.527   5.538   2.285
  736   1HH2  ARG  91          1HH2      ARG  91   0.436   7.864   4.613
  737   2HH2  ARG  91          2HH2      ARG  91   0.554   6.182   4.220
  738    H    ALA  92           H        ALA  92  -2.553   9.845   2.797
  739    HA   ALA  92           HA       ALA  92  -2.189   7.381   4.156
  740   1HB   ALA  92          1HB       ALA  92  -2.225   9.441   5.416
  741   2HB   ALA  92          2HB       ALA  92  -3.594   8.473   5.962
  742   3HB   ALA  92          3HB       ALA  92  -3.853   9.818   4.851
  743    H    ASP  93           H        ASP  93  -5.035   8.825   2.643
  744    HA   ASP  93           HA       ASP  93  -6.955   6.945   3.602
  745   1HB   ASP  93          2HB       ASP  93  -6.865   9.107   1.693
  746   2HB   ASP  93          1HB       ASP  93  -7.725   7.732   1.000
  747    H    LEU  94           H        LEU  94  -4.637   6.833   0.954
  748    HA   LEU  94           HA       LEU  94  -5.771   4.607  -0.450
  749   1HB   LEU  94          2HB       LEU  94  -2.925   5.621  -0.222
  750   2HB   LEU  94          1HB       LEU  94  -3.393   4.296  -1.287
  751    HG   LEU  94           HG       LEU  94  -4.330   7.171  -1.393
  752   1HD1  LEU  94          1HD1      LEU  94  -2.317   6.924  -2.606
  753   2HD1  LEU  94          2HD1      LEU  94  -3.570   6.750  -3.833
  754   3HD1  LEU  94          3HD1      LEU  94  -2.764   5.320  -3.188
  755   1HD2  LEU  94          1HD2      LEU  94  -5.600   6.122  -3.473
  756   2HD2  LEU  94          2HD2      LEU  94  -6.336   6.097  -1.871
  757   3HD2  LEU  94          3HD2      LEU  94  -5.536   4.656  -2.495
  758    H    ILE  95           H        ILE  95  -3.063   4.695   1.900
  759    HA   ILE  95           HA       ILE  95  -2.854   1.843   2.124
  760    HB   ILE  95           HB       ILE  95  -2.226   3.746   4.383
  761   1HG1  ILE  95          2HG1      ILE  95  -1.288   4.894   2.521
  762   2HG1  ILE  95          1HG1      ILE  95   0.046   3.959   3.199
  763   1HG2  ILE  95          1HG2      ILE  95  -1.942   1.081   4.238
  764   2HG2  ILE  95          2HG2      ILE  95  -0.780   2.099   5.089
  765   3HG2  ILE  95          3HG2      ILE  95  -0.435   1.551   3.449
  766   1HD1  ILE  95          1HD1      ILE  95  -1.668   3.165   0.830
  767   2HD1  ILE  95          2HD1      ILE  95  -0.397   2.167   1.537
  768   3HD1  ILE  95          3HD1      ILE  95   0.011   3.701   0.768
  769    H    ALA  96           H        ALA  96  -4.879   4.211   3.691
  770    HA   ALA  96           HA       ALA  96  -5.794   2.674   5.893
  771   1HB   ALA  96          1HB       ALA  96  -7.332   4.360   6.219
  772   2HB   ALA  96          2HB       ALA  96  -7.703   4.497   4.500
  773   3HB   ALA  96          3HB       ALA  96  -6.217   5.197   5.139
  774    H    TYR  97           H        TYR  97  -7.190   2.980   2.607
  775    HA   TYR  97           HA       TYR  97  -9.384   1.225   3.102
  776   1HB   TYR  97          2HB       TYR  97  -9.485   2.654   1.179
  777   2HB   TYR  97          1HB       TYR  97  -7.970   2.009   0.546
  778    HD1  TYR  97           HD1      TYR  97  -8.163   0.486  -1.194
  779    HD2  TYR  97           HD2      TYR  97 -11.257   0.661   1.780
  780    HE1  TYR  97           HE1      TYR  97  -9.406  -1.300  -2.382
  781    HE2  TYR  97           HE2      TYR  97 -12.503  -1.124   0.590
  782    HH   TYR  97           HH       TYR  97 -11.349  -3.167  -1.377
  783    H    LEU  98           H        LEU  98  -6.207   0.594   1.574
  784    HA   LEU  98           HA       LEU  98  -6.699  -2.210   1.215
  785   1HB   LEU  98          2HB       LEU  98  -4.305  -0.429   1.140
  786   2HB   LEU  98          1HB       LEU  98  -4.024  -2.162   1.315
  787    HG   LEU  98           HG       LEU  98  -4.042  -1.612  -1.053
  788   1HD1  LEU  98          1HD1      LEU  98  -5.488  -3.300  -1.744
  789   2HD1  LEU  98          2HD1      LEU  98  -6.764  -2.801  -0.631
  790   3HD1  LEU  98          3HD1      LEU  98  -5.350  -3.662  -0.023
  791   1HD2  LEU  98          1HD2      LEU  98  -6.328  -0.765  -1.969
  792   2HD2  LEU  98          2HD2      LEU  98  -5.248   0.408  -1.212
  793   3HD2  LEU  98          3HD2      LEU  98  -6.621  -0.235  -0.312
  794    H    LYS  99           H        LYS  99  -5.976  -0.357   4.012
  795    HA   LYS  99           HA       LYS  99  -4.681  -2.494   5.483
  796   1HB   LYS  99          2HB       LYS  99  -4.798   0.186   5.856
  797   2HB   LYS  99          1HB       LYS  99  -6.053  -0.332   6.980
  798   1HG   LYS  99          2HG       LYS  99  -3.667  -2.013   7.133
  799   2HG   LYS  99          1HG       LYS  99  -3.318  -0.322   7.489
  800   1HD   LYS  99          2HD       LYS  99  -5.547  -0.544   8.937
  801   2HD   LYS  99          1HD       LYS  99  -5.078  -2.244   8.953
  802   1HE   LYS  99          2HE       LYS  99  -3.438  -1.843  10.444
  803   2HE   LYS  99          1HE       LYS  99  -2.776  -0.554   9.439
  804   1HZ   LYS  99          1HZ       LYS  99  -3.456   0.761  11.097
  805   2HZ   LYS  99          2HZ       LYS  99  -4.531  -0.395  11.726
  806   3HZ   LYS  99          3HZ       LYS  99  -5.000   0.585  10.419
  807    H    LYS 100           H        LYS 100  -7.925  -1.003   5.607
  808    HA   LYS 100           HA       LYS 100  -8.945  -2.999   7.455
  809   1HB   LYS 100          2HB       LYS 100  -9.773  -0.518   6.756
  810   2HB   LYS 100          1HB       LYS 100 -10.839  -1.487   5.739
  811   1HG   LYS 100          2HG       LYS 100 -11.871  -2.511   7.558
  812   2HG   LYS 100          1HG       LYS 100 -10.495  -2.234   8.625
  813   1HD   LYS 100          2HD       LYS 100 -11.716  -0.499   9.432
  814   2HD   LYS 100          1HD       LYS 100 -11.228   0.334   7.956
  815   1HE   LYS 100          2HE       LYS 100 -13.437   0.509   7.500
  816   2HE   LYS 100          1HE       LYS 100 -13.375  -1.214   7.125
  817   1HZ   LYS 100          1HZ       LYS 100 -14.699   0.077   9.248
  818   2HZ   LYS 100          2HZ       LYS 100 -13.530  -0.976   9.890
  819   3HZ   LYS 100          3HZ       LYS 100 -14.720  -1.566   8.830
  820    H    ALA 101           H        ALA 101  -8.607  -2.782   4.012
  821    HA   ALA 101           HA       ALA 101 -10.649  -4.758   3.414
  822   1HB   ALA 101          1HB       ALA 101 -10.387  -3.649   1.461
  823   2HB   ALA 101          2HB       ALA 101  -8.982  -4.685   1.214
  824   3HB   ALA 101          3HB       ALA 101  -8.780  -3.076   1.908
  825    H    THR 102           H        THR 102  -7.059  -4.814   3.192
  826    HA   THR 102           HA       THR 102  -7.254  -7.788   3.399
  827    HB   THR 102           HB       THR 102  -6.156  -6.630   1.354
  828    HG1  THR 102           HG1      THR 102  -4.429  -8.417   2.652
  829   1HG2  THR 102          1HG2      THR 102  -3.630  -6.604   2.898
  830   2HG2  THR 102          2HG2      THR 102  -4.736  -5.271   3.223
  831   3HG2  THR 102          3HG2      THR 102  -4.159  -5.555   1.583
  832    H    ASN 103           H        ASN 103  -5.698  -4.934   4.780
  833    HA   ASN 103           HA       ASN 103  -4.002  -6.528   6.532
  834   1HB   ASN 103          2HB       ASN 103  -3.573  -4.120   5.627
  835   2HB   ASN 103          1HB       ASN 103  -4.605  -3.617   6.965
  836   1HD2  ASN 103          1HD2      ASN 103  -3.721  -3.680   9.087
  837   2HD2  ASN 103          2HD2      ASN 103  -2.138  -4.193   9.424
  838    H    GLU 104           HN       GLU 104  -7.204  -6.260   6.544
  839    HA   GLU 104           HA       GLU 104  -7.385  -6.760   9.422
  840   1HB   GLU 104          2HB       GLU 104  -7.649  -4.124   8.653
  841   2HB   GLU 104          1HB       GLU 104  -9.322  -4.683   8.657
  842   1HG   GLU 104          2HG       GLU 104  -8.433  -5.800  10.971
  843   2HG   GLU 104          1HG       GLU 104  -7.441  -4.343  10.920
  844    HHA  HEC 105           HHA      HEC 105   4.269  -2.438  -8.935
  845    HHB  HEC 105           HHB      HEC 105   1.162   1.344  -4.963
  846    HHC  HEC 105           HHC      HEC 105  -1.699   4.160  -9.853
  847    HHD  HEC 105           HHD      HEC 105   1.078   0.080 -13.804
  848   1HMA  HEC 105          1HMA      HEC 105   2.037  -0.270  -3.832
  849   2HMA  HEC 105          2HMA      HEC 105   3.762   0.072  -3.954
  850   3HMA  HEC 105          3HMA      HEC 105   3.193  -1.598  -3.919
  851   1HAA  HEC 105          1HAA      HEC 105   4.859  -2.300  -5.267
  852   2HAA  HEC 105          2HAA      HEC 105   5.340  -2.407  -6.948
  853   1HBA  HEC 105          1HBA      HEC 105   2.883  -3.791  -6.741
  854   2HBA  HEC 105          2HBA      HEC 105   3.858  -4.303  -5.364
  855   1HMB  HEC 105          1HMB      HEC 105  -1.648   2.855  -4.497
  856   2HMB  HEC 105          2HMB      HEC 105  -0.760   4.374  -4.614
  857   3HMB  HEC 105          3HMB      HEC 105   0.092   2.883  -4.211
  858    HAB  HEC 105           HAB      HEC 105  -2.189   5.241  -8.172
  859   1HBB  HEC 105          1HBB      HEC 105  -1.927   5.675  -5.260
  860   2HBB  HEC 105          2HBB      HEC 105  -2.123   6.832  -6.575
  861   3HBB  HEC 105          3HBB      HEC 105  -0.567   6.043  -6.321
  862   1HMC  HEC 105          1HMC      HEC 105  -2.784   3.666 -13.253
  863   2HMC  HEC 105          2HMC      HEC 105  -2.531   4.432 -11.684
  864   3HMC  HEC 105          3HMC      HEC 105  -1.515   4.875 -13.055
  865    HAC  HEC 105           HAC      HEC 105   0.187   1.615 -14.983
  866   1HBC  HEC 105          1HBC      HEC 105  -0.892   3.233 -16.259
  867   2HBC  HEC 105          2HBC      HEC 105  -0.222   4.066 -14.857
  868   3HBC  HEC 105          3HBC      HEC 105  -1.946   3.702 -14.926
  869   1HMD  HEC 105          1HMD      HEC 105   3.008  -1.019 -14.567
  870   2HMD  HEC 105          2HMD      HEC 105   3.816  -2.519 -14.116
  871   3HMD  HEC 105          3HMD      HEC 105   2.060  -2.478 -14.277
  872   1HAD  HEC 105          1HAD      HEC 105   4.274  -3.781 -12.499
  873   2HAD  HEC 105          2HAD      HEC 105   5.463  -2.823 -11.638
  874   1HBD  HEC 105          1HBD      HEC 105   3.522  -3.869  -9.795
  875   2HBD  HEC 105          2HBD      HEC 105   5.267  -4.106  -9.818
  Start of MODEL    6
    1   1H    GLY   1          1HT       GLY   1 -11.414   7.254  11.395
    2   2H    GLY   1          2HT       GLY   1 -10.245   6.041  11.172
    3   3H    GLY   1          3HT       GLY   1 -11.888   5.699  10.911
    4   1HA   GLY   1          1HA       GLY   1 -10.762   7.877   9.342
    5   2HA   GLY   1          2HA       GLY   1 -10.213   6.249   8.942
    6    H    ASP   2           H        ASP   2 -11.426   6.648   6.888
    7    HA   ASP   2           HA       ASP   2 -14.268   5.821   7.229
    8   1HB   ASP   2          2HB       ASP   2 -13.235   8.282   5.911
    9   2HB   ASP   2          1HB       ASP   2 -14.514   7.414   5.062
   10    H    VAL   3           H        VAL   3 -14.992   4.428   5.586
   11    HA   VAL   3           HA       VAL   3 -12.845   3.317   3.872
   12    HB   VAL   3           HB       VAL   3 -14.270   1.793   5.246
   13   1HG1  VAL   3          1HG1      VAL   3 -16.422   2.984   3.485
   14   2HG1  VAL   3          2HG1      VAL   3 -16.378   2.912   5.247
   15   3HG1  VAL   3          3HG1      VAL   3 -16.627   1.439   4.310
   16   1HG2  VAL   3          1HG2      VAL   3 -13.394   1.461   2.666
   17   2HG2  VAL   3          2HG2      VAL   3 -15.110   1.082   2.507
   18   3HG2  VAL   3          3HG2      VAL   3 -14.109   0.180   3.645
   19    H    GLU   4           H        GLU   4 -15.631   5.342   3.667
   20    HA   GLU   4           HA       GLU   4 -16.114   4.865   0.821
   21   1HB   GLU   4          2HB       GLU   4 -17.718   5.812   2.734
   22   2HB   GLU   4          1HB       GLU   4 -17.061   7.352   2.182
   23   1HG   GLU   4          2HG       GLU   4 -17.950   5.436   0.082
   24   2HG   GLU   4          1HG       GLU   4 -19.210   6.227   1.029
   25    H    LYS   5           H        LYS   5 -13.804   6.587   2.595
   26    HA   LYS   5           HA       LYS   5 -13.424   8.626   0.472
   27   1HB   LYS   5          2HB       LYS   5 -11.966   8.228   3.103
   28   2HB   LYS   5          1HB       LYS   5 -11.748   9.589   2.001
   29   1HG   LYS   5          2HG       LYS   5 -14.491   9.524   2.356
   30   2HG   LYS   5          1HG       LYS   5 -13.878   9.098   3.955
   31   1HD   LYS   5          2HD       LYS   5 -13.623  11.331   4.249
   32   2HD   LYS   5          1HD       LYS   5 -12.202  11.155   3.220
   33   1HE   LYS   5          2HE       LYS   5 -13.168  12.337   1.565
   34   2HE   LYS   5          1HE       LYS   5 -14.612  11.325   1.616
   35   1HZ   LYS   5          1HZ       LYS   5 -14.983  12.716   3.817
   36   2HZ   LYS   5          2HZ       LYS   5 -15.514  13.268   2.300
   37   3HZ   LYS   5          3HZ       LYS   5 -14.064  13.855   2.961
   38    H    GLY   6           H        GLY   6 -11.534   6.083   2.143
   39   1HA   GLY   6          1HA       GLY   6  -9.344   6.282   0.242
   40   2HA   GLY   6          2HA       GLY   6  -9.537   5.026   1.464
   41    H    LYS   7           H        LYS   7 -12.231   4.270   0.556
   42    HA   LYS   7           HA       LYS   7 -11.464   2.349  -1.455
   43   1HB   LYS   7          2HB       LYS   7 -13.230   1.822   0.149
   44   2HB   LYS   7          1HB       LYS   7 -14.204   3.169  -0.443
   45   1HG   LYS   7          2HG       LYS   7 -15.113   1.762  -1.949
   46   2HG   LYS   7          1HG       LYS   7 -13.535   1.667  -2.730
   47   1HD   LYS   7          2HD       LYS   7 -12.999  -0.343  -1.720
   48   2HD   LYS   7          1HD       LYS   7 -14.003  -0.020  -0.307
   49   1HE   LYS   7          2HE       LYS   7 -15.803  -1.020  -1.238
   50   2HE   LYS   7          1HE       LYS   7 -15.574  -0.167  -2.766
   51   1HZ   LYS   7          1HZ       LYS   7 -14.175  -1.792  -3.565
   52   2HZ   LYS   7          2HZ       LYS   7 -15.293  -2.717  -2.683
   53   3HZ   LYS   7          3HZ       LYS   7 -13.767  -2.370  -2.024
   54    H    LYS   8           H        LYS   8 -13.186   5.442  -1.546
   55    HA   LYS   8           HA       LYS   8 -13.890   5.194  -4.359
   56   1HB   LYS   8          2HB       LYS   8 -14.276   7.142  -2.204
   57   2HB   LYS   8          1HB       LYS   8 -13.942   7.901  -3.761
   58   1HG   LYS   8          2HG       LYS   8 -15.699   6.161  -4.663
   59   2HG   LYS   8          1HG       LYS   8 -16.226   6.116  -2.980
   60   1HD   LYS   8          2HD       LYS   8 -17.526   7.873  -3.714
   61   2HD   LYS   8          1HD       LYS   8 -16.077   8.772  -3.262
   62   1HE   LYS   8          2HE       LYS   8 -15.352   8.178  -5.750
   63   2HE   LYS   8          1HE       LYS   8 -17.097   8.065  -5.983
   64   1HZ   LYS   8          1HZ       LYS   8 -15.816  10.390  -4.672
   65   2HZ   LYS   8          2HZ       LYS   8 -17.393  10.274  -5.294
   66   3HZ   LYS   8          3HZ       LYS   8 -16.062  10.317  -6.349
   67    H    ILE   9           H        ILE   9 -11.218   6.540  -2.507
   68    HA   ILE   9           HA       ILE   9 -10.040   8.031  -4.671
   69    HB   ILE   9           HB       ILE   9  -8.807   6.829  -2.175
   70   1HG1  ILE   9          2HG1      ILE   9  -9.321   9.745  -2.720
   71   2HG1  ILE   9          1HG1      ILE   9 -10.626   8.717  -2.127
   72   1HG2  ILE   9          1HG2      ILE   9  -7.575   7.959  -4.514
   73   2HG2  ILE   9          2HG2      ILE   9  -6.803   7.379  -3.037
   74   3HG2  ILE   9          3HG2      ILE   9  -7.339   9.056  -3.154
   75   1HD1  ILE   9          1HD1      ILE   9  -9.760   9.328  -0.090
   76   2HD1  ILE   9          2HD1      ILE   9  -8.150   9.620  -0.748
   77   3HD1  ILE   9          3HD1      ILE   9  -8.682   7.971  -0.416
   78    H    PHE  10           H        PHE  10  -8.970   4.915  -3.228
   79    HA   PHE  10           HA       PHE  10  -7.144   4.245  -5.272
   80   1HB   PHE  10          2HB       PHE  10  -7.397   2.998  -3.113
   81   2HB   PHE  10          1HB       PHE  10  -8.885   2.287  -3.743
   82    HD1  PHE  10           HD1      PHE  10  -8.683   1.178  -6.136
   83    HD2  PHE  10           HD2      PHE  10  -5.377   1.891  -3.490
   84    HE1  PHE  10           HE1      PHE  10  -7.355  -0.537  -7.337
   85    HE2  PHE  10           HE2      PHE  10  -4.048   0.174  -4.689
   86    HZ   PHE  10           HZ       PHE  10  -5.037  -1.040  -6.612
   87    H    ILE  11           H        ILE  11 -10.646   3.700  -5.090
   88    HA   ILE  11           HA       ILE  11 -10.927   2.086  -7.403
   89    HB   ILE  11           HB       ILE  11 -12.722   4.048  -5.986
   90   1HG1  ILE  11          2HG1      ILE  11 -12.360   1.759  -5.086
   91   2HG1  ILE  11          1HG1      ILE  11 -14.034   2.013  -5.581
   92   1HG2  ILE  11          1HG2      ILE  11 -13.596   4.456  -8.096
   93   2HG2  ILE  11          2HG2      ILE  11 -14.495   3.002  -7.662
   94   3HG2  ILE  11          3HG2      ILE  11 -13.092   2.887  -8.723
   95   1HD1  ILE  11          1HD1      ILE  11 -13.738   0.057  -6.712
   96   2HD1  ILE  11          2HD1      ILE  11 -11.982   0.216  -6.729
   97   3HD1  ILE  11          3HD1      ILE  11 -12.958   1.091  -7.909
   98    H    MET  12           H        MET  12 -10.641   5.600  -7.028
   99    HA   MET  12           HA       MET  12 -10.618   5.855 -10.003
  100   1HB   MET  12          2HB       MET  12 -11.161   8.173  -9.703
  101   2HB   MET  12          1HB       MET  12 -12.227   7.263  -8.633
  102   1HG   MET  12          2HG       MET  12 -10.434   7.630  -6.820
  103   2HG   MET  12          1HG       MET  12  -9.761   8.848  -7.905
  104   1HE   MET  12          1HE       MET  12  -9.814  10.688  -7.076
  105   2HE   MET  12          2HE       MET  12 -11.071  11.614  -6.258
  106   3HE   MET  12          3HE       MET  12 -11.051  11.533  -8.018
  107    H    LYS  13           H        LYS  13  -8.403   5.228  -7.775
  108    HA   LYS  13           HA       LYS  13  -6.439   7.240  -8.795
  109   1HB   LYS  13          2HB       LYS  13  -6.918   6.792  -6.220
  110   2HB   LYS  13          1HB       LYS  13  -5.820   5.436  -6.483
  111   1HG   LYS  13          2HG       LYS  13  -4.584   7.441  -5.749
  112   2HG   LYS  13          1HG       LYS  13  -4.124   6.978  -7.388
  113   1HD   LYS  13          2HD       LYS  13  -4.745   8.999  -8.146
  114   2HD   LYS  13          1HD       LYS  13  -6.384   8.721  -7.556
  115   1HE   LYS  13          2HE       LYS  13  -5.122   9.288  -5.219
  116   2HE   LYS  13          1HE       LYS  13  -4.177  10.274  -6.334
  117   1HZ   LYS  13          1HZ       LYS  13  -7.118  10.328  -5.950
  118   2HZ   LYS  13          2HZ       LYS  13  -6.309  11.159  -7.191
  119   3HZ   LYS  13          3HZ       LYS  13  -6.014  11.557  -5.566
  120    H    CYS  14           H        CYS  14  -6.460   3.814  -7.723
  121    HA   CYS  14           HA       CYS  14  -4.798   3.194 -10.125
  122   1HB   CYS  14          2HB       CYS  14  -4.104   1.394  -7.994
  123   2HB   CYS  14          1HB       CYS  14  -3.056   2.504  -8.861
  124    H    SER  15           H        SER  15  -7.600   2.856  -9.919
  125    HA   SER  15           HA       SER  15  -8.082   0.023  -9.261
  126   1HB   SER  15          2HB       SER  15  -9.757   1.904  -8.850
  127   2HB   SER  15          1HB       SER  15  -9.989   1.958 -10.595
  128    HG   SER  15           HG       SER  15 -10.402  -0.243  -8.846
  129    H    GLN  16           H        GLN  16  -6.737   1.592 -11.847
  130    HA   GLN  16           HA       GLN  16  -7.966  -0.211 -13.871
  131   1HB   GLN  16          2HB       GLN  16  -6.389   2.342 -14.009
  132   2HB   GLN  16          1HB       GLN  16  -6.388   1.252 -15.396
  133   1HG   GLN  16          2HG       GLN  16  -9.057   1.712 -14.237
  134   2HG   GLN  16          1HG       GLN  16  -8.309   3.157 -14.916
  135   1HE2  GLN  16          1HE2      GLN  16  -8.273   3.341 -17.195
  136   2HE2  GLN  16          2HE2      GLN  16  -8.762   2.108 -18.254
  137    H    CYS  17           H        CYS  17  -4.752   0.825 -12.694
  138    HA   CYS  17           HA       CYS  17  -3.499  -1.470 -14.058
  139   1HB   CYS  17          2HB       CYS  17  -2.448   0.848 -12.429
  140   2HB   CYS  17          1HB       CYS  17  -1.412  -0.511 -12.865
  141    H    HIS  18           H        HIS  18  -4.947  -0.817 -11.025
  142    HA   HIS  18           HA       HIS  18  -3.728  -3.327  -9.956
  143   1HB   HIS  18          2HB       HIS  18  -4.183  -0.742  -8.451
  144   2HB   HIS  18          1HB       HIS  18  -3.823  -2.280  -7.671
  145    HD1  HIS  18           HD1      HIS  18  -1.409  -3.151  -7.811
  146    HD2  HIS  18           HD2      HIS  18  -2.023   0.366  -9.943
  147    HE1  HIS  18           HE1      HIS  18   0.887  -2.272  -8.419
  148    H    THR  19           H        THR  19  -5.784  -4.291 -10.720
  149    HA   THR  19           HA       THR  19  -8.272  -3.387  -9.469
  150    HB   THR  19           HB       THR  19  -9.278  -5.336 -10.556
  151    HG1  THR  19           HG1      THR  19  -6.577  -6.066 -10.799
  152   1HG2  THR  19          1HG2      THR  19  -7.302  -3.717 -12.145
  153   2HG2  THR  19          2HG2      THR  19  -9.062  -3.591 -12.110
  154   3HG2  THR  19          3HG2      THR  19  -8.290  -4.946 -12.936
  155    H    VAL  20           H        VAL  20  -7.789  -3.511  -7.218
  156    HA   VAL  20           HA       VAL  20  -6.818  -6.016  -6.063
  157    HB   VAL  20           HB       VAL  20  -6.795  -4.851  -3.988
  158   1HG1  VAL  20          1HG1      VAL  20  -5.595  -2.815  -4.509
  159   2HG1  VAL  20          2HG1      VAL  20  -6.347  -2.728  -6.102
  160   3HG1  VAL  20          3HG1      VAL  20  -5.197  -4.015  -5.740
  161   1HG2  VAL  20          1HG2      VAL  20  -7.949  -2.543  -3.878
  162   2HG2  VAL  20          2HG2      VAL  20  -8.994  -3.964  -3.822
  163   3HG2  VAL  20          3HG2      VAL  20  -8.824  -3.052  -5.323
  164    H    GLU  21           H        GLU  21  -9.373  -6.235  -7.490
  165    HA   GLU  21           HA       GLU  21 -10.847  -7.654  -5.440
  166   1HB   GLU  21          2HB       GLU  21 -12.951  -6.285  -5.697
  167   2HB   GLU  21          1HB       GLU  21 -11.652  -5.464  -4.832
  168   1HG   GLU  21          2HG       GLU  21 -11.619  -3.817  -6.361
  169   2HG   GLU  21          1HG       GLU  21 -11.366  -4.988  -7.658
  170    H    LYS  22           H        LYS  22  -9.731  -7.863  -8.282
  171    HA   LYS  22           HA       LYS  22 -12.220  -8.493  -9.773
  172   1HB   LYS  22          2HB       LYS  22 -10.299  -7.251 -10.866
  173   2HB   LYS  22          1HB       LYS  22  -9.361  -8.740 -10.742
  174   1HG   LYS  22          2HG       LYS  22 -11.151  -9.928 -12.014
  175   2HG   LYS  22          1HG       LYS  22 -11.985  -8.388 -12.219
  176   1HD   LYS  22          2HD       LYS  22  -9.291  -7.957 -12.989
  177   2HD   LYS  22          1HD       LYS  22  -9.804  -9.460 -13.756
  178   1HE   LYS  22          2HE       LYS  22 -11.573  -8.423 -14.902
  179   2HE   LYS  22          1HE       LYS  22 -11.590  -7.039 -13.810
  180   1HZ   LYS  22          1HZ       LYS  22 -10.551  -6.732 -16.099
  181   2HZ   LYS  22          2HZ       LYS  22  -9.242  -7.635 -15.500
  182   3HZ   LYS  22          3HZ       LYS  22  -9.674  -6.167 -14.762
  183    H    GLY  23           H        GLY  23  -9.835 -10.059  -7.862
  184   1HA   GLY  23          2HA       GLY  23 -10.634 -12.431  -7.281
  185   2HA   GLY  23          1HA       GLY  23 -10.603 -12.703  -9.024
  186    H    GLY  24           H        GLY  24  -8.149 -10.938  -9.226
  187   1HA   GLY  24          1HA       GLY  24  -5.880 -11.344  -7.991
  188   2HA   GLY  24          2HA       GLY  24  -6.205 -13.033  -8.378
  189    H    LYS  25           H        LYS  25  -7.532 -11.508 -10.906
  190    HA   LYS  25           HA       LYS  25  -5.406 -12.194 -12.719
  191   1HB   LYS  25          2HB       LYS  25  -7.931 -12.026 -13.207
  192   2HB   LYS  25          1HB       LYS  25  -7.664 -10.289 -13.351
  193   1HG   LYS  25          2HG       LYS  25  -5.834 -10.816 -15.026
  194   2HG   LYS  25          1HG       LYS  25  -6.401 -12.487 -15.005
  195   1HD   LYS  25          2HD       LYS  25  -8.489 -10.411 -15.386
  196   2HD   LYS  25          1HD       LYS  25  -7.362 -10.630 -16.725
  197   1HE   LYS  25          2HE       LYS  25  -9.036 -12.195 -17.219
  198   2HE   LYS  25          1HE       LYS  25  -7.835 -13.177 -16.381
  199   1HZ   LYS  25          1HZ       LYS  25  -9.093 -13.249 -14.473
  200   2HZ   LYS  25          2HZ       LYS  25 -10.299 -13.300 -15.668
  201   3HZ   LYS  25          3HZ       LYS  25  -9.969 -11.848 -14.851
  202    H    HIS  26           H        HIS  26  -3.862 -10.881 -13.702
  203    HA   HIS  26           HA       HIS  26  -3.676  -8.091 -12.635
  204   1HB   HIS  26          2HB       HIS  26  -1.245  -9.207 -13.864
  205   2HB   HIS  26          1HB       HIS  26  -1.437  -8.370 -12.327
  206    HD1  HIS  26           HD1      HIS  26  -2.240 -11.805 -13.798
  207    HD2  HIS  26           HD2      HIS  26  -1.167 -10.064 -10.165
  208    HE1  HIS  26           HE1      HIS  26  -1.963 -13.707 -12.147
  209    H    LYS  27           H        LYS  27  -4.261  -6.639 -14.170
  210    HA   LYS  27           HA       LYS  27  -4.073  -7.362 -17.006
  211   1HB   LYS  27          2HB       LYS  27  -6.121  -6.287 -16.378
  212   2HB   LYS  27          1HB       LYS  27  -5.255  -4.990 -15.553
  213   1HG   LYS  27          2HG       LYS  27  -4.707  -3.917 -17.511
  214   2HG   LYS  27          1HG       LYS  27  -4.624  -5.420 -18.432
  215   1HD   LYS  27          2HD       LYS  27  -6.934  -5.505 -18.762
  216   2HD   LYS  27          1HD       LYS  27  -7.270  -4.482 -17.364
  217   1HE   LYS  27          2HE       LYS  27  -6.791  -2.523 -18.507
  218   2HE   LYS  27          1HE       LYS  27  -5.694  -3.324 -19.632
  219   1HZ   LYS  27          1HZ       LYS  27  -8.652  -3.591 -19.591
  220   2HZ   LYS  27          2HZ       LYS  27  -7.608  -4.405 -20.654
  221   3HZ   LYS  27          3HZ       LYS  27  -7.747  -2.714 -20.726
  222    H    THR  28           H        THR  28  -3.435  -4.178 -15.564
  223    HA   THR  28           HA       THR  28  -0.977  -4.028 -17.232
  224    HB   THR  28           HB       THR  28  -2.678  -1.941 -15.853
  225    HG1  THR  28           HG1      THR  28  -3.239  -1.463 -17.848
  226   1HG2  THR  28          1HG2      THR  28  -1.011  -0.315 -16.919
  227   2HG2  THR  28          2HG2      THR  28   0.077  -1.695 -17.072
  228   3HG2  THR  28          3HG2      THR  28  -0.457  -1.164 -15.476
  229    H    GLY  29           H        GLY  29  -2.020  -3.195 -13.901
  230   1HA   GLY  29          1HA       GLY  29   0.825  -3.290 -13.079
  231   2HA   GLY  29          2HA       GLY  29  -0.501  -2.657 -12.104
  232    HA   PRO  30           HA       PRO  30   0.544  -7.075 -10.871
  233   1HB   PRO  30          2HB       PRO  30   1.612  -6.485  -8.430
  234   2HB   PRO  30          1HB       PRO  30   2.571  -6.619  -9.906
  235   1HG   PRO  30          2HG       PRO  30   1.709  -4.152  -8.447
  236   2HG   PRO  30          1HG       PRO  30   3.172  -4.439  -9.406
  237   1HD   PRO  30          2HD       PRO  30   0.926  -3.039 -10.315
  238   2HD   PRO  30          1HD       PRO  30   2.166  -3.762 -11.352
  239    H    ASN  31           H        ASN  31  -1.236  -8.072 -10.089
  240    HA   ASN  31           HA       ASN  31  -3.474  -6.840  -8.972
  241   1HB   ASN  31          2HB       ASN  31  -3.433  -9.181  -9.795
  242   2HB   ASN  31          1HB       ASN  31  -2.489  -9.648  -8.380
  243   1HD2  ASN  31          1HD2      ASN  31  -5.481  -7.684  -8.927
  244   2HD2  ASN  31          2HD2      ASN  31  -6.373  -8.445  -7.700
  245    H    LEU  32           H        LEU  32  -3.172  -5.418  -7.283
  246    HA   LEU  32           HA       LEU  32  -1.460  -6.051  -5.024
  247   1HB   LEU  32          2HB       LEU  32  -2.899  -3.741  -6.034
  248   2HB   LEU  32          1HB       LEU  32  -3.153  -3.931  -4.300
  249    HG   LEU  32           HG       LEU  32  -0.840  -3.790  -3.825
  250   1HD1  LEU  32          1HD1      LEU  32   0.706  -3.624  -6.015
  251   2HD1  LEU  32          2HD1      LEU  32  -0.575  -4.644  -6.669
  252   3HD1  LEU  32          3HD1      LEU  32   0.330  -5.169  -5.250
  253   1HD2  LEU  32          1HD2      LEU  32  -0.916  -1.573  -4.236
  254   2HD2  LEU  32          2HD2      LEU  32  -2.042  -1.824  -5.570
  255   3HD2  LEU  32          3HD2      LEU  32  -0.304  -1.896  -5.858
  256    H    HIS  33           H        HIS  33  -2.613  -8.131  -4.528
  257    HA   HIS  33           HA       HIS  33  -5.257  -7.771  -3.224
  258   1HB   HIS  33          2HB       HIS  33  -4.313  -9.771  -4.836
  259   2HB   HIS  33          1HB       HIS  33  -4.008 -10.449  -3.237
  260    HD1  HIS  33           HD1      HIS  33  -5.929 -12.129  -3.205
  261    HD2  HIS  33           HD2      HIS  33  -7.198  -8.240  -4.008
  262    HE1  HIS  33           HE1      HIS  33  -8.459 -12.161  -3.081
  263    H    GLY  34           H        GLY  34  -2.308  -9.647  -2.428
  264   1HA   GLY  34          2HA       GLY  34  -2.742  -8.865   0.426
  265   2HA   GLY  34          1HA       GLY  34  -1.949 -10.357  -0.083
  266    H    LEU  35           H        LEU  35  -1.310  -7.341  -1.725
  267    HA   LEU  35           HA       LEU  35   1.449  -7.456  -1.694
  268   1HB   LEU  35          2HB       LEU  35   0.365  -5.714  -2.947
  269   2HB   LEU  35          1HB       LEU  35  -0.341  -5.023  -1.485
  270    HG   LEU  35           HG       LEU  35   2.580  -5.276  -1.351
  271   1HD1  LEU  35          1HD1      LEU  35   2.208  -4.774  -3.797
  272   2HD1  LEU  35          2HD1      LEU  35   3.102  -3.523  -2.931
  273   3HD1  LEU  35          3HD1      LEU  35   1.395  -3.288  -3.307
  274   1HD2  LEU  35          1HD2      LEU  35   0.459  -3.205  -0.814
  275   2HD2  LEU  35          2HD2      LEU  35   2.166  -2.759  -0.791
  276   3HD2  LEU  35          3HD2      LEU  35   1.559  -3.981   0.326
  277    H    PHE  36           H        PHE  36  -0.658  -6.497   0.953
  278    HA   PHE  36           HA       PHE  36   1.490  -5.446   2.607
  279   1HB   PHE  36          2HB       PHE  36  -1.367  -6.270   3.150
  280   2HB   PHE  36          1HB       PHE  36  -0.286  -5.756   4.447
  281    HD1  PHE  36           HD1      PHE  36  -0.933  -4.617   0.924
  282    HD2  PHE  36           HD2      PHE  36  -0.627  -3.543   5.072
  283    HE1  PHE  36           HE1      PHE  36  -1.348  -2.244   0.340
  284    HE2  PHE  36           HE2      PHE  36  -1.043  -1.170   4.488
  285    HZ   PHE  36           HZ       PHE  36  -1.403  -0.519   2.122
  286    H    GLY  37           H        GLY  37   2.889  -6.611   3.838
  287   1HA   GLY  37          2HA       GLY  37   3.719  -8.412   5.125
  288   2HA   GLY  37          1HA       GLY  37   2.156  -9.211   4.945
  289    H    ARG  38           H        ARG  38   2.957  -8.337   1.893
  290    HA   ARG  38           HA       ARG  38   4.427 -10.898   1.395
  291   1HB   ARG  38          2HB       ARG  38   2.144 -11.085   0.572
  292   2HB   ARG  38          1HB       ARG  38   2.290  -9.548  -0.280
  293   1HG   ARG  38          2HG       ARG  38   4.474 -11.021  -1.188
  294   2HG   ARG  38          1HG       ARG  38   3.169 -12.205  -1.103
  295   1HD   ARG  38          2HD       ARG  38   3.154 -11.131  -3.299
  296   2HD   ARG  38          1HD       ARG  38   1.716 -10.653  -2.398
  297    HE   ARG  38           HE       ARG  38   3.236  -8.574  -1.789
  298   1HH1  ARG  38          1HH2      ARG  38   4.795 -10.068  -4.215
  299   2HH1  ARG  38          2HH2      ARG  38   4.536  -8.864  -5.433
  300   1HH2  ARG  38          1HH1      ARG  38   2.176  -7.122  -3.581
  301   2HH2  ARG  38          2HH1      ARG  38   3.053  -7.195  -5.072
  302    H    LYS  39           H        LYS  39   6.404 -10.566   0.502
  303    HA   LYS  39           HA       LYS  39   7.398  -7.990  -0.194
  304   1HB   LYS  39          2HB       LYS  39   9.314  -9.201  -1.165
  305   2HB   LYS  39          1HB       LYS  39   8.857  -9.906   0.386
  306   1HG   LYS  39          2HG       LYS  39   8.160 -11.861  -0.558
  307   2HG   LYS  39          1HG       LYS  39   7.475 -11.049  -1.965
  308   1HD   LYS  39          2HD       LYS  39   9.270 -12.042  -3.000
  309   2HD   LYS  39          1HD       LYS  39  10.074 -10.572  -2.446
  310   1HE   LYS  39          2HE       LYS  39   9.957 -12.819  -0.504
  311   2HE   LYS  39          1HE       LYS  39  11.014 -13.045  -1.898
  312   1HZ   LYS  39          1HZ       LYS  39  12.315 -11.262  -1.319
  313   2HZ   LYS  39          2HZ       LYS  39  11.911 -11.881   0.211
  314   3HZ   LYS  39          3HZ       LYS  39  11.100 -10.518  -0.398
  315    H    THR  40           H        THR  40   8.475  -7.842  -2.599
  316    HA   THR  40           HA       THR  40   6.170  -7.657  -4.393
  317    HB   THR  40           HB       THR  40   7.539  -6.349  -5.759
  318    HG1  THR  40           HG1      THR  40   9.670  -7.870  -4.684
  319   1HG2  THR  40          1HG2      THR  40   8.164  -4.764  -4.273
  320   2HG2  THR  40          2HG2      THR  40   9.355  -5.827  -3.523
  321   3HG2  THR  40          3HG2      THR  40   7.666  -5.906  -3.025
  322    H    GLY  41           H        GLY  41   6.747  -8.384  -6.810
  323   1HA   GLY  41          2HA       GLY  41   6.887 -10.249  -8.229
  324   2HA   GLY  41          1HA       GLY  41   8.377 -10.604  -7.358
  325    H    GLN  42           H        GLN  42   5.130 -11.617  -7.881
  326    HA   GLN  42           HA       GLN  42   5.588 -13.931  -6.128
  327   1HB   GLN  42          2HB       GLN  42   4.170 -11.724  -5.121
  328   2HB   GLN  42          1HB       GLN  42   2.936 -12.903  -5.564
  329   1HG   GLN  42          2HG       GLN  42   3.802 -13.177  -3.217
  330   2HG   GLN  42          1HG       GLN  42   3.997 -14.614  -4.220
  331   1HE2  GLN  42          1HE2      GLN  42   5.820 -11.694  -3.151
  332   2HE2  GLN  42          2HE2      GLN  42   7.340 -12.446  -3.197
  333    H    ALA  43           H        ALA  43   2.812 -12.327  -7.746
  334    HA   ALA  43           HA       ALA  43   1.604 -14.753  -8.603
  335   1HB   ALA  43          1HB       ALA  43   0.057 -13.411  -9.629
  336   2HB   ALA  43          2HB       ALA  43   1.285 -12.366 -10.343
  337   3HB   ALA  43          3HB       ALA  43   0.835 -12.168  -8.649
  338    HA   PRO  44           HA       PRO  44   4.289 -15.841 -11.956
  339   1HB   PRO  44          2HB       PRO  44   2.709 -17.849 -12.968
  340   2HB   PRO  44          1HB       PRO  44   3.702 -18.029 -11.512
  341   1HG   PRO  44          2HG       PRO  44   0.749 -17.727 -11.738
  342   2HG   PRO  44          1HG       PRO  44   1.706 -18.476 -10.449
  343   1HD   PRO  44          2HD       PRO  44   0.529 -15.889 -10.381
  344   2HD   PRO  44          1HD       PRO  44   1.707 -16.544  -9.223
  345    H    GLY  45           H        GLY  45   3.705 -16.540 -14.462
  346   1HA   GLY  45          2HA       GLY  45   3.145 -15.549 -16.527
  347   2HA   GLY  45          1HA       GLY  45   1.514 -15.554 -15.855
  348    H    TYR  46           H        TYR  46   4.026 -13.730 -14.276
  349    HA   TYR  46           HA       TYR  46   3.344 -11.212 -15.629
  350   1HB   TYR  46          2HB       TYR  46   1.491 -11.598 -13.952
  351   2HB   TYR  46          1HB       TYR  46   2.705 -11.553 -12.683
  352    HD1  TYR  46           HD1      TYR  46   4.247  -9.235 -14.527
  353    HD2  TYR  46           HD2      TYR  46   0.408  -9.716 -12.705
  354    HE1  TYR  46           HE1      TYR  46   4.026  -6.802 -14.414
  355    HE2  TYR  46           HE2      TYR  46   0.201  -7.255 -12.582
  356    HH   TYR  46           HH       TYR  46   2.223  -5.227 -12.540
  357    H    SER  47           H        SER  47   5.374 -10.445 -15.873
  358    HA   SER  47           HA       SER  47   7.482 -10.997 -13.917
  359   1HB   SER  47          2HB       SER  47   7.899  -8.845 -15.905
  360   2HB   SER  47          1HB       SER  47   8.904 -10.243 -15.542
  361    HG   SER  47           HG       SER  47   7.920 -10.358 -17.622
  362    H    TYR  48           H        TYR  48   6.215 -10.017 -12.110
  363    HA   TYR  48           HA       TYR  48   5.280  -7.412 -11.842
  364   1HB   TYR  48          2HB       TYR  48   6.495  -9.423 -10.045
  365   2HB   TYR  48          1HB       TYR  48   6.558  -7.774  -9.451
  366    HD1  TYR  48           HD1      TYR  48   3.901  -9.295 -11.578
  367    HD2  TYR  48           HD2      TYR  48   5.014  -7.839  -7.710
  368    HE1  TYR  48           HE1      TYR  48   1.552  -9.528 -10.811
  369    HE2  TYR  48           HE2      TYR  48   2.667  -8.057  -6.940
  370    HH   TYR  48           HH       TYR  48   0.654  -8.987  -7.444
  371    H    THR  49           H        THR  49   6.599  -5.724 -10.347
  372    HA   THR  49           HA       THR  49   8.678  -4.630 -11.947
  373    HB   THR  49           HB       THR  49   9.191  -3.655  -9.411
  374    HG1  THR  49           HG1      THR  49   7.384  -3.717  -8.270
  375   1HG2  THR  49          1HG2      THR  49   8.739  -1.870 -10.691
  376   2HG2  THR  49          2HG2      THR  49   7.026  -2.160 -10.392
  377   3HG2  THR  49          3HG2      THR  49   7.802  -2.847 -11.820
  378    H    ALA  50           H        ALA  50  10.155  -6.365 -12.361
  379    HA   ALA  50           HA       ALA  50  11.403  -8.079 -10.573
  380   1HB   ALA  50          1HB       ALA  50  12.904  -8.489 -12.256
  381   2HB   ALA  50          2HB       ALA  50  13.232  -6.776 -12.519
  382   3HB   ALA  50          3HB       ALA  50  11.779  -7.510 -13.198
  383    H    ALA  51           H        ALA  51  12.229  -4.682 -11.228
  384    HA   ALA  51           HA       ALA  51  14.562  -4.459  -9.688
  385   1HB   ALA  51          1HB       ALA  51  13.983  -2.505 -10.837
  386   2HB   ALA  51          2HB       ALA  51  13.584  -2.077  -9.174
  387   3HB   ALA  51          3HB       ALA  51  12.308  -2.562 -10.291
  388    H    ASN  52           H        ASN  52  11.310  -3.547  -8.454
  389    HA   ASN  52           HA       ASN  52  11.874  -3.379  -5.752
  390   1HB   ASN  52          2HB       ASN  52   9.514  -3.973  -7.355
  391   2HB   ASN  52          1HB       ASN  52   9.469  -4.814  -5.806
  392   1HD2  ASN  52          1HD2      ASN  52  10.877  -2.897  -4.209
  393   2HD2  ASN  52          2HD2      ASN  52   9.933  -1.490  -4.107
  394    H    LYS  53           H        LYS  53  11.285  -6.364  -7.599
  395    HA   LYS  53           HA       LYS  53  11.207  -8.296  -5.634
  396   1HB   LYS  53          2HB       LYS  53  11.493  -8.386  -8.316
  397   2HB   LYS  53          1HB       LYS  53  13.120  -8.868  -7.833
  398   1HG   LYS  53          2HG       LYS  53  11.317 -10.257  -6.137
  399   2HG   LYS  53          1HG       LYS  53  10.707 -10.427  -7.784
  400   1HD   LYS  53          2HD       LYS  53  12.825 -11.297  -8.553
  401   2HD   LYS  53          1HD       LYS  53  13.590 -10.941  -7.004
  402   1HE   LYS  53          2HE       LYS  53  12.238 -12.595  -5.878
  403   2HE   LYS  53          1HE       LYS  53  11.248 -12.838  -7.317
  404   1HZ   LYS  53          1HZ       LYS  53  13.576 -13.369  -8.364
  405   2HZ   LYS  53          2HZ       LYS  53  12.697 -14.559  -7.529
  406   3HZ   LYS  53          3HZ       LYS  53  13.975 -13.745  -6.759
  407    H    ASN  54           H        ASN  54  14.359  -7.626  -7.189
  408    HA   ASN  54           HA       ASN  54  15.845  -8.724  -5.022
  409   1HB   ASN  54          2HB       ASN  54  17.809  -7.644  -6.107
  410   2HB   ASN  54          1HB       ASN  54  16.808  -8.528  -7.259
  411   1HD2  ASN  54          1HD2      ASN  54  17.483  -5.226  -6.042
  412   2HD2  ASN  54          2HD2      ASN  54  16.931  -4.430  -7.435
  413    H    LYS  55           H        LYS  55  14.317  -5.670  -5.331
  414    HA   LYS  55           HA       LYS  55  16.065  -4.052  -3.778
  415   1HB   LYS  55          2HB       LYS  55  14.065  -3.220  -5.047
  416   2HB   LYS  55          1HB       LYS  55  13.036  -3.936  -3.807
  417   1HG   LYS  55          2HG       LYS  55  13.222  -1.837  -2.897
  418   2HG   LYS  55          1HG       LYS  55  14.692  -2.532  -2.217
  419   1HD   LYS  55          2HD       LYS  55  14.754  -1.226  -4.926
  420   2HD   LYS  55          1HD       LYS  55  14.850  -0.242  -3.464
  421   1HE   LYS  55          2HE       LYS  55  16.757  -2.385  -4.406
  422   2HE   LYS  55          1HE       LYS  55  17.109  -0.705  -4.004
  423   1HZ   LYS  55          1HZ       LYS  55  17.820  -1.842  -2.145
  424   2HZ   LYS  55          2HZ       LYS  55  16.544  -2.964  -2.198
  425   3HZ   LYS  55          3HZ       LYS  55  16.258  -1.369  -1.686
  426    H    GLY  56           H        GLY  56  14.253  -6.809  -2.885
  427   1HA   GLY  56          1HA       GLY  56  13.729  -7.735  -0.782
  428   2HA   GLY  56          2HA       GLY  56  15.220  -6.947  -0.255
  429    H    ILE  57           H        ILE  57  12.065  -5.701  -1.356
  430    HA   ILE  57           HA       ILE  57  12.036  -3.972   1.084
  431    HB   ILE  57           HB       ILE  57  12.087  -2.959  -1.286
  432   1HG1  ILE  57          2HG1      ILE  57  11.397  -1.772   0.847
  433   2HG1  ILE  57          1HG1      ILE  57  10.685  -1.125  -0.631
  434   1HG2  ILE  57          1HG2      ILE  57   9.180  -3.808  -1.194
  435   2HG2  ILE  57          2HG2      ILE  57  10.407  -4.539  -2.229
  436   3HG2  ILE  57          3HG2      ILE  57   9.953  -2.850  -2.453
  437   1HD1  ILE  57          1HD1      ILE  57   8.878  -1.278   0.900
  438   2HD1  ILE  57          2HD1      ILE  57   9.376  -2.875   1.452
  439   3HD1  ILE  57          3HD1      ILE  57   8.692  -2.673  -0.159
  440    H    ILE  58           H        ILE  58  10.522  -4.471   2.597
  441    HA   ILE  58           HA       ILE  58   8.369  -6.372   1.911
  442    HB   ILE  58           HB       ILE  58   9.789  -6.384   4.093
  443   1HG1  ILE  58          2HG1      ILE  58   7.831  -7.818   3.766
  444   2HG1  ILE  58          1HG1      ILE  58   7.825  -7.171   5.408
  445   1HG2  ILE  58          1HG2      ILE  58   7.692  -4.459   5.067
  446   2HG2  ILE  58          2HG2      ILE  58   9.210  -3.855   4.403
  447   3HG2  ILE  58          3HG2      ILE  58   9.224  -4.905   5.820
  448   1HD1  ILE  58          1HD1      ILE  58   5.621  -6.780   4.754
  449   2HD1  ILE  58          2HD1      ILE  58   6.071  -6.445   3.082
  450   3HD1  ILE  58          3HD1      ILE  58   6.385  -5.246   4.336
  451    H    TRP  59           H        TRP  59   6.505  -5.540   1.092
  452    HA   TRP  59           HA       TRP  59   5.885  -2.796   0.965
  453   1HB   TRP  59          2HB       TRP  59   4.132  -5.250   0.777
  454   2HB   TRP  59          1HB       TRP  59   3.512  -3.617   0.510
  455    HD1  TRP  59           HD1      TRP  59   4.472  -6.287  -1.537
  456    HE1  TRP  59           HE1      TRP  59   5.621  -5.550  -3.727
  457    HE3  TRP  59           HE3      TRP  59   5.676  -1.471  -0.330
  458    HZ2  TRP  59           HZ2      TRP  59   6.884  -3.226  -4.817
  459    HZ3  TRP  59           HZ3      TRP  59   6.847  -0.021  -1.961
  460    HH2  TRP  59           HH2      TRP  59   7.449  -0.891  -4.200
  461    H    GLY  60           H        GLY  60   6.001  -1.717   2.911
  462   1HA   GLY  60          1HA       GLY  60   4.011  -2.529   4.996
  463   2HA   GLY  60          2HA       GLY  60   5.546  -1.749   5.382
  464    H    GLU  61           H        GLU  61   3.673  -0.321   6.430
  465    HA   GLU  61           HA       GLU  61   2.163   1.412   4.722
  466   1HB   GLU  61          2HB       GLU  61   2.344   2.959   6.883
  467   2HB   GLU  61          1HB       GLU  61   1.332   1.517   6.871
  468   1HG   GLU  61          2HG       GLU  61   4.142   1.013   7.619
  469   2HG   GLU  61          1HG       GLU  61   3.261   2.041   8.748
  470    H    ASP  62           H        ASP  62   5.134   2.205   6.585
  471    HA   ASP  62           HA       ASP  62   5.536   4.670   5.169
  472   1HB   ASP  62          2HB       ASP  62   7.418   2.984   6.839
  473   2HB   ASP  62          1HB       ASP  62   7.817   4.587   6.222
  474    H    THR  63           H        THR  63   6.819   1.389   4.761
  475    HA   THR  63           HA       THR  63   8.795   1.993   2.815
  476    HB   THR  63           HB       THR  63   7.631  -0.509   2.129
  477    HG1  THR  63           HG1      THR  63   7.822  -1.346   4.388
  478   1HG2  THR  63          1HG2      THR  63   9.989   0.183   3.905
  479   2HG2  THR  63          2HG2      THR  63  10.030   0.060   2.147
  480   3HG2  THR  63          3HG2      THR  63   9.714  -1.375   3.123
  481    H    LEU  64           H        LEU  64   5.306   1.488   2.503
  482    HA   LEU  64           HA       LEU  64   5.388   1.549  -0.414
  483   1HB   LEU  64          2HB       LEU  64   3.473   0.876   1.549
  484   2HB   LEU  64          1HB       LEU  64   2.807   2.260   0.683
  485    HG   LEU  64           HG       LEU  64   3.823  -0.318  -0.552
  486   1HD1  LEU  64          1HD1      LEU  64   1.501  -0.166   0.603
  487   2HD1  LEU  64          2HD1      LEU  64   1.567  -0.805  -1.039
  488   3HD1  LEU  64          3HD1      LEU  64   1.056   0.859  -0.761
  489   1HD2  LEU  64          1HD2      LEU  64   4.028   0.794  -2.501
  490   2HD2  LEU  64          2HD2      LEU  64   3.722   2.304  -1.643
  491   3HD2  LEU  64          3HD2      LEU  64   2.380   1.405  -2.352
  492    H    MET  65           H        MET  65   5.003   3.870   2.187
  493    HA   MET  65           HA       MET  65   3.909   6.038   0.722
  494   1HB   MET  65          2HB       MET  65   4.114   6.145   3.146
  495   2HB   MET  65          1HB       MET  65   5.872   6.034   3.035
  496   1HG   MET  65          2HG       MET  65   5.279   8.169   1.372
  497   2HG   MET  65          1HG       MET  65   4.129   8.365   2.693
  498   1HE   MET  65          1HE       MET  65   6.469  10.921   3.809
  499   2HE   MET  65          2HE       MET  65   5.145  10.177   4.704
  500   3HE   MET  65          3HE       MET  65   4.991  10.432   2.968
  501    H    GLU  66           H        GLU  66   7.214   4.823   0.979
  502    HA   GLU  66           HA       GLU  66   8.371   7.048  -0.481
  503   1HB   GLU  66          2HB       GLU  66   9.667   5.663   1.138
  504   2HB   GLU  66          1HB       GLU  66   9.513   4.291   0.041
  505   1HG   GLU  66          2HG       GLU  66  10.596   5.725  -1.746
  506   2HG   GLU  66          1HG       GLU  66  10.941   6.909  -0.483
  507    H    TYR  67           H        TYR  67   7.970   3.585  -1.293
  508    HA   TYR  67           HA       TYR  67   8.691   3.680  -3.982
  509   1HB   TYR  67          2HB       TYR  67   8.142   1.576  -2.875
  510   2HB   TYR  67          1HB       TYR  67   6.456   2.067  -2.718
  511    HD1  TYR  67           HD1      TYR  67   9.064   0.905  -5.023
  512    HD2  TYR  67           HD2      TYR  67   4.985   2.185  -4.682
  513    HE1  TYR  67           HE1      TYR  67   8.598   0.018  -7.291
  514    HE2  TYR  67           HE2      TYR  67   4.513   1.298  -6.948
  515    HH   TYR  67           HH       TYR  67   5.438  -0.380  -8.492
  516    H    LEU  68           H        LEU  68   5.730   4.869  -2.510
  517    HA   LEU  68           HA       LEU  68   4.468   5.275  -5.142
  518   1HB   LEU  68          2HB       LEU  68   3.569   5.145  -2.414
  519   2HB   LEU  68          1HB       LEU  68   3.053   6.677  -3.119
  520    HG   LEU  68           HG       LEU  68   2.178   5.402  -5.096
  521   1HD1  LEU  68          1HD1      LEU  68   3.663   3.315  -3.906
  522   2HD1  LEU  68          2HD1      LEU  68   2.632   3.207  -5.332
  523   3HD1  LEU  68          3HD1      LEU  68   1.968   2.858  -3.735
  524   1HD2  LEU  68          1HD2      LEU  68   0.657   4.071  -3.028
  525   2HD2  LEU  68          2HD2      LEU  68   0.205   5.466  -4.008
  526   3HD2  LEU  68          3HD2      LEU  68   1.093   5.698  -2.503
  527    H    GLU  69           H        GLU  69   5.956   7.214  -2.577
  528    HA   GLU  69           HA       GLU  69   5.392   9.779  -3.668
  529   1HB   GLU  69          2HB       GLU  69   6.569   8.938  -1.418
  530   2HB   GLU  69          1HB       GLU  69   8.019   9.253  -2.360
  531   1HG   GLU  69          2HG       GLU  69   7.436  11.547  -2.684
  532   2HG   GLU  69          1HG       GLU  69   5.790  11.279  -2.109
  533    H    ASN  70           H        ASN  70   7.498   7.237  -4.589
  534    HA   ASN  70           HA       ASN  70   8.227   8.526  -7.071
  535   1HB   ASN  70          2HB       ASN  70  10.111   8.596  -4.761
  536   2HB   ASN  70          1HB       ASN  70  10.792   8.180  -6.333
  537   1HD2  ASN  70          1HD2      ASN  70   9.278   9.781  -8.065
  538   2HD2  ASN  70          2HD2      ASN  70   9.535  11.419  -7.702
  539    HA   PRO  71           HA       PRO  71   8.326   3.969  -7.088
  540   1HB   PRO  71          2HB       PRO  71   6.972   3.767  -9.482
  541   2HB   PRO  71          1HB       PRO  71   6.169   3.871  -7.907
  542   1HG   PRO  71          2HG       PRO  71   6.433   5.955 -10.016
  543   2HG   PRO  71          1HG       PRO  71   5.199   5.784  -8.759
  544   1HD   PRO  71          2HD       PRO  71   7.379   7.591  -8.707
  545   2HD   PRO  71          1HD       PRO  71   6.329   7.179  -7.335
  546    H    LYS  72           H        LYS  72   8.876   6.184  -9.835
  547    HA   LYS  72           HA       LYS  72  10.633   4.327 -11.200
  548   1HB   LYS  72          2HB       LYS  72   9.326   6.040 -12.420
  549   2HB   LYS  72          1HB       LYS  72  10.259   7.305 -11.618
  550   1HG   LYS  72          2HG       LYS  72  11.905   5.227 -12.909
  551   2HG   LYS  72          1HG       LYS  72  10.930   6.176 -14.030
  552   1HD   LYS  72          2HD       LYS  72  11.888   8.233 -13.270
  553   2HD   LYS  72          1HD       LYS  72  12.643   7.445 -11.883
  554   1HE   LYS  72          2HE       LYS  72  14.464   7.507 -13.297
  555   2HE   LYS  72          1HE       LYS  72  13.765   5.972 -13.812
  556   1HZ   LYS  72          1HZ       LYS  72  12.681   7.044 -15.622
  557   2HZ   LYS  72          2HZ       LYS  72  14.313   7.511 -15.658
  558   3HZ   LYS  72          3HZ       LYS  72  13.133   8.584 -15.072
  559    H    LYS  73           H        LYS  73  11.056   7.002  -8.932
  560    HA   LYS  73           HA       LYS  73  13.969   7.021  -9.308
  561   1HB   LYS  73          2HB       LYS  73  12.510   8.305  -7.002
  562   2HB   LYS  73          1HB       LYS  73  14.021   8.802  -7.760
  563   1HG   LYS  73          2HG       LYS  73  11.904   8.736  -9.728
  564   2HG   LYS  73          1HG       LYS  73  11.432   9.745  -8.360
  565   1HD   LYS  73          2HD       LYS  73  12.597  11.247  -9.746
  566   2HD   LYS  73          1HD       LYS  73  13.820  10.757  -8.574
  567   1HE   LYS  73          2HE       LYS  73  14.873   9.299 -10.106
  568   2HE   LYS  73          1HE       LYS  73  13.471   9.271 -11.176
  569   1HZ   LYS  73          1HZ       LYS  73  15.485  11.385 -10.809
  570   2HZ   LYS  73          2HZ       LYS  73  13.926  11.792 -11.350
  571   3HZ   LYS  73          3HZ       LYS  73  14.886  10.714 -12.246
  572    H    TYR  74           H        TYR  74  11.649   5.462  -7.199
  573    HA   TYR  74           HA       TYR  74  13.705   4.669  -5.255
  574   1HB   TYR  74          2HB       TYR  74  11.434   5.021  -4.440
  575   2HB   TYR  74          1HB       TYR  74  10.806   3.845  -5.594
  576    HD1  TYR  74           HD1      TYR  74  13.995   3.493  -3.738
  577    HD2  TYR  74           HD2      TYR  74   9.891   2.256  -4.025
  578    HE1  TYR  74           HE1      TYR  74  14.430   1.668  -2.118
  579    HE2  TYR  74           HE2      TYR  74  10.326   0.432  -2.403
  580    HH   TYR  74           HH       TYR  74  13.248   0.252  -0.584
  581    H    ILE  75           H        ILE  75  11.392   2.635  -7.070
  582    HA   ILE  75           HA       ILE  75  13.458   0.559  -7.262
  583    HB   ILE  75           HB       ILE  75  10.578   0.482  -8.171
  584   1HG1  ILE  75          2HG1      ILE  75  10.803   1.169  -5.769
  585   2HG1  ILE  75          1HG1      ILE  75  10.037  -0.409  -5.969
  586   1HG2  ILE  75          1HG2      ILE  75  11.681  -1.383  -9.016
  587   2HG2  ILE  75          2HG2      ILE  75  11.062  -1.973  -7.474
  588   3HG2  ILE  75          3HG2      ILE  75  12.754  -1.500  -7.623
  589   1HD1  ILE  75          1HD1      ILE  75  11.644  -0.735  -4.255
  590   2HD1  ILE  75          2HD1      ILE  75  12.868   0.196  -5.117
  591   3HD1  ILE  75          3HD1      ILE  75  12.395  -1.398  -5.707
  592    HA   PRO  76           HA       PRO  76  14.102   1.978 -11.478
  593   1HB   PRO  76          2HB       PRO  76  16.336   0.433 -11.891
  594   2HB   PRO  76          1HB       PRO  76  16.367   1.977 -11.022
  595   1HG   PRO  76          2HG       PRO  76  16.575  -0.788  -9.935
  596   2HG   PRO  76          1HG       PRO  76  17.172   0.734  -9.252
  597   1HD   PRO  76          2HD       PRO  76  14.826  -0.660  -8.455
  598   2HD   PRO  76          1HD       PRO  76  15.292   0.985  -7.973
  599    H    GLY  77           H        GLY  77  11.998   0.319 -11.441
  600   1HA   GLY  77          2HA       GLY  77  12.543  -1.554 -13.624
  601   2HA   GLY  77          1HA       GLY  77  12.032  -2.323 -12.121
  602    H    THR  78           H        THR  78  10.155  -0.414 -11.209
  603    HA   THR  78           HA       THR  78   7.840  -1.189 -12.673
  604    HB   THR  78           HB       THR  78   7.898  -0.275 -10.282
  605    HG1  THR  78           HG1      THR  78   5.854  -0.250 -10.697
  606   1HG2  THR  78          1HG2      THR  78   9.095   1.892 -11.404
  607   2HG2  THR  78          2HG2      THR  78   8.214   1.950  -9.876
  608   3HG2  THR  78          3HG2      THR  78   7.417   2.435 -11.372
  609    H    LYS  79           H        LYS  79   6.358   0.256 -13.844
  610    HA   LYS  79           HA       LYS  79   7.774   2.445 -15.295
  611   1HB   LYS  79          2HB       LYS  79   6.260   0.094 -16.390
  612   2HB   LYS  79          1HB       LYS  79   6.207   1.628 -17.261
  613   1HG   LYS  79          2HG       LYS  79   8.350   1.429 -17.966
  614   2HG   LYS  79          1HG       LYS  79   8.907   0.886 -16.382
  615   1HD   LYS  79          2HD       LYS  79   8.340  -1.364 -16.822
  616   2HD   LYS  79          1HD       LYS  79   7.295  -0.926 -18.173
  617   1HE   LYS  79          2HE       LYS  79  10.080  -0.030 -18.482
  618   2HE   LYS  79          1HE       LYS  79   9.894  -1.782 -18.426
  619   1HZ   LYS  79          1HZ       LYS  79   8.860  -1.812 -20.389
  620   2HZ   LYS  79          2HZ       LYS  79   9.516  -0.260 -20.615
  621   3HZ   LYS  79          3HZ       LYS  79   7.925  -0.438 -20.045
  622    H    MET  80           H        MET  80   5.514   1.912 -13.106
  623    HA   MET  80           HA       MET  80   3.227   3.218 -14.351
  624   1HB   MET  80          2HB       MET  80   2.228   3.170 -12.101
  625   2HB   MET  80          1HB       MET  80   2.931   1.614 -12.514
  626   1HG   MET  80          2HG       MET  80   4.815   1.976 -11.163
  627   2HG   MET  80          1HG       MET  80   4.434   3.657 -10.930
  628   1HE   MET  80          1HE       MET  80   1.892   4.088  -8.542
  629   2HE   MET  80          2HE       MET  80   3.111   4.648  -9.683
  630   3HE   MET  80          3HE       MET  80   3.603   4.064  -8.096
  631    H    ILE  81           H        ILE  81   3.264   5.288 -14.839
  632    HA   ILE  81           HA       ILE  81   4.951   7.173 -13.285
  633    HB   ILE  81           HB       ILE  81   4.940   7.115 -15.848
  634   1HG1  ILE  81          2HG1      ILE  81   4.137   9.855 -15.334
  635   2HG1  ILE  81          1HG1      ILE  81   5.131   9.240 -14.013
  636   1HG2  ILE  81          1HG2      ILE  81   3.076   7.760 -17.039
  637   2HG2  ILE  81          2HG2      ILE  81   2.472   8.788 -15.739
  638   3HG2  ILE  81          3HG2      ILE  81   2.268   7.038 -15.649
  639   1HD1  ILE  81          1HD1      ILE  81   5.839   9.181 -16.961
  640   2HD1  ILE  81          2HD1      ILE  81   6.817   8.470 -15.676
  641   3HD1  ILE  81          3HD1      ILE  81   6.570  10.216 -15.734
  642    H    PHE  82           H        PHE  82   2.581   5.983 -12.179
  643    HA   PHE  82           HA       PHE  82   0.274   7.617 -12.259
  644   1HB   PHE  82          2HB       PHE  82  -0.123   5.623 -11.183
  645   2HB   PHE  82          1HB       PHE  82   1.459   5.595 -10.418
  646    HD1  PHE  82           HD1      PHE  82  -1.865   7.240 -10.323
  647    HD2  PHE  82           HD2      PHE  82   1.761   6.369  -8.200
  648    HE1  PHE  82           HE1      PHE  82  -2.882   8.129  -8.240
  649    HE2  PHE  82           HE2      PHE  82   0.748   7.255  -6.111
  650    HZ   PHE  82           HZ       PHE  82  -1.575   8.131  -6.134
  651    H    VAL  83           H        VAL  83   3.275   7.929 -10.466
  652    HA   VAL  83           HA       VAL  83   2.899   9.591  -8.390
  653    HB   VAL  83           HB       VAL  83   4.887  10.974  -9.283
  654   1HG1  VAL  83          1HG1      VAL  83   6.292   9.330  -8.485
  655   2HG1  VAL  83          2HG1      VAL  83   5.512   8.061  -9.428
  656   3HG1  VAL  83          3HG1      VAL  83   4.753   8.654  -7.951
  657   1HG2  VAL  83          1HG2      VAL  83   5.997   9.961 -11.249
  658   2HG2  VAL  83          2HG2      VAL  83   4.402  10.580 -11.675
  659   3HG2  VAL  83          3HG2      VAL  83   4.641   8.850 -11.438
  660    H    GLY  84           H        GLY  84   1.203  11.001  -8.232
  661   1HA   GLY  84          2HA       GLY  84   1.368  13.548  -9.582
  662   2HA   GLY  84          1HA       GLY  84   0.038  12.580 -10.221
  663    H    ILE  85           H        ILE  85   1.079  12.308  -6.884
  664    HA   ILE  85           HA       ILE  85  -1.526  13.522  -6.069
  665    HB   ILE  85           HB       ILE  85   0.195  11.367  -4.830
  666   1HG1  ILE  85          2HG1      ILE  85  -2.715  11.558  -5.671
  667   2HG1  ILE  85          1HG1      ILE  85  -1.450  10.630  -6.475
  668   1HG2  ILE  85          1HG2      ILE  85  -0.349  12.268  -2.815
  669   2HG2  ILE  85          2HG2      ILE  85  -1.962  11.635  -3.146
  670   3HG2  ILE  85          3HG2      ILE  85  -1.581  13.317  -3.515
  671   1HD1  ILE  85          1HD1      ILE  85  -1.213   9.169  -4.564
  672   2HD1  ILE  85          2HD1      ILE  85  -2.927   9.250  -4.971
  673   3HD1  ILE  85          3HD1      ILE  85  -2.300  10.171  -3.604
  674    H    LYS  86           H        LYS  86  -1.526  15.077  -4.409
  675    HA   LYS  86           HA       LYS  86   1.081  15.870  -3.239
  676   1HB   LYS  86          2HB       LYS  86  -0.657  18.052  -4.333
  677   2HB   LYS  86          1HB       LYS  86   1.087  18.036  -4.075
  678   1HG   LYS  86          2HG       LYS  86   1.288  16.377  -5.949
  679   2HG   LYS  86          1HG       LYS  86  -0.435  16.590  -6.260
  680   1HD   LYS  86          2HD       LYS  86   1.041  18.026  -7.710
  681   2HD   LYS  86          1HD       LYS  86  -0.118  18.942  -6.747
  682   1HE   LYS  86          2HE       LYS  86   1.514  19.741  -5.291
  683   2HE   LYS  86          1HE       LYS  86   2.608  18.397  -5.619
  684   1HZ   LYS  86          1HZ       LYS  86   2.669  20.896  -6.768
  685   2HZ   LYS  86          2HZ       LYS  86   2.070  19.871  -7.983
  686   3HZ   LYS  86          3HZ       LYS  86   3.562  19.535  -7.245
  687    H    LYS  87           H        LYS  87  -1.247  14.603  -2.102
  688    HA   LYS  87           HA       LYS  87  -1.996  16.729  -0.150
  689   1HB   LYS  87          2HB       LYS  87  -3.766  15.254  -1.953
  690   2HB   LYS  87          1HB       LYS  87  -4.227  15.076  -0.259
  691   1HG   LYS  87          2HG       LYS  87  -3.620  17.759  -1.521
  692   2HG   LYS  87          1HG       LYS  87  -5.245  17.077  -1.454
  693   1HD   LYS  87          2HD       LYS  87  -5.251  17.077   0.937
  694   2HD   LYS  87          1HD       LYS  87  -3.520  17.411   1.008
  695   1HE   LYS  87          2HE       LYS  87  -3.854  19.635   0.810
  696   2HE   LYS  87          1HE       LYS  87  -4.941  19.414  -0.561
  697   1HZ   LYS  87          1HZ       LYS  87  -6.035  18.597   1.982
  698   2HZ   LYS  87          2HZ       LYS  87  -6.737  19.519   0.740
  699   3HZ   LYS  87          3HZ       LYS  87  -5.706  20.256   1.870
  700    H    LYS  88           H        LYS  88  -1.978  16.016   1.967
  701    HA   LYS  88           HA       LYS  88  -0.817  13.389   2.481
  702   1HB   LYS  88          2HB       LYS  88  -1.566  15.775   4.124
  703   2HB   LYS  88          1HB       LYS  88  -1.379  14.226   4.945
  704   1HG   LYS  88          2HG       LYS  88   0.878  14.170   4.608
  705   2HG   LYS  88          1HG       LYS  88   0.757  14.894   3.005
  706   1HD   LYS  88          2HD       LYS  88  -0.015  16.717   5.178
  707   2HD   LYS  88          1HD       LYS  88   1.667  16.195   5.259
  708   1HE   LYS  88          2HE       LYS  88   1.683  18.136   3.879
  709   2HE   LYS  88          1HE       LYS  88   1.804  16.775   2.763
  710   1HZ   LYS  88          1HZ       LYS  88  -0.120  18.763   2.788
  711   2HZ   LYS  88          2HZ       LYS  88  -0.906  17.350   3.308
  712   3HZ   LYS  88          3HZ       LYS  88  -0.090  17.372   1.818
  713    H    GLU  89           H        GLU  89  -3.990  14.916   2.887
  714    HA   GLU  89           HA       GLU  89  -5.200  12.775   4.347
  715   1HB   GLU  89          2HB       GLU  89  -7.295  13.820   3.829
  716   2HB   GLU  89          1HB       GLU  89  -6.124  15.125   4.027
  717   1HG   GLU  89          2HG       GLU  89  -5.776  15.064   1.519
  718   2HG   GLU  89          1HG       GLU  89  -7.151  13.962   1.426
  719    H    GLU  90           H        GLU  90  -4.362  13.156   1.007
  720    HA   GLU  90           HA       GLU  90  -6.217  11.102   0.049
  721   1HB   GLU  90          2HB       GLU  90  -5.241  13.069  -1.310
  722   2HB   GLU  90          1HB       GLU  90  -3.774  12.095  -1.418
  723   1HG   GLU  90          2HG       GLU  90  -4.683  10.846  -3.051
  724   2HG   GLU  90          1HG       GLU  90  -6.049  10.440  -2.012
  725    H    ARG  91           H        ARG  91  -2.635  11.283   0.189
  726    HA   ARG  91           HA       ARG  91  -2.127   8.574  -0.367
  727   1HB   ARG  91          2HB       ARG  91   0.013   8.908   0.851
  728   2HB   ARG  91          1HB       ARG  91  -0.336  10.247  -0.242
  729   1HG   ARG  91          2HG       ARG  91  -0.165  11.656   1.502
  730   2HG   ARG  91          1HG       ARG  91  -1.584  10.889   2.213
  731   1HD   ARG  91          2HD       ARG  91   0.101   9.069   3.021
  732   2HD   ARG  91          1HD       ARG  91   1.324  10.302   2.714
  733    HE   ARG  91           HE       ARG  91  -0.799  11.417   4.293
  734   1HH1  ARG  91          1HH2      ARG  91   2.268  11.521   4.679
  735   2HH1  ARG  91          2HH2      ARG  91   2.410  10.764   6.230
  736   1HH2  ARG  91          1HH1      ARG  91  -0.798   9.450   6.179
  737   2HH2  ARG  91          2HH1      ARG  91   0.675   9.591   7.080
  738    H    ALA  92           H        ALA  92  -3.205  10.087   2.616
  739    HA   ALA  92           HA       ALA  92  -2.677   7.818   4.314
  740   1HB   ALA  92          1HB       ALA  92  -3.153   9.413   5.833
  741   2HB   ALA  92          2HB       ALA  92  -4.851   9.265   5.386
  742   3HB   ALA  92          3HB       ALA  92  -3.829  10.455   4.581
  743    H    ASP  93           H        ASP  93  -5.692   9.061   2.832
  744    HA   ASP  93           HA       ASP  93  -7.352   6.916   3.663
  745   1HB   ASP  93          2HB       ASP  93  -7.487   8.755   1.265
  746   2HB   ASP  93          1HB       ASP  93  -8.743   7.568   1.624
  747    H    LEU  94           H        LEU  94  -4.908   7.071   1.207
  748    HA   LEU  94           HA       LEU  94  -5.870   4.848  -0.384
  749   1HB   LEU  94          2HB       LEU  94  -3.232   6.284  -0.127
  750   2HB   LEU  94          1HB       LEU  94  -3.365   4.814  -1.093
  751    HG   LEU  94           HG       LEU  94  -5.109   7.269  -1.447
  752   1HD1  LEU  94          1HD1      LEU  94  -2.472   7.104  -2.118
  753   2HD1  LEU  94          2HD1      LEU  94  -3.654   8.046  -3.027
  754   3HD1  LEU  94          3HD1      LEU  94  -3.217   6.424  -3.564
  755   1HD2  LEU  94          1HD2      LEU  94  -6.367   5.492  -2.286
  756   2HD2  LEU  94          2HD2      LEU  94  -4.938   4.563  -2.742
  757   3HD2  LEU  94          3HD2      LEU  94  -5.434   5.950  -3.712
  758    H    ILE  95           H        ILE  95  -3.139   5.087   1.927
  759    HA   ILE  95           HA       ILE  95  -2.595   2.310   2.074
  760    HB   ILE  95           HB       ILE  95  -2.353   4.197   4.425
  761   1HG1  ILE  95          2HG1      ILE  95  -1.423   5.508   2.695
  762   2HG1  ILE  95          1HG1      ILE  95  -0.030   4.650   3.352
  763   1HG2  ILE  95          1HG2      ILE  95  -0.644   1.901   3.409
  764   2HG2  ILE  95          2HG2      ILE  95  -1.765   1.821   4.769
  765   3HG2  ILE  95          3HG2      ILE  95  -0.335   2.848   4.865
  766   1HD1  ILE  95          1HD1      ILE  95  -0.894   2.862   1.483
  767   2HD1  ILE  95          2HD1      ILE  95   0.340   4.085   1.177
  768   3HD1  ILE  95          3HD1      ILE  95  -1.334   4.387   0.713
  769    H    ALA  96           H        ALA  96  -4.886   4.305   3.865
  770    HA   ALA  96           HA       ALA  96  -5.716   2.373   5.773
  771   1HB   ALA  96          1HB       ALA  96  -7.862   3.722   5.817
  772   2HB   ALA  96          2HB       ALA  96  -7.199   4.680   4.492
  773   3HB   ALA  96          3HB       ALA  96  -6.390   4.663   6.058
  774    H    TYR  97           H        TYR  97  -7.080   3.134   2.555
  775    HA   TYR  97           HA       TYR  97  -9.136   1.168   2.628
  776   1HB   TYR  97          2HB       TYR  97  -9.273   2.854   0.942
  777   2HB   TYR  97          1HB       TYR  97  -7.655   2.486   0.346
  778    HD1  TYR  97           HD1      TYR  97  -7.593   1.344  -1.671
  779    HD2  TYR  97           HD2      TYR  97 -10.808   0.565   1.069
  780    HE1  TYR  97           HE1      TYR  97  -8.544  -0.307  -3.257
  781    HE2  TYR  97           HE2      TYR  97 -11.759  -1.087  -0.518
  782    HH   TYR  97           HH       TYR  97 -10.969  -2.513  -2.374
  783    H    LEU  98           H        LEU  98  -5.732   0.985   1.707
  784    HA   LEU  98           HA       LEU  98  -6.003  -1.776   0.753
  785   1HB   LEU  98          2HB       LEU  98  -3.853   0.263   0.902
  786   2HB   LEU  98          1HB       LEU  98  -3.325  -1.414   1.022
  787    HG   LEU  98           HG       LEU  98  -3.318  -0.781  -1.319
  788   1HD1  LEU  98          1HD1      LEU  98  -5.879  -2.306  -1.174
  789   2HD1  LEU  98          2HD1      LEU  98  -4.466  -3.011  -0.389
  790   3HD1  LEU  98          3HD1      LEU  98  -4.423  -2.640  -2.112
  791   1HD2  LEU  98          1HD2      LEU  98  -4.989   0.410  -2.358
  792   2HD2  LEU  98          2HD2      LEU  98  -5.255   0.984  -0.713
  793   3HD2  LEU  98          3HD2      LEU  98  -6.261  -0.307  -1.370
  794    H    LYS  99           H        LYS  99  -5.620  -0.242   3.771
  795    HA   LYS  99           HA       LYS  99  -4.274  -2.566   4.978
  796   1HB   LYS  99          2HB       LYS  99  -4.362   0.212   5.567
  797   2HB   LYS  99          1HB       LYS  99  -5.110  -0.633   6.924
  798   1HG   LYS  99          2HG       LYS  99  -2.472  -1.503   5.728
  799   2HG   LYS  99          1HG       LYS  99  -2.575  -0.349   7.057
  800   1HD   LYS  99          2HD       LYS  99  -4.244  -2.687   7.534
  801   2HD   LYS  99          1HD       LYS  99  -2.554  -3.131   7.293
  802   1HE   LYS  99          2HE       LYS  99  -2.463  -2.647   9.543
  803   2HE   LYS  99          1HE       LYS  99  -2.185  -1.024   8.911
  804   1HZ   LYS  99          1HZ       LYS  99  -4.641  -2.176  10.051
  805   2HZ   LYS  99          2HZ       LYS  99  -4.750  -0.895   8.939
  806   3HZ   LYS  99          3HZ       LYS  99  -3.895  -0.692  10.394
  807    H    LYS 100           H        LYS 100  -7.413  -1.528   4.306
  808    HA   LYS 100           HA       LYS 100  -8.497  -3.210   6.532
  809   1HB   LYS 100          2HB       LYS 100  -9.287  -0.918   6.724
  810   2HB   LYS 100          1HB       LYS 100  -9.775  -0.906   5.028
  811   1HG   LYS 100          2HG       LYS 100 -11.056  -3.152   6.055
  812   2HG   LYS 100          1HG       LYS 100 -11.190  -1.969   7.356
  813   1HD   LYS 100          2HD       LYS 100 -12.153  -0.332   5.821
  814   2HD   LYS 100          1HD       LYS 100 -11.936  -1.439   4.465
  815   1HE   LYS 100          2HE       LYS 100 -13.871  -2.488   4.940
  816   2HE   LYS 100          1HE       LYS 100 -13.367  -2.754   6.608
  817   1HZ   LYS 100          1HZ       LYS 100 -15.218  -0.879   5.600
  818   2HZ   LYS 100          2HZ       LYS 100 -13.946  -0.057   6.369
  819   3HZ   LYS 100          3HZ       LYS 100 -14.835  -1.233   7.214
  820    H    ALA 101           H        ALA 101  -9.174  -2.227   3.155
  821    HA   ALA 101           HA       ALA 101 -10.996  -4.371   2.649
  822   1HB   ALA 101          1HB       ALA 101 -10.409  -3.842   0.203
  823   2HB   ALA 101          2HB       ALA 101  -9.356  -2.585   0.853
  824   3HB   ALA 101          3HB       ALA 101 -11.092  -2.526   1.159
  825    H    THR 102           H        THR 102  -7.485  -4.130   2.446
  826    HA   THR 102           HA       THR 102  -7.445  -7.029   1.714
  827    HB   THR 102           HB       THR 102  -5.098  -6.243   0.701
  828    HG1  THR 102           HG1      THR 102  -6.791  -4.012   0.296
  829   1HG2  THR 102          1HG2      THR 102  -6.103  -6.349  -1.446
  830   2HG2  THR 102          2HG2      THR 102  -7.628  -5.696  -0.849
  831   3HG2  THR 102          3HG2      THR 102  -7.139  -7.334  -0.414
  832    H    ASN 103           H        ASN 103  -7.391  -6.015   4.381
  833    HA   ASN 103           HA       ASN 103  -5.152  -7.387   5.442
  834   1HB   ASN 103          2HB       ASN 103  -4.103  -5.228   4.385
  835   2HB   ASN 103          1HB       ASN 103  -4.763  -4.428   5.812
  836   1HD2  ASN 103          1HD2      ASN 103  -2.326  -6.720   4.694
  837   2HD2  ASN 103          2HD2      ASN 103  -1.530  -6.882   6.183
  838    H    GLU 104           HN       GLU 104  -7.775  -7.466   6.115
  839    HA   GLU 104           HA       GLU 104  -8.207  -5.730   8.470
  840   1HB   GLU 104          2HB       GLU 104 -10.422  -6.841   8.570
  841   2HB   GLU 104          1HB       GLU 104 -10.112  -6.162   6.972
  842   1HG   GLU 104          2HG       GLU 104  -9.027  -8.745   6.873
  843   2HG   GLU 104          1HG       GLU 104 -10.558  -8.931   7.728
  844    HHA  HEC 105           HHA      HEC 105   4.336  -2.651  -9.199
  845    HHB  HEC 105           HHB      HEC 105   1.276   0.955  -4.996
  846    HHC  HEC 105           HHC      HEC 105  -1.786   3.852  -9.715
  847    HHD  HEC 105           HHD      HEC 105   1.215   0.195 -13.902
  848   1HMA  HEC 105          1HMA      HEC 105   3.469  -1.958  -4.108
  849   2HMA  HEC 105          2HMA      HEC 105   2.168  -0.778  -3.949
  850   3HMA  HEC 105          3HMA      HEC 105   3.839  -0.234  -4.082
  851   1HAA  HEC 105          1HAA      HEC 105   5.312  -2.386  -5.715
  852   2HAA  HEC 105          2HAA      HEC 105   5.252  -2.900  -7.392
  853   1HBA  HEC 105          1HBA      HEC 105   3.138  -4.238  -6.650
  854   2HBA  HEC 105          2HBA      HEC 105   3.789  -4.024  -5.024
  855   1HMB  HEC 105          1HMB      HEC 105   0.195   2.483  -4.169
  856   2HMB  HEC 105          2HMB      HEC 105  -1.553   2.388  -4.383
  857   3HMB  HEC 105          3HMB      HEC 105  -0.732   3.941  -4.520
  858    HAB  HEC 105           HAB      HEC 105  -2.354   4.823  -7.945
  859   1HBB  HEC 105          1HBB      HEC 105  -2.584   6.181  -6.148
  860   2HBB  HEC 105          2HBB      HEC 105  -0.951   5.563  -5.899
  861   3HBB  HEC 105          3HBB      HEC 105  -2.298   4.889  -4.985
  862   1HMC  HEC 105          1HMC      HEC 105  -2.717   4.101 -11.546
  863   2HMC  HEC 105          2HMC      HEC 105  -1.619   4.833 -12.717
  864   3HMC  HEC 105          3HMC      HEC 105  -2.751   3.582 -13.232
  865    HAC  HEC 105           HAC      HEC 105   0.116   1.583 -14.982
  866   1HBC  HEC 105          1HBC      HEC 105  -0.345   3.457 -15.994
  867   2HBC  HEC 105          2HBC      HEC 105  -0.733   4.142 -14.415
  868   3HBC  HEC 105          3HBC      HEC 105  -2.009   3.446 -15.413
  869   1HMD  HEC 105          1HMD      HEC 105   4.182  -1.956 -14.382
  870   2HMD  HEC 105          2HMD      HEC 105   2.535  -2.579 -14.465
  871   3HMD  HEC 105          3HMD      HEC 105   2.843  -0.863 -14.734
  872   1HAD  HEC 105          1HAD      HEC 105   5.599  -2.778 -12.054
  873   2HAD  HEC 105          2HAD      HEC 105   4.665  -3.740 -10.922
  874   1HBD  HEC 105          1HBD      HEC 105   3.299  -3.922 -13.374
  875   2HBD  HEC 105          2HBD      HEC 105   4.261  -5.178 -12.595
  Start of MODEL    7
    1   1H    GLY   1          1HT       GLY   1  -8.726   8.064   8.024
    2   2H    GLY   1          2HT       GLY   1 -10.003   7.154   8.681
    3   3H    GLY   1          3HT       GLY   1  -9.005   8.082   9.697
    4   1HA   GLY   1          1HA       GLY   1 -10.479   9.714   9.542
    5   2HA   GLY   1          2HA       GLY   1  -9.964   9.881   7.862
    6    H    ASP   2           H        ASP   2 -11.105   8.470   6.264
    7    HA   ASP   2           HA       ASP   2 -13.791   7.573   7.185
    8   1HB   ASP   2          2HB       ASP   2 -13.434   9.153   4.636
    9   2HB   ASP   2          1HB       ASP   2 -14.932   8.781   5.492
   10    H    VAL   3           H        VAL   3 -13.752   5.435   6.681
   11    HA   VAL   3           HA       VAL   3 -12.075   4.198   4.766
   12    HB   VAL   3           HB       VAL   3 -13.187   2.878   6.476
   13   1HG1  VAL   3          1HG1      VAL   3 -15.289   4.424   6.312
   14   2HG1  VAL   3          2HG1      VAL   3 -15.513   2.726   6.733
   15   3HG1  VAL   3          3HG1      VAL   3 -15.828   3.274   5.087
   16   1HG2  VAL   3          1HG2      VAL   3 -13.199   2.251   3.699
   17   2HG2  VAL   3          2HG2      VAL   3 -14.696   1.618   4.382
   18   3HG2  VAL   3          3HG2      VAL   3 -13.142   1.130   5.058
   19    H    GLU   4           H        GLU   4 -15.304   5.599   4.434
   20    HA   GLU   4           HA       GLU   4 -16.005   4.641   1.881
   21   1HB   GLU   4          2HB       GLU   4 -16.694   6.971   3.546
   22   2HB   GLU   4          1HB       GLU   4 -16.886   7.247   1.814
   23   1HG   GLU   4          2HG       GLU   4 -18.199   5.104   1.690
   24   2HG   GLU   4          1HG       GLU   4 -18.127   5.019   3.451
   25    H    LYS   5           H        LYS   5 -13.808   7.271   2.779
   26    HA   LYS   5           HA       LYS   5 -13.393   8.148   0.038
   27   1HB   LYS   5          2HB       LYS   5 -12.079   8.701   2.687
   28   2HB   LYS   5          1HB       LYS   5 -11.292   9.218   1.196
   29   1HG   LYS   5          2HG       LYS   5 -14.154   9.898   1.929
   30   2HG   LYS   5          1HG       LYS   5 -12.781  10.976   2.190
   31   1HD   LYS   5          2HD       LYS   5 -12.549  10.130  -0.480
   32   2HD   LYS   5          1HD       LYS   5 -14.264  10.470  -0.252
   33   1HE   LYS   5          2HE       LYS   5 -13.901  12.711   0.215
   34   2HE   LYS   5          1HE       LYS   5 -12.272  12.426   0.829
   35   1HZ   LYS   5          1HZ       LYS   5 -11.887  13.391  -1.214
   36   2HZ   LYS   5          2HZ       LYS   5 -13.196  12.609  -1.962
   37   3HZ   LYS   5          3HZ       LYS   5 -11.786  11.740  -1.588
   38    H    GLY   6           H        GLY   6 -11.534   6.140   2.330
   39   1HA   GLY   6          1HA       GLY   6  -9.219   5.630   0.928
   40   2HA   GLY   6          2HA       GLY   6 -10.051   4.368   1.835
   41    H    LYS   7           H        LYS   7 -12.287   3.850   0.420
   42    HA   LYS   7           HA       LYS   7 -11.332   2.347  -1.820
   43   1HB   LYS   7          2HB       LYS   7 -13.362   1.710  -0.590
   44   2HB   LYS   7          1HB       LYS   7 -14.164   3.186  -1.128
   45   1HG   LYS   7          2HG       LYS   7 -13.758   2.427  -3.509
   46   2HG   LYS   7          1HG       LYS   7 -13.221   0.881  -2.851
   47   1HD   LYS   7          2HD       LYS   7 -15.793   1.821  -1.764
   48   2HD   LYS   7          1HD       LYS   7 -15.823   1.474  -3.493
   49   1HE   LYS   7          2HE       LYS   7 -14.350  -0.576  -2.067
   50   2HE   LYS   7          1HE       LYS   7 -15.972  -0.397  -1.399
   51   1HZ   LYS   7          1HZ       LYS   7 -15.331  -0.756  -4.277
   52   2HZ   LYS   7          2HZ       LYS   7 -16.888  -0.624  -3.610
   53   3HZ   LYS   7          3HZ       LYS   7 -15.916  -1.969  -3.245
   54    H    LYS   8           H        LYS   8 -12.881   5.528  -1.572
   55    HA   LYS   8           HA       LYS   8 -13.351   5.903  -4.363
   56   1HB   LYS   8          2HB       LYS   8 -13.997   7.344  -2.203
   57   2HB   LYS   8          1HB       LYS   8 -12.566   8.250  -2.696
   58   1HG   LYS   8          2HG       LYS   8 -13.885   9.312  -4.190
   59   2HG   LYS   8          1HG       LYS   8 -13.952   7.790  -5.081
   60   1HD   LYS   8          2HD       LYS   8 -15.853   7.159  -3.425
   61   2HD   LYS   8          1HD       LYS   8 -15.926   8.888  -3.087
   62   1HE   LYS   8          2HE       LYS   8 -16.318   9.373  -5.447
   63   2HE   LYS   8          1HE       LYS   8 -16.139   7.666  -5.853
   64   1HZ   LYS   8          1HZ       LYS   8 -18.486   8.600  -5.536
   65   2HZ   LYS   8          2HZ       LYS   8 -18.140   8.550  -3.873
   66   3HZ   LYS   8          3HZ       LYS   8 -18.109   7.122  -4.793
   67    H    ILE   9           H        ILE   9 -10.420   6.031  -2.480
   68    HA   ILE   9           HA       ILE   9  -8.965   7.562  -4.515
   69    HB   ILE   9           HB       ILE   9  -7.723   5.944  -2.289
   70   1HG1  ILE   9          2HG1      ILE   9  -9.516   7.326  -1.314
   71   2HG1  ILE   9          1HG1      ILE   9  -7.934   7.972  -0.882
   72   1HG2  ILE   9          1HG2      ILE   9  -6.338   7.031  -4.125
   73   2HG2  ILE   9          2HG2      ILE   9  -5.937   7.534  -2.484
   74   3HG2  ILE   9          3HG2      ILE   9  -6.904   8.586  -3.516
   75   1HD1  ILE   9          1HD1      ILE   9  -8.938   9.056  -3.409
   76   2HD1  ILE   9          2HD1      ILE   9  -8.305   9.903  -1.999
   77   3HD1  ILE   9          3HD1      ILE   9  -9.999   9.413  -2.047
   78    H    PHE  10           H        PHE  10  -8.323   4.290  -3.176
   79    HA   PHE  10           HA       PHE  10  -6.697   3.394  -5.265
   80   1HB   PHE  10          2HB       PHE  10  -7.363   2.212  -3.055
   81   2HB   PHE  10          1HB       PHE  10  -8.719   1.567  -3.981
   82    HD1  PHE  10           HD1      PHE  10  -5.012   1.758  -3.803
   83    HD2  PHE  10           HD2      PHE  10  -8.401  -0.156  -5.620
   84    HE1  PHE  10           HE1      PHE  10  -3.514   0.054  -4.807
   85    HE2  PHE  10           HE2      PHE  10  -6.893  -1.857  -6.618
   86    HZ   PHE  10           HZ       PHE  10  -4.467  -1.753  -6.223
   87    H    ILE  11           H        ILE  11 -10.209   3.668  -5.175
   88    HA   ILE  11           HA       ILE  11 -10.679   2.128  -7.569
   89    HB   ILE  11           HB       ILE  11 -12.350   2.945  -5.697
   90   1HG1  ILE  11          2HG1      ILE  11 -12.966   2.732  -8.653
   91   2HG1  ILE  11          1HG1      ILE  11 -13.017   1.439  -7.454
   92   1HG2  ILE  11          1HG2      ILE  11 -11.893   5.380  -6.305
   93   2HG2  ILE  11          2HG2      ILE  11 -13.590   4.915  -6.221
   94   3HG2  ILE  11          3HG2      ILE  11 -12.796   5.081  -7.787
   95   1HD1  ILE  11          1HD1      ILE  11 -15.289   2.202  -7.889
   96   2HD1  ILE  11          2HD1      ILE  11 -14.824   3.871  -7.560
   97   3HD1  ILE  11          3HD1      ILE  11 -14.826   2.682  -6.257
   98    H    MET  12           H        MET  12 -10.156   5.579  -6.923
   99    HA   MET  12           HA       MET  12 -10.005   6.007  -9.881
  100   1HB   MET  12          2HB       MET  12 -11.650   7.342  -8.327
  101   2HB   MET  12          1HB       MET  12 -10.203   8.256  -7.899
  102   1HG   MET  12          2HG       MET  12 -10.209   9.351  -9.871
  103   2HG   MET  12          1HG       MET  12 -10.395   7.848 -10.776
  104   1HE   MET  12          1HE       MET  12 -13.847   6.996 -11.022
  105   2HE   MET  12          2HE       MET  12 -13.662   6.986  -9.270
  106   3HE   MET  12          3HE       MET  12 -12.331   6.451 -10.293
  107    H    LYS  13           H        LYS  13  -7.820   4.961  -8.115
  108    HA   LYS  13           HA       LYS  13  -5.816   7.031  -8.856
  109   1HB   LYS  13          2HB       LYS  13  -6.606   6.818  -6.255
  110   2HB   LYS  13          1HB       LYS  13  -5.273   5.664  -6.290
  111   1HG   LYS  13          2HG       LYS  13  -4.071   7.584  -5.869
  112   2HG   LYS  13          1HG       LYS  13  -4.089   7.651  -7.632
  113   1HD   LYS  13          2HD       LYS  13  -6.516   8.825  -6.678
  114   2HD   LYS  13          1HD       LYS  13  -5.172   9.547  -5.791
  115   1HE   LYS  13          2HE       LYS  13  -4.114  10.293  -7.773
  116   2HE   LYS  13          1HE       LYS  13  -5.078   9.222  -8.789
  117   1HZ   LYS  13          1HZ       LYS  13  -5.622  11.818  -8.350
  118   2HZ   LYS  13          2HZ       LYS  13  -6.625  11.066  -7.202
  119   3HZ   LYS  13          3HZ       LYS  13  -6.763  10.666  -8.848
  120    H    CYS  14           H        CYS  14  -6.414   3.668  -7.811
  121    HA   CYS  14           HA       CYS  14  -4.256   2.835  -9.665
  122   1HB   CYS  14          2HB       CYS  14  -4.097   1.271  -7.209
  123   2HB   CYS  14          1HB       CYS  14  -2.807   2.064  -8.106
  124    H    SER  15           H        SER  15  -7.336   2.560  -9.134
  125    HA   SER  15           HA       SER  15  -7.589  -0.363  -8.913
  126   1HB   SER  15          2HB       SER  15  -9.339   0.947  -7.912
  127   2HB   SER  15          1HB       SER  15  -9.601   1.846  -9.403
  128    HG   SER  15           HG       SER  15 -10.609  -0.533  -8.629
  129    H    GLN  16           H        GLN  16  -6.450   1.455 -11.302
  130    HA   GLN  16           HA       GLN  16  -7.979   0.125 -13.484
  131   1HB   GLN  16          2HB       GLN  16  -6.139   2.499 -13.343
  132   2HB   GLN  16          1HB       GLN  16  -6.351   1.657 -14.878
  133   1HG   GLN  16          2HG       GLN  16  -8.495   2.389 -15.131
  134   2HG   GLN  16          1HG       GLN  16  -8.852   2.245 -13.410
  135   1HE2  GLN  16          1HE2      GLN  16  -7.071   4.326 -15.739
  136   2HE2  GLN  16          2HE2      GLN  16  -7.225   5.745 -14.819
  137    H    CYS  17           H        CYS  17  -4.696   0.574 -12.215
  138    HA   CYS  17           HA       CYS  17  -3.719  -1.598 -13.981
  139   1HB   CYS  17          2HB       CYS  17  -2.346   0.437 -12.205
  140   2HB   CYS  17          1HB       CYS  17  -1.475  -0.920 -12.921
  141    H    HIS  18           H        HIS  18  -4.351  -0.823 -10.600
  142    HA   HIS  18           HA       HIS  18  -3.510  -3.592  -9.837
  143   1HB   HIS  18          2HB       HIS  18  -4.041  -1.171  -8.088
  144   2HB   HIS  18          1HB       HIS  18  -3.560  -2.763  -7.505
  145    HD1  HIS  18           HD1      HIS  18  -1.095  -3.350  -7.616
  146    HD2  HIS  18           HD2      HIS  18  -2.005   0.187  -9.600
  147    HE1  HIS  18           HE1      HIS  18   1.120  -2.267  -8.195
  148    H    THR  19           H        THR  19  -5.568  -4.497 -10.663
  149    HA   THR  19           HA       THR  19  -8.044  -3.510  -9.459
  150    HB   THR  19           HB       THR  19  -8.770  -5.906 -10.496
  151    HG1  THR  19           HG1      THR  19  -7.407  -6.565 -12.001
  152   1HG2  THR  19          1HG2      THR  19  -9.256  -3.369 -11.130
  153   2HG2  THR  19          2HG2      THR  19  -9.655  -4.678 -12.242
  154   3HG2  THR  19          3HG2      THR  19  -8.177  -3.744 -12.474
  155    H    VAL  20           H        VAL  20  -7.719  -3.743  -7.220
  156    HA   VAL  20           HA       VAL  20  -6.959  -6.350  -6.112
  157    HB   VAL  20           HB       VAL  20  -7.081  -5.241  -3.963
  158   1HG1  VAL  20          1HG1      VAL  20  -5.642  -3.219  -4.426
  159   2HG1  VAL  20          2HG1      VAL  20  -5.939  -3.479  -6.145
  160   3HG1  VAL  20          3HG1      VAL  20  -5.083  -4.699  -5.203
  161   1HG2  VAL  20          1HG2      VAL  20  -8.554  -3.585  -3.553
  162   2HG2  VAL  20          2HG2      VAL  20  -9.123  -3.754  -5.214
  163   3HG2  VAL  20          3HG2      VAL  20  -7.855  -2.590  -4.830
  164    H    GLU  21           H        GLU  21  -9.738  -5.443  -7.503
  165    HA   GLU  21           HA       GLU  21 -11.304  -7.193  -5.696
  166   1HB   GLU  21          2HB       GLU  21 -12.034  -4.350  -6.419
  167   2HB   GLU  21          1HB       GLU  21 -13.235  -5.522  -5.873
  168   1HG   GLU  21          2HG       GLU  21 -11.169  -5.802  -4.031
  169   2HG   GLU  21          1HG       GLU  21 -11.234  -4.063  -4.321
  170    H    LYS  22           H        LYS  22 -10.201  -7.256  -8.526
  171    HA   LYS  22           HA       LYS  22 -12.736  -7.388 -10.073
  172   1HB   LYS  22          2HB       LYS  22 -10.607  -6.297 -10.995
  173   2HB   LYS  22          1HB       LYS  22  -9.946  -7.929 -11.112
  174   1HG   LYS  22          2HG       LYS  22 -12.310  -8.364 -12.310
  175   2HG   LYS  22          1HG       LYS  22 -12.128  -6.652 -12.691
  176   1HD   LYS  22          2HD       LYS  22  -9.913  -7.086 -13.666
  177   2HD   LYS  22          1HD       LYS  22 -10.058  -8.796 -13.257
  178   1HE   LYS  22          2HE       LYS  22 -11.560  -9.213 -14.941
  179   2HE   LYS  22          1HE       LYS  22 -12.292  -7.613 -14.826
  180   1HZ   LYS  22          1HZ       LYS  22  -9.597  -8.148 -15.946
  181   2HZ   LYS  22          2HZ       LYS  22 -10.419  -6.662 -15.942
  182   3HZ   LYS  22          3HZ       LYS  22 -10.998  -7.955 -16.880
  183    H    GLY  23           H        GLY  23  -9.848  -9.450  -9.587
  184   1HA   GLY  23          2HA       GLY  23 -11.059 -11.764  -8.679
  185   2HA   GLY  23          1HA       GLY  23 -11.290 -11.838 -10.426
  186    H    GLY  24           H        GLY  24  -8.579 -10.818  -8.307
  187   1HA   GLY  24          1HA       GLY  24  -6.290 -11.309  -8.475
  188   2HA   GLY  24          2HA       GLY  24  -6.841 -12.957  -8.787
  189    H    LYS  25           H        LYS  25  -7.886 -10.511 -11.005
  190    HA   LYS  25           HA       LYS  25  -6.088 -11.690 -13.062
  191   1HB   LYS  25          2HB       LYS  25  -8.675 -11.528 -13.305
  192   2HB   LYS  25          1HB       LYS  25  -8.381  -9.818 -13.627
  193   1HG   LYS  25          2HG       LYS  25  -7.302 -10.235 -15.626
  194   2HG   LYS  25          1HG       LYS  25  -6.718 -11.815 -15.103
  195   1HD   LYS  25          2HD       LYS  25  -8.380 -12.623 -16.428
  196   2HD   LYS  25          1HD       LYS  25  -9.429 -12.206 -15.073
  197   1HE   LYS  25          2HE       LYS  25 -10.426 -10.553 -16.241
  198   2HE   LYS  25          1HE       LYS  25  -8.874  -9.891 -16.752
  199   1HZ   LYS  25          1HZ       LYS  25  -9.274 -10.713 -18.753
  200   2HZ   LYS  25          2HZ       LYS  25 -10.697 -11.471 -18.219
  201   3HZ   LYS  25          3HZ       LYS  25  -9.208 -12.281 -18.111
  202    H    HIS  26           H        HIS  26  -4.233 -10.401 -12.325
  203    HA   HIS  26           HA       HIS  26  -4.427  -7.483 -12.475
  204   1HB   HIS  26          2HB       HIS  26  -1.786  -7.809 -12.410
  205   2HB   HIS  26          1HB       HIS  26  -2.764  -8.005 -10.960
  206    HD1  HIS  26           HD1      HIS  26  -2.491 -10.547 -13.767
  207    HD2  HIS  26           HD2      HIS  26  -1.336 -10.100  -9.787
  208    HE1  HIS  26           HE1      HIS  26  -1.570 -12.789 -13.032
  209    H    LYS  27           H        LYS  27  -3.426  -6.170 -14.095
  210    HA   LYS  27           HA       LYS  27  -2.632  -7.584 -16.566
  211   1HB   LYS  27          2HB       LYS  27  -4.683  -5.412 -16.205
  212   2HB   LYS  27          1HB       LYS  27  -3.858  -5.632 -17.743
  213   1HG   LYS  27          2HG       LYS  27  -4.720  -8.194 -16.778
  214   2HG   LYS  27          1HG       LYS  27  -6.089  -7.083 -16.757
  215   1HD   LYS  27          2HD       LYS  27  -5.957  -6.673 -19.065
  216   2HD   LYS  27          1HD       LYS  27  -4.282  -7.220 -19.160
  217   1HE   LYS  27          2HE       LYS  27  -5.409  -9.498 -18.287
  218   2HE   LYS  27          1HE       LYS  27  -6.796  -8.815 -19.135
  219   1HZ   LYS  27          1HZ       LYS  27  -4.155  -8.854 -20.430
  220   2HZ   LYS  27          2HZ       LYS  27  -5.698  -8.837 -21.139
  221   3HZ   LYS  27          3HZ       LYS  27  -5.106 -10.257 -20.419
  222    H    THR  28           H        THR  28  -3.093  -4.120 -16.088
  223    HA   THR  28           HA       THR  28  -0.316  -3.635 -16.890
  224    HB   THR  28           HB       THR  28  -2.554  -1.757 -16.081
  225    HG1  THR  28           HG1      THR  28  -2.799  -2.860 -18.070
  226   1HG2  THR  28          1HG2      THR  28   0.173  -1.139 -17.251
  227   2HG2  THR  28          2HG2      THR  28  -0.328  -0.800 -15.594
  228   3HG2  THR  28          3HG2      THR  28  -1.107   0.033 -16.940
  229    H    GLY  29           H        GLY  29  -2.013  -4.069 -13.950
  230   1HA   GLY  29          2HA       GLY  29   0.378  -3.082 -12.463
  231   2HA   GLY  29          1HA       GLY  29  -1.240  -2.697 -11.892
  232    HA   PRO  30           HA       PRO  30   0.333  -7.068 -10.600
  233   1HB   PRO  30          2HB       PRO  30   1.448  -6.430  -8.178
  234   2HB   PRO  30          1HB       PRO  30   2.369  -6.586  -9.677
  235   1HG   PRO  30          2HG       PRO  30   1.461  -4.090  -8.276
  236   2HG   PRO  30          1HG       PRO  30   2.956  -4.387  -9.185
  237   1HD   PRO  30          2HD       PRO  30   0.812  -3.008 -10.241
  238   2HD   PRO  30          1HD       PRO  30   1.976  -3.920 -11.222
  239    H    ASN  31           H        ASN  31  -1.239  -8.208  -9.628
  240    HA   ASN  31           HA       ASN  31  -3.580  -7.075  -8.574
  241   1HB   ASN  31          2HB       ASN  31  -3.304  -9.458  -9.317
  242   2HB   ASN  31          1HB       ASN  31  -2.444  -9.777  -7.809
  243   1HD2  ASN  31          1HD2      ASN  31  -5.412  -7.818  -8.465
  244   2HD2  ASN  31          2HD2      ASN  31  -6.382  -8.656  -7.354
  245    H    LEU  32           H        LEU  32  -3.417  -5.599  -6.938
  246    HA   LEU  32           HA       LEU  32  -1.668  -6.035  -4.649
  247   1HB   LEU  32          2HB       LEU  32  -3.324  -3.856  -5.721
  248   2HB   LEU  32          1HB       LEU  32  -3.325  -3.945  -3.962
  249    HG   LEU  32           HG       LEU  32  -1.046  -3.509  -3.799
  250   1HD1  LEU  32          1HD1      LEU  32  -0.941  -4.973  -6.370
  251   2HD1  LEU  32          2HD1      LEU  32   0.174  -5.016  -5.006
  252   3HD1  LEU  32          3HD1      LEU  32   0.264  -3.701  -6.178
  253   1HD2  LEU  32          1HD2      LEU  32  -1.709  -1.449  -4.611
  254   2HD2  LEU  32          2HD2      LEU  32  -2.268  -2.117  -6.146
  255   3HD2  LEU  32          3HD2      LEU  32  -0.542  -1.887  -5.859
  256    H    HIS  33           H        HIS  33  -3.539  -8.155  -4.881
  257    HA   HIS  33           HA       HIS  33  -5.677  -7.614  -2.923
  258   1HB   HIS  33          2HB       HIS  33  -5.810  -9.160  -5.041
  259   2HB   HIS  33          1HB       HIS  33  -5.008 -10.341  -4.005
  260    HD1  HIS  33           HD1      HIS  33  -6.281 -10.316  -1.423
  261    HD2  HIS  33           HD2      HIS  33  -8.535  -9.461  -4.824
  262    HE1  HIS  33           HE1      HIS  33  -8.703 -10.707  -0.794
  263    H    GLY  34           H        GLY  34  -3.500  -7.114  -1.548
  264   1HA   GLY  34          2HA       GLY  34  -3.193  -8.155   0.765
  265   2HA   GLY  34          1HA       GLY  34  -2.803  -9.639  -0.105
  266    H    LEU  35           H        LEU  35  -1.743  -6.590  -1.427
  267    HA   LEU  35           HA       LEU  35   0.974  -7.347  -1.583
  268   1HB   LEU  35          2HB       LEU  35   0.034  -5.503  -2.912
  269   2HB   LEU  35          1HB       LEU  35  -0.193  -4.552  -1.444
  270    HG   LEU  35           HG       LEU  35   2.481  -5.354  -1.334
  271   1HD1  LEU  35          1HD1      LEU  35   1.861  -4.327  -4.115
  272   2HD1  LEU  35          2HD1      LEU  35   2.190  -6.022  -3.755
  273   3HD1  LEU  35          3HD1      LEU  35   3.435  -4.803  -3.478
  274   1HD2  LEU  35          1HD2      LEU  35   2.194  -3.195  -0.636
  275   2HD2  LEU  35          2HD2      LEU  35   0.928  -2.875  -1.820
  276   3HD2  LEU  35          3HD2      LEU  35   2.622  -2.813  -2.303
  277    H    PHE  36           H        PHE  36  -0.867  -6.100   1.073
  278    HA   PHE  36           HA       PHE  36   1.341  -5.043   2.611
  279   1HB   PHE  36          2HB       PHE  36  -1.473  -5.903   3.270
  280   2HB   PHE  36          1HB       PHE  36  -0.349  -5.427   4.543
  281    HD1  PHE  36           HD1      PHE  36  -1.547  -4.240   1.186
  282    HD2  PHE  36           HD2      PHE  36  -0.242  -3.176   5.138
  283    HE1  PHE  36           HE1      PHE  36  -1.998  -1.852   0.692
  284    HE2  PHE  36           HE2      PHE  36  -0.693  -0.788   4.642
  285    HZ   PHE  36           HZ       PHE  36  -1.571  -0.127   2.421
  286    H    GLY  37           H        GLY  37   2.750  -6.112   3.940
  287   1HA   GLY  37          2HA       GLY  37   3.765  -7.877   5.109
  288   2HA   GLY  37          1HA       GLY  37   2.188  -8.664   5.151
  289    H    ARG  38           H        ARG  38   3.074  -7.827   1.989
  290    HA   ARG  38           HA       ARG  38   4.153 -10.580   1.528
  291   1HB   ARG  38          2HB       ARG  38   1.822 -10.371   0.714
  292   2HB   ARG  38          1HB       ARG  38   2.302  -8.997  -0.284
  293   1HG   ARG  38          2HG       ARG  38   4.001 -10.513  -1.388
  294   2HG   ARG  38          1HG       ARG  38   3.257 -11.860  -0.527
  295   1HD   ARG  38          2HD       ARG  38   2.311 -11.669  -2.787
  296   2HD   ARG  38          1HD       ARG  38   1.078 -11.315  -1.575
  297    HE   ARG  38           HE       ARG  38   0.907  -9.206  -2.590
  298   1HH1  ARG  38          1HH1      ARG  38   2.741 -10.178  -4.844
  299   2HH1  ARG  38          2HH1      ARG  38   3.950  -8.937  -4.839
  300   1HH2  ARG  38          1HH2      ARG  38   3.056  -7.713  -1.719
  301   2HH2  ARG  38          2HH2      ARG  38   4.129  -7.542  -3.069
  302    H    LYS  39           H        LYS  39   6.194 -10.478   0.742
  303    HA   LYS  39           HA       LYS  39   7.430  -8.032  -0.101
  304   1HB   LYS  39          2HB       LYS  39   9.269  -9.549  -0.910
  305   2HB   LYS  39          1HB       LYS  39   8.791  -9.848   0.762
  306   1HG   LYS  39          2HG       LYS  39   7.093 -11.430  -0.874
  307   2HG   LYS  39          1HG       LYS  39   8.740 -11.666  -1.463
  308   1HD   LYS  39          2HD       LYS  39   9.473 -12.116   0.879
  309   2HD   LYS  39          1HD       LYS  39   7.792 -11.990   1.400
  310   1HE   LYS  39          2HE       LYS  39   8.769 -13.943  -0.702
  311   2HE   LYS  39          1HE       LYS  39   8.542 -14.355   0.997
  312   1HZ   LYS  39          1HZ       LYS  39   6.604 -14.924  -0.342
  313   2HZ   LYS  39          2HZ       LYS  39   6.435 -13.300  -0.811
  314   3HZ   LYS  39          3HZ       LYS  39   6.224 -13.745   0.816
  315    H    THR  40           H        THR  40   8.298  -7.638  -2.320
  316    HA   THR  40           HA       THR  40   6.225  -7.853  -4.304
  317    HB   THR  40           HB       THR  40   7.603  -5.987  -4.621
  318    HG1  THR  40           HG1      THR  40   9.085  -7.580  -6.335
  319   1HG2  THR  40          1HG2      THR  40   9.437  -6.317  -3.225
  320   2HG2  THR  40          2HG2      THR  40  10.181  -6.419  -4.819
  321   3HG2  THR  40          3HG2      THR  40   9.811  -7.892  -3.925
  322    H    GLY  41           H        GLY  41   6.932  -8.707  -6.616
  323   1HA   GLY  41          2HA       GLY  41   7.372 -10.576  -7.949
  324   2HA   GLY  41          1HA       GLY  41   8.708 -10.912  -6.851
  325    H    GLN  42           H        GLN  42   5.414 -11.716  -7.676
  326    HA   GLN  42           HA       GLN  42   5.616 -14.147  -6.051
  327   1HB   GLN  42          2HB       GLN  42   4.391 -11.883  -4.912
  328   2HB   GLN  42          1HB       GLN  42   3.068 -12.935  -5.417
  329   1HG   GLN  42          2HG       GLN  42   3.899 -13.420  -3.095
  330   2HG   GLN  42          1HG       GLN  42   4.006 -14.803  -4.186
  331   1HE2  GLN  42          1HE2      GLN  42   5.983 -12.138  -2.813
  332   2HE2  GLN  42          2HE2      GLN  42   7.463 -12.953  -2.959
  333    H    ALA  43           H        ALA  43   3.097 -12.152  -7.663
  334    HA   ALA  43           HA       ALA  43   1.500 -14.269  -8.578
  335   1HB   ALA  43          1HB       ALA  43   0.578 -12.729 -10.175
  336   2HB   ALA  43          2HB       ALA  43   2.047 -11.754 -10.171
  337   3HB   ALA  43          3HB       ALA  43   1.006 -11.787  -8.748
  338    HA   PRO  44           HA       PRO  44   4.259 -16.147 -11.531
  339   1HB   PRO  44          2HB       PRO  44   2.506 -18.107 -12.323
  340   2HB   PRO  44          1HB       PRO  44   3.425 -18.174 -10.809
  341   1HG   PRO  44          2HG       PRO  44   0.531 -17.594 -11.222
  342   2HG   PRO  44          1HG       PRO  44   1.350 -18.265  -9.801
  343   1HD   PRO  44          2HD       PRO  44   0.475 -15.584 -10.112
  344   2HD   PRO  44          1HD       PRO  44   1.552 -16.196  -8.838
  345    H    GLY  45           H        GLY  45   4.495 -16.017 -13.803
  346   1HA   GLY  45          2HA       GLY  45   3.802 -15.678 -16.062
  347   2HA   GLY  45          1HA       GLY  45   2.149 -15.435 -15.490
  348    H    TYR  46           H        TYR  46   2.480 -13.446 -13.628
  349    HA   TYR  46           HA       TYR  46   2.942 -11.101 -15.323
  350   1HB   TYR  46          2HB       TYR  46   1.074 -11.294 -13.650
  351   2HB   TYR  46          1HB       TYR  46   2.274 -11.283 -12.368
  352    HD1  TYR  46           HD1      TYR  46   3.937  -9.118 -14.312
  353    HD2  TYR  46           HD2      TYR  46   0.110  -9.325 -12.416
  354    HE1  TYR  46           HE1      TYR  46   3.855  -6.672 -14.260
  355    HE2  TYR  46           HE2      TYR  46   0.050  -6.861 -12.353
  356    HH   TYR  46           HH       TYR  46   1.908  -4.913 -14.182
  357    H    SER  47           H        SER  47   5.015 -10.411 -15.595
  358    HA   SER  47           HA       SER  47   7.107 -11.005 -13.641
  359   1HB   SER  47          2HB       SER  47   7.014 -10.231 -16.368
  360   2HB   SER  47          1HB       SER  47   7.832  -8.927 -15.513
  361    HG   SER  47           HG       SER  47   9.328 -10.503 -16.081
  362    H    TYR  48           H        TYR  48   5.922  -9.929 -11.837
  363    HA   TYR  48           HA       TYR  48   5.111  -7.286 -11.606
  364   1HB   TYR  48          2HB       TYR  48   6.340  -9.267  -9.778
  365   2HB   TYR  48          1HB       TYR  48   6.354  -7.602  -9.227
  366    HD1  TYR  48           HD1      TYR  48   3.734  -9.159 -11.362
  367    HD2  TYR  48           HD2      TYR  48   4.830  -7.778  -7.461
  368    HE1  TYR  48           HE1      TYR  48   1.390  -9.440 -10.600
  369    HE2  TYR  48           HE2      TYR  48   2.484  -8.050  -6.694
  370    HH   TYR  48           HH       TYR  48   0.325  -8.320  -7.448
  371    H    THR  49           H        THR  49   6.497  -5.583 -10.225
  372    HA   THR  49           HA       THR  49   8.630  -4.662 -11.873
  373    HB   THR  49           HB       THR  49   9.144  -3.532  -9.399
  374    HG1  THR  49           HG1      THR  49   7.505  -4.286  -8.272
  375   1HG2  THR  49          1HG2      THR  49   8.852  -1.903 -10.945
  376   2HG2  THR  49          2HG2      THR  49   7.164  -1.929 -10.433
  377   3HG2  THR  49          3HG2      THR  49   7.670  -2.849 -11.849
  378    H    ALA  50           H        ALA  50  10.037  -6.503 -12.129
  379    HA   ALA  50           HA       ALA  50  11.220  -8.074 -10.163
  380   1HB   ALA  50          1HB       ALA  50  11.820  -8.654 -12.354
  381   2HB   ALA  50          2HB       ALA  50  13.312  -7.941 -11.740
  382   3HB   ALA  50          3HB       ALA  50  12.246  -6.997 -12.779
  383    H    ALA  51           H        ALA  51  12.171  -4.795 -11.183
  384    HA   ALA  51           HA       ALA  51  14.529  -4.471  -9.726
  385   1HB   ALA  51          1HB       ALA  51  13.740  -2.657 -11.093
  386   2HB   ALA  51          2HB       ALA  51  13.789  -2.059  -9.434
  387   3HB   ALA  51          3HB       ALA  51  12.250  -2.525 -10.160
  388    H    ASN  52           H        ASN  52  11.356  -3.391  -8.433
  389    HA   ASN  52           HA       ASN  52  11.981  -3.045  -5.782
  390   1HB   ASN  52          2HB       ASN  52   9.613  -3.523  -7.264
  391   2HB   ASN  52          1HB       ASN  52   9.572  -4.625  -5.888
  392   1HD2  ASN  52          1HD2      ASN  52  11.077  -2.931  -4.054
  393   2HD2  ASN  52          2HD2      ASN  52  10.092  -1.603  -3.674
  394    H    LYS  53           H        LYS  53  11.222  -6.190  -7.298
  395    HA   LYS  53           HA       LYS  53  11.369  -7.869  -5.085
  396   1HB   LYS  53          2HB       LYS  53  11.383  -8.202  -7.862
  397   2HB   LYS  53          1HB       LYS  53  12.852  -9.009  -7.311
  398   1HG   LYS  53          2HG       LYS  53  11.360 -10.086  -5.501
  399   2HG   LYS  53          1HG       LYS  53   9.999  -9.550  -6.487
  400   1HD   LYS  53          2HD       LYS  53  10.347 -11.647  -7.403
  401   2HD   LYS  53          1HD       LYS  53  11.408 -10.687  -8.434
  402   1HE   LYS  53          2HE       LYS  53  13.234 -11.178  -6.659
  403   2HE   LYS  53          1HE       LYS  53  12.151 -12.456  -6.107
  404   1HZ   LYS  53          1HZ       LYS  53  12.492 -13.671  -7.956
  405   2HZ   LYS  53          2HZ       LYS  53  13.947 -12.797  -8.027
  406   3HZ   LYS  53          3HZ       LYS  53  12.621 -12.319  -8.972
  407    H    ASN  54           H        ASN  54  14.179  -7.126  -7.190
  408    HA   ASN  54           HA       ASN  54  16.080  -8.275  -5.401
  409   1HB   ASN  54          2HB       ASN  54  16.703  -7.931  -7.701
  410   2HB   ASN  54          1HB       ASN  54  16.380  -6.201  -7.584
  411   1HD2  ASN  54          1HD2      ASN  54  18.527  -5.431  -7.947
  412   2HD2  ASN  54          2HD2      ASN  54  19.824  -5.778  -6.908
  413    H    LYS  55           H        LYS  55  14.446  -5.222  -5.352
  414    HA   LYS  55           HA       LYS  55  16.367  -3.709  -3.880
  415   1HB   LYS  55          2HB       LYS  55  14.273  -2.819  -4.994
  416   2HB   LYS  55          1HB       LYS  55  13.359  -3.481  -3.639
  417   1HG   LYS  55          2HG       LYS  55  13.763  -1.260  -2.972
  418   2HG   LYS  55          1HG       LYS  55  15.040  -2.162  -2.155
  419   1HD   LYS  55          2HD       LYS  55  16.062  -1.559  -4.709
  420   2HD   LYS  55          1HD       LYS  55  15.281  -0.080  -4.149
  421   1HE   LYS  55          2HE       LYS  55  16.535  -0.751  -1.876
  422   2HE   LYS  55          1HE       LYS  55  17.630  -1.527  -3.020
  423   1HZ   LYS  55          1HZ       LYS  55  18.418   0.429  -3.665
  424   2HZ   LYS  55          2HZ       LYS  55  17.607   1.118  -2.340
  425   3HZ   LYS  55          3HZ       LYS  55  16.867   1.087  -3.870
  426    H    GLY  56           H        GLY  56  14.667  -6.496  -2.971
  427   1HA   GLY  56          1HA       GLY  56  14.290  -7.511  -0.882
  428   2HA   GLY  56          2HA       GLY  56  15.737  -6.637  -0.373
  429    H    ILE  57           H        ILE  57  12.459  -5.601  -1.337
  430    HA   ILE  57           HA       ILE  57  12.381  -3.964   1.168
  431    HB   ILE  57           HB       ILE  57  12.365  -2.852  -1.175
  432   1HG1  ILE  57          2HG1      ILE  57  11.765  -1.740   0.988
  433   2HG1  ILE  57          1HG1      ILE  57  10.867  -1.108  -0.392
  434   1HG2  ILE  57          1HG2      ILE  57  10.747  -4.294  -2.267
  435   2HG2  ILE  57          2HG2      ILE  57  10.052  -2.679  -2.131
  436   3HG2  ILE  57          3HG2      ILE  57   9.543  -3.951  -1.024
  437   1HD1  ILE  57          1HD1      ILE  57   9.891  -2.600   1.954
  438   2HD1  ILE  57          2HD1      ILE  57   9.240  -3.160   0.415
  439   3HD1  ILE  57          3HD1      ILE  57   9.037  -1.477   0.899
  440    H    ILE  58           H        ILE  58  10.680  -4.262   2.563
  441    HA   ILE  58           HA       ILE  58   8.690  -6.359   1.838
  442    HB   ILE  58           HB       ILE  58  10.049  -6.453   4.013
  443   1HG1  ILE  58          2HG1      ILE  58   7.915  -7.703   3.589
  444   2HG1  ILE  58          1HG1      ILE  58   8.155  -7.292   5.287
  445   1HG2  ILE  58          1HG2      ILE  58   9.554  -4.971   5.773
  446   2HG2  ILE  58          2HG2      ILE  58   8.067  -4.412   5.006
  447   3HG2  ILE  58          3HG2      ILE  58   9.632  -3.912   4.364
  448   1HD1  ILE  58          1HD1      ILE  58   5.958  -6.609   5.007
  449   2HD1  ILE  58          2HD1      ILE  58   6.203  -6.159   3.320
  450   3HD1  ILE  58          3HD1      ILE  58   6.802  -5.113   4.607
  451    H    TRP  59           H        TRP  59   6.843  -5.548   0.976
  452    HA   TRP  59           HA       TRP  59   6.100  -2.846   0.935
  453   1HB   TRP  59          2HB       TRP  59   4.457  -5.359   0.645
  454   2HB   TRP  59          1HB       TRP  59   3.765  -3.749   0.429
  455    HD1  TRP  59           HD1      TRP  59   4.847  -6.281  -1.707
  456    HE1  TRP  59           HE1      TRP  59   6.010  -5.419  -3.838
  457    HE3  TRP  59           HE3      TRP  59   5.876  -1.486  -0.279
  458    HZ2  TRP  59           HZ2      TRP  59   7.216  -3.016  -4.806
  459    HZ3  TRP  59           HZ3      TRP  59   7.032   0.066  -1.822
  460    HH2  TRP  59           HH2      TRP  59   7.703  -0.692  -4.087
  461    H    GLY  60           H        GLY  60   5.819  -1.622   2.684
  462   1HA   GLY  60          1HA       GLY  60   3.904  -2.574   4.766
  463   2HA   GLY  60          2HA       GLY  60   5.419  -1.799   5.237
  464    H    GLU  61           H        GLU  61   3.913  -0.175   6.263
  465    HA   GLU  61           HA       GLU  61   2.289   1.501   4.527
  466   1HB   GLU  61          2HB       GLU  61   3.275   2.118   7.326
  467   2HB   GLU  61          1HB       GLU  61   1.892   2.841   6.501
  468   1HG   GLU  61          2HG       GLU  61   0.794   0.626   6.410
  469   2HG   GLU  61          1HG       GLU  61   2.165  -0.082   7.264
  470    H    ASP  62           H        ASP  62   5.188   2.311   6.487
  471    HA   ASP  62           HA       ASP  62   5.684   4.754   5.091
  472   1HB   ASP  62          2HB       ASP  62   6.764   3.432   7.310
  473   2HB   ASP  62          1HB       ASP  62   8.100   3.550   6.164
  474    H    THR  63           H        THR  63   6.918   1.456   4.631
  475    HA   THR  63           HA       THR  63   8.904   2.060   2.698
  476    HB   THR  63           HB       THR  63   7.833  -0.409   1.926
  477    HG1  THR  63           HG1      THR  63   7.839  -0.298   4.737
  478   1HG2  THR  63          1HG2      THR  63  10.167  -0.144   2.181
  479   2HG2  THR  63          2HG2      THR  63   9.715  -1.251   3.477
  480   3HG2  THR  63          3HG2      THR  63  10.006   0.452   3.832
  481    H    LEU  64           H        LEU  64   5.411   1.516   2.331
  482    HA   LEU  64           HA       LEU  64   5.525   1.651  -0.577
  483   1HB   LEU  64          2HB       LEU  64   3.588   0.961   1.366
  484   2HB   LEU  64          1HB       LEU  64   2.928   2.330   0.473
  485    HG   LEU  64           HG       LEU  64   4.021  -0.228  -0.735
  486   1HD1  LEU  64          1HD1      LEU  64   1.720  -0.229   0.404
  487   2HD1  LEU  64          2HD1      LEU  64   1.765  -0.752  -1.279
  488   3HD1  LEU  64          3HD1      LEU  64   1.210   0.873  -0.874
  489   1HD2  LEU  64          1HD2      LEU  64   2.530   1.431  -2.548
  490   2HD2  LEU  64          2HD2      LEU  64   4.207   0.905  -2.675
  491   3HD2  LEU  64          3HD2      LEU  64   3.813   2.396  -1.821
  492    H    MET  65           H        MET  65   4.990   3.949   2.046
  493    HA   MET  65           HA       MET  65   3.910   6.103   0.579
  494   1HB   MET  65          2HB       MET  65   4.380   5.889   3.121
  495   2HB   MET  65          1HB       MET  65   5.988   6.498   2.728
  496   1HG   MET  65          2HG       MET  65   4.482   8.285   1.365
  497   2HG   MET  65          1HG       MET  65   3.368   7.897   2.676
  498   1HE   MET  65          1HE       MET  65   3.792  10.684   4.037
  499   2HE   MET  65          2HE       MET  65   3.857  10.392   2.301
  500   3HE   MET  65          3HE       MET  65   5.146  11.306   3.083
  501    H    GLU  66           H        GLU  66   7.285   5.072   0.957
  502    HA   GLU  66           HA       GLU  66   8.343   7.309  -0.542
  503   1HB   GLU  66          2HB       GLU  66   9.554   5.778   1.178
  504   2HB   GLU  66          1HB       GLU  66   9.772   4.684  -0.189
  505   1HG   GLU  66          2HG       GLU  66  11.265   6.067  -1.232
  506   2HG   GLU  66          1HG       GLU  66  10.442   7.530  -0.692
  507    H    TYR  67           H        TYR  67   7.804   3.852  -1.307
  508    HA   TYR  67           HA       TYR  67   8.710   3.972  -4.000
  509   1HB   TYR  67          2HB       TYR  67   8.289   1.828  -2.923
  510   2HB   TYR  67          1HB       TYR  67   6.577   2.216  -2.748
  511    HD1  TYR  67           HD1      TYR  67   5.135   2.452  -4.783
  512    HD2  TYR  67           HD2      TYR  67   9.180   1.032  -5.009
  513    HE1  TYR  67           HE1      TYR  67   4.691   1.557  -7.050
  514    HE2  TYR  67           HE2      TYR  67   8.737   0.137  -7.279
  515    HH   TYR  67           HH       TYR  67   6.728   0.949  -9.213
  516    H    LEU  68           H        LEU  68   5.867   5.275  -2.544
  517    HA   LEU  68           HA       LEU  68   4.452   5.439  -5.137
  518   1HB   LEU  68          2HB       LEU  68   3.677   5.490  -2.365
  519   2HB   LEU  68          1HB       LEU  68   3.097   6.953  -3.164
  520    HG   LEU  68           HG       LEU  68   2.070   5.595  -4.937
  521   1HD1  LEU  68          1HD1      LEU  68   2.345   3.037  -3.529
  522   2HD1  LEU  68          2HD1      LEU  68   3.883   3.663  -4.121
  523   3HD1  LEU  68          3HD1      LEU  68   2.548   3.401  -5.243
  524   1HD2  LEU  68          1HD2      LEU  68   1.168   5.899  -2.355
  525   2HD2  LEU  68          2HD2      LEU  68   1.041   4.154  -2.579
  526   3HD2  LEU  68          3HD2      LEU  68   0.204   5.248  -3.681
  527    H    GLU  69           H        GLU  69   6.028   7.556  -2.769
  528    HA   GLU  69           HA       GLU  69   5.372  10.041  -3.982
  529   1HB   GLU  69          2HB       GLU  69   6.679   9.362  -1.755
  530   2HB   GLU  69          1HB       GLU  69   8.075   9.615  -2.792
  531   1HG   GLU  69          2HG       GLU  69   6.375  11.788  -3.324
  532   2HG   GLU  69          1HG       GLU  69   6.329  11.588  -1.573
  533    H    ASN  70           H        ASN  70   7.480   7.478  -4.848
  534    HA   ASN  70           HA       ASN  70   8.003   8.544  -7.467
  535   1HB   ASN  70          2HB       ASN  70  10.024   8.985  -5.320
  536   2HB   ASN  70          1HB       ASN  70  10.627   8.442  -6.886
  537   1HD2  ASN  70          1HD2      ASN  70  10.017  11.229  -5.186
  538   2HD2  ASN  70          2HD2      ASN  70   9.710  12.287  -6.478
  539    HA   PRO  71           HA       PRO  71   8.396   4.039  -7.076
  540   1HB   PRO  71          2HB       PRO  71   7.106   3.545  -9.465
  541   2HB   PRO  71          1HB       PRO  71   6.264   3.750  -7.922
  542   1HG   PRO  71          2HG       PRO  71   6.466   5.641 -10.212
  543   2HG   PRO  71          1HG       PRO  71   5.220   5.524  -8.961
  544   1HD   PRO  71          2HD       PRO  71   7.308   7.436  -9.048
  545   2HD   PRO  71          1HD       PRO  71   6.253   7.103  -7.660
  546    H    LYS  72           H        LYS  72   9.110   6.202  -9.767
  547    HA   LYS  72           HA       LYS  72  10.871   4.288 -11.083
  548   1HB   LYS  72          2HB       LYS  72   9.613   5.977 -12.385
  549   2HB   LYS  72          1HB       LYS  72  10.500   7.258 -11.560
  550   1HG   LYS  72          2HG       LYS  72  12.396   6.908 -12.779
  551   2HG   LYS  72          1HG       LYS  72  12.181   5.157 -12.794
  552   1HD   LYS  72          2HD       LYS  72  11.521   5.383 -14.943
  553   2HD   LYS  72          1HD       LYS  72  10.040   6.097 -14.306
  554   1HE   LYS  72          2HE       LYS  72  10.622   7.950 -15.468
  555   2HE   LYS  72          1HE       LYS  72  11.825   8.208 -14.204
  556   1HZ   LYS  72          1HZ       LYS  72  12.635   8.160 -16.594
  557   2HZ   LYS  72          2HZ       LYS  72  12.373   6.481 -16.540
  558   3HZ   LYS  72          3HZ       LYS  72  13.482   7.207 -15.476
  559    H    LYS  73           H        LYS  73  11.156   6.866  -8.734
  560    HA   LYS  73           HA       LYS  73  14.064   7.062  -9.033
  561   1HB   LYS  73          2HB       LYS  73  13.875   8.926  -7.749
  562   2HB   LYS  73          1HB       LYS  73  12.143   8.747  -8.005
  563   1HG   LYS  73          2HG       LYS  73  11.914   7.523  -5.908
  564   2HG   LYS  73          1HG       LYS  73  13.662   7.526  -5.679
  565   1HD   LYS  73          2HD       LYS  73  13.566  10.057  -5.702
  566   2HD   LYS  73          1HD       LYS  73  11.809   9.921  -5.658
  567   1HE   LYS  73          2HE       LYS  73  11.813   9.455  -3.451
  568   2HE   LYS  73          1HE       LYS  73  13.061   8.225  -3.651
  569   1HZ   LYS  73          1HZ       LYS  73  13.460  11.153  -3.385
  570   2HZ   LYS  73          2HZ       LYS  73  14.699  10.060  -3.783
  571   3HZ   LYS  73          3HZ       LYS  73  13.919   9.953  -2.278
  572    H    TYR  74           H        TYR  74  11.807   5.619  -6.684
  573    HA   TYR  74           HA       TYR  74  13.922   4.535  -5.025
  574   1HB   TYR  74          2HB       TYR  74  11.672   4.910  -4.116
  575   2HB   TYR  74          1HB       TYR  74  10.993   3.775  -5.281
  576    HD1  TYR  74           HD1      TYR  74  10.070   2.439  -3.384
  577    HD2  TYR  74           HD2      TYR  74  14.292   3.056  -3.892
  578    HE1  TYR  74           HE1      TYR  74  10.532   0.569  -1.825
  579    HE2  TYR  74           HE2      TYR  74  14.751   1.183  -2.333
  580    HH   TYR  74           HH       TYR  74  12.570  -0.050  -0.252
  581    H    ILE  75           H        ILE  75  11.502   2.803  -7.021
  582    HA   ILE  75           HA       ILE  75  13.480   0.657  -7.431
  583    HB   ILE  75           HB       ILE  75  10.560   0.750  -8.201
  584   1HG1  ILE  75          2HG1      ILE  75  10.863   1.184  -5.779
  585   2HG1  ILE  75          1HG1      ILE  75  10.150  -0.403  -6.065
  586   1HG2  ILE  75          1HG2      ILE  75  10.764  -1.582  -8.424
  587   2HG2  ILE  75          2HG2      ILE  75  12.274  -1.622  -7.512
  588   3HG2  ILE  75          3HG2      ILE  75  12.243  -0.951  -9.143
  589   1HD1  ILE  75          1HD1      ILE  75  12.995   0.258  -5.313
  590   2HD1  ILE  75          2HD1      ILE  75  12.561  -1.301  -6.013
  591   3HD1  ILE  75          3HD1      ILE  75  11.864  -0.801  -4.473
  592    HA   PRO  76           HA       PRO  76  13.934   2.577 -11.493
  593   1HB   PRO  76          2HB       PRO  76  16.307   1.310 -12.051
  594   2HB   PRO  76          1HB       PRO  76  16.196   2.783 -11.070
  595   1HG   PRO  76          2HG       PRO  76  16.700  -0.020 -10.191
  596   2HG   PRO  76          1HG       PRO  76  17.174   1.501  -9.418
  597   1HD   PRO  76          2HD       PRO  76  15.001  -0.151  -8.651
  598   2HD   PRO  76          1HD       PRO  76  15.302   1.510  -8.096
  599    H    GLY  77           H        GLY  77  11.993   0.872 -11.722
  600   1HA   GLY  77          2HA       GLY  77  12.669  -0.833 -13.972
  601   2HA   GLY  77          1HA       GLY  77  12.286  -1.764 -12.525
  602    H    THR  78           H        THR  78  10.223  -0.278 -11.399
  603    HA   THR  78           HA       THR  78   7.945  -1.147 -12.752
  604    HB   THR  78           HB       THR  78   8.036  -0.096 -10.417
  605    HG1  THR  78           HG1      THR  78   6.124  -0.475 -11.984
  606   1HG2  THR  78          1HG2      THR  78   8.187   2.167 -10.146
  607   2HG2  THR  78          2HG2      THR  78   7.277   2.504 -11.618
  608   3HG2  THR  78          3HG2      THR  78   8.992   2.101 -11.715
  609    H    LYS  79           H        LYS  79   6.251   0.258 -13.807
  610    HA   LYS  79           HA       LYS  79   7.467   2.383 -15.501
  611   1HB   LYS  79          2HB       LYS  79   5.586   0.243 -16.541
  612   2HB   LYS  79          1HB       LYS  79   6.416   1.482 -17.485
  613   1HG   LYS  79          2HG       LYS  79   8.043  -0.399 -15.808
  614   2HG   LYS  79          1HG       LYS  79   7.408  -0.961 -17.355
  615   1HD   LYS  79          2HD       LYS  79   8.462   1.633 -17.806
  616   2HD   LYS  79          1HD       LYS  79   9.667   0.752 -16.864
  617   1HE   LYS  79          2HE       LYS  79   8.493  -0.918 -18.945
  618   2HE   LYS  79          1HE       LYS  79   9.249   0.528 -19.615
  619   1HZ   LYS  79          1HZ       LYS  79  10.472  -1.775 -18.499
  620   2HZ   LYS  79          2HZ       LYS  79  10.965  -0.381 -17.663
  621   3HZ   LYS  79          3HZ       LYS  79  11.184  -0.488 -19.344
  622    H    MET  80           H        MET  80   5.362   1.871 -13.155
  623    HA   MET  80           HA       MET  80   2.940   2.970 -14.353
  624   1HB   MET  80          2HB       MET  80   2.053   3.013 -12.067
  625   2HB   MET  80          1HB       MET  80   2.841   1.485 -12.403
  626   1HG   MET  80          2HG       MET  80   4.761   2.069 -11.168
  627   2HG   MET  80          1HG       MET  80   4.251   3.733 -11.016
  628   1HE   MET  80          1HE       MET  80   3.379   4.101  -7.976
  629   2HE   MET  80          2HE       MET  80   1.800   4.215  -8.748
  630   3HE   MET  80          3HE       MET  80   3.243   4.689  -9.639
  631    H    ILE  81           H        ILE  81   2.702   5.014 -14.872
  632    HA   ILE  81           HA       ILE  81   4.477   7.071 -13.691
  633    HB   ILE  81           HB       ILE  81   4.109   6.910 -16.189
  634   1HG1  ILE  81          2HG1      ILE  81   3.028   9.556 -15.723
  635   2HG1  ILE  81          1HG1      ILE  81   4.236   9.164 -14.499
  636   1HG2  ILE  81          1HG2      ILE  81   2.000   6.750 -16.957
  637   2HG2  ILE  81          2HG2      ILE  81   1.651   8.352 -16.307
  638   3HG2  ILE  81          3HG2      ILE  81   1.379   6.919 -15.315
  639   1HD1  ILE  81          1HD1      ILE  81   4.696   8.761 -17.464
  640   2HD1  ILE  81          2HD1      ILE  81   5.894   8.680 -16.172
  641   3HD1  ILE  81          3HD1      ILE  81   5.166  10.227 -16.603
  642    H    PHE  82           H        PHE  82   2.361   5.852 -12.122
  643    HA   PHE  82           HA       PHE  82   0.011   7.432 -11.949
  644   1HB   PHE  82          2HB       PHE  82  -0.136   5.498 -10.686
  645   2HB   PHE  82          1HB       PHE  82   1.526   5.614 -10.117
  646    HD1  PHE  82           HD1      PHE  82   1.840   6.168  -7.881
  647    HD2  PHE  82           HD2      PHE  82  -1.648   7.593  -9.936
  648    HE1  PHE  82           HE1      PHE  82   1.037   7.232  -5.786
  649    HE2  PHE  82           HE2      PHE  82  -2.456   8.654  -7.845
  650    HZ   PHE  82           HZ       PHE  82  -1.115   8.469  -5.769
  651    H    VAL  83           H        VAL  83   3.234   7.889 -10.625
  652    HA   VAL  83           HA       VAL  83   3.149   9.706  -8.661
  653    HB   VAL  83           HB       VAL  83   4.958  11.028  -9.989
  654   1HG1  VAL  83          1HG1      VAL  83   6.408   8.817  -9.903
  655   2HG1  VAL  83          2HG1      VAL  83   4.966   8.150  -9.136
  656   3HG1  VAL  83          3HG1      VAL  83   5.794   9.529  -8.412
  657   1HG2  VAL  83          1HG2      VAL  83   5.344   8.763 -11.758
  658   2HG2  VAL  83          2HG2      VAL  83   5.263  10.479 -12.159
  659   3HG2  VAL  83          3HG2      VAL  83   3.783   9.525 -12.063
  660    H    GLY  84           H        GLY  84   1.665  11.258  -8.276
  661   1HA   GLY  84          2HA       GLY  84   1.527  13.716  -9.581
  662   2HA   GLY  84          1HA       GLY  84   0.300  12.720 -10.368
  663    H    ILE  85           H        ILE  85   1.307  12.636  -6.962
  664    HA   ILE  85           HA       ILE  85  -1.533  13.097  -6.211
  665    HB   ILE  85           HB       ILE  85   0.785  12.166  -4.492
  666   1HG1  ILE  85          2HG1      ILE  85  -0.827  10.006  -4.784
  667   2HG1  ILE  85          1HG1      ILE  85  -1.044  10.763  -6.363
  668   1HG2  ILE  85          1HG2      ILE  85  -1.348  11.243  -3.228
  669   2HG2  ILE  85          2HG2      ILE  85  -2.157  12.561  -4.077
  670   3HG2  ILE  85          3HG2      ILE  85  -0.819  12.906  -2.982
  671   1HD1  ILE  85          1HD1      ILE  85   0.918   9.846  -6.983
  672   2HD1  ILE  85          2HD1      ILE  85   1.246   9.308  -5.336
  673   3HD1  ILE  85          3HD1      ILE  85   1.713  10.933  -5.842
  674    H    LYS  86           H        LYS  86  -1.825  14.406  -4.140
  675    HA   LYS  86           HA       LYS  86   0.192  16.362  -3.428
  676   1HB   LYS  86          2HB       LYS  86  -1.080  17.020  -5.739
  677   2HB   LYS  86          1HB       LYS  86  -2.183  17.733  -4.562
  678   1HG   LYS  86          2HG       LYS  86   0.251  18.484  -3.551
  679   2HG   LYS  86          1HG       LYS  86   0.560  18.532  -5.286
  680   1HD   LYS  86          2HD       LYS  86  -1.887  19.726  -5.179
  681   2HD   LYS  86          1HD       LYS  86  -1.203  20.243  -3.638
  682   1HE   LYS  86          2HE       LYS  86   0.728  21.191  -4.732
  683   2HE   LYS  86          1HE       LYS  86   0.252  20.499  -6.283
  684   1HZ   LYS  86          1HZ       LYS  86  -0.300  22.931  -5.852
  685   2HZ   LYS  86          2HZ       LYS  86  -1.518  22.354  -4.817
  686   3HZ   LYS  86          3HZ       LYS  86  -1.539  21.948  -6.466
  687    H    LYS  87           H        LYS  87  -1.714  14.416  -2.225
  688    HA   LYS  87           HA       LYS  87  -2.889  16.276  -0.234
  689   1HB   LYS  87          2HB       LYS  87  -4.425  14.848  -2.205
  690   2HB   LYS  87          1HB       LYS  87  -4.794  14.201  -0.606
  691   1HG   LYS  87          2HG       LYS  87  -5.949  16.051  -0.045
  692   2HG   LYS  87          1HG       LYS  87  -4.616  17.098  -0.534
  693   1HD   LYS  87          2HD       LYS  87  -5.554  17.546  -2.549
  694   2HD   LYS  87          1HD       LYS  87  -6.036  15.867  -2.796
  695   1HE   LYS  87          2HE       LYS  87  -7.965  16.167  -1.326
  696   2HE   LYS  87          1HE       LYS  87  -7.466  17.820  -0.970
  697   1HZ   LYS  87          1HZ       LYS  87  -8.082  16.830  -3.697
  698   2HZ   LYS  87          2HZ       LYS  87  -7.801  18.439  -3.227
  699   3HZ   LYS  87          3HZ       LYS  87  -9.204  17.632  -2.710
  700    H    LYS  88           H        LYS  88  -2.083  15.566   1.680
  701    HA   LYS  88           HA       LYS  88  -0.897  12.994   2.068
  702   1HB   LYS  88          2HB       LYS  88  -1.824  15.175   3.928
  703   2HB   LYS  88          1HB       LYS  88  -1.252  13.636   4.574
  704   1HG   LYS  88          2HG       LYS  88   0.863  13.905   3.312
  705   2HG   LYS  88          1HG       LYS  88   0.296  15.464   2.715
  706   1HD   LYS  88          2HD       LYS  88  -0.053  15.493   5.531
  707   2HD   LYS  88          1HD       LYS  88   1.568  14.867   5.222
  708   1HE   LYS  88          2HE       LYS  88   2.008  17.139   5.179
  709   2HE   LYS  88          1HE       LYS  88   1.638  16.867   3.476
  710   1HZ   LYS  88          1HZ       LYS  88   0.215  18.403   5.416
  711   2HZ   LYS  88          2HZ       LYS  88  -0.795  17.271   4.651
  712   3HZ   LYS  88          3HZ       LYS  88   0.072  18.403   3.725
  713    H    GLU  89           H        GLU  89  -4.136  14.255   2.807
  714    HA   GLU  89           HA       GLU  89  -5.102  11.984   4.219
  715   1HB   GLU  89          2HB       GLU  89  -7.375  12.799   3.234
  716   2HB   GLU  89          1HB       GLU  89  -6.500  13.869   4.331
  717   1HG   GLU  89          2HG       GLU  89  -6.175  15.412   2.716
  718   2HG   GLU  89          1HG       GLU  89  -5.629  14.194   1.564
  719    H    GLU  90           H        GLU  90  -4.481  12.510   0.841
  720    HA   GLU  90           HA       GLU  90  -6.185  10.374  -0.143
  721   1HB   GLU  90          2HB       GLU  90  -4.517  12.394  -1.265
  722   2HB   GLU  90          1HB       GLU  90  -3.955  10.842  -1.884
  723   1HG   GLU  90          2HG       GLU  90  -6.461  10.337  -2.312
  724   2HG   GLU  90          1HG       GLU  90  -6.695  12.075  -2.124
  725    H    ARG  91           H        ARG  91  -2.636  10.648   0.308
  726    HA   ARG  91           HA       ARG  91  -1.993   7.969  -0.325
  727   1HB   ARG  91          2HB       ARG  91  -0.718   9.918   1.612
  728   2HB   ARG  91          1HB       ARG  91  -0.019   8.342   1.242
  729   1HG   ARG  91          2HG       ARG  91   1.015   9.413  -0.470
  730   2HG   ARG  91          1HG       ARG  91  -0.556   9.337  -1.269
  731   1HD   ARG  91          2HD       ARG  91  -0.919  11.562  -1.024
  732   2HD   ARG  91          1HD       ARG  91  -0.309  11.567   0.631
  733    HE   ARG  91           HE       ARG  91   2.007  11.330  -0.739
  734   1HH1  ARG  91          1HH2      ARG  91  -0.099  13.815  -0.115
  735   2HH1  ARG  91          2HH2      ARG  91   0.469  14.871  -1.364
  736   1HH2  ARG  91          1HH1      ARG  91   2.462  12.462  -2.863
  737   2HH2  ARG  91          2HH1      ARG  91   1.918  14.105  -2.920
  738    H    ALA  92           H        ALA  92  -2.876   9.403   2.820
  739    HA   ALA  92           HA       ALA  92  -2.655   7.015   4.348
  740   1HB   ALA  92          1HB       ALA  92  -4.457   9.427   4.703
  741   2HB   ALA  92          2HB       ALA  92  -2.890   9.154   5.464
  742   3HB   ALA  92          3HB       ALA  92  -4.273   8.153   5.907
  743    H    ASP  93           H        ASP  93  -5.452   8.435   2.647
  744    HA   ASP  93           HA       ASP  93  -7.353   6.457   3.348
  745   1HB   ASP  93          2HB       ASP  93  -7.072   8.496   1.223
  746   2HB   ASP  93          1HB       ASP  93  -8.121   7.138   0.819
  747    H    LEU  94           H        LEU  94  -4.754   6.432   0.999
  748    HA   LEU  94           HA       LEU  94  -5.650   4.164  -0.523
  749   1HB   LEU  94          2HB       LEU  94  -2.872   5.273  -0.024
  750   2HB   LEU  94          1HB       LEU  94  -3.233   3.999  -1.190
  751    HG   LEU  94           HG       LEU  94  -4.745   6.599  -1.271
  752   1HD1  LEU  94          1HD1      LEU  94  -2.565   6.464  -3.183
  753   2HD1  LEU  94          2HD1      LEU  94  -1.954   6.427  -1.528
  754   3HD1  LEU  94          3HD1      LEU  94  -2.980   7.759  -2.059
  755   1HD2  LEU  94          1HD2      LEU  94  -4.861   5.967  -3.691
  756   2HD2  LEU  94          2HD2      LEU  94  -5.578   4.751  -2.633
  757   3HD2  LEU  94          3HD2      LEU  94  -3.973   4.491  -3.314
  758    H    ILE  95           H        ILE  95  -3.398   4.452   2.240
  759    HA   ILE  95           HA       ILE  95  -2.887   1.633   2.447
  760    HB   ILE  95           HB       ILE  95  -2.844   3.498   4.814
  761   1HG1  ILE  95          2HG1      ILE  95  -1.824   4.872   3.163
  762   2HG1  ILE  95          1HG1      ILE  95  -0.475   4.069   3.969
  763   1HG2  ILE  95          1HG2      ILE  95  -0.602   2.155   5.026
  764   2HG2  ILE  95          2HG2      ILE  95  -1.365   1.054   3.879
  765   3HG2  ILE  95          3HG2      ILE  95  -2.122   1.364   5.441
  766   1HD1  ILE  95          1HD1      ILE  95  -0.729   2.259   2.129
  767   2HD1  ILE  95          2HD1      ILE  95   0.014   3.794   1.679
  768   3HD1  ILE  95          3HD1      ILE  95  -1.671   3.475   1.266
  769    H    ALA  96           H        ALA  96  -4.928   3.724   4.509
  770    HA   ALA  96           HA       ALA  96  -6.165   1.819   6.079
  771   1HB   ALA  96          1HB       ALA  96  -6.890   4.473   5.070
  772   2HB   ALA  96          2HB       ALA  96  -7.111   3.785   6.679
  773   3HB   ALA  96          3HB       ALA  96  -8.294   3.462   5.412
  774    H    TYR  97           H        TYR  97  -7.050   2.661   2.722
  775    HA   TYR  97           HA       TYR  97  -9.315   0.925   2.592
  776   1HB   TYR  97          2HB       TYR  97  -8.912   2.703   0.928
  777   2HB   TYR  97          1HB       TYR  97  -7.495   1.829   0.344
  778    HD1  TYR  97           HD1      TYR  97  -7.915   0.789  -1.701
  779    HD2  TYR  97           HD2      TYR  97 -10.976   0.809   1.313
  780    HE1  TYR  97           HE1      TYR  97  -9.362  -0.599  -3.160
  781    HE2  TYR  97           HE2      TYR  97 -12.422  -0.577  -0.149
  782    HH   TYR  97           HH       TYR  97 -11.750  -1.087  -3.452
  783    H    LEU  98           H        LEU  98  -5.954   0.421   1.441
  784    HA   LEU  98           HA       LEU  98  -6.483  -2.375   0.828
  785   1HB   LEU  98          2HB       LEU  98  -4.073  -0.596   0.847
  786   2HB   LEU  98          1HB       LEU  98  -3.821  -2.340   0.865
  787    HG   LEU  98           HG       LEU  98  -3.848  -1.630  -1.443
  788   1HD1  LEU  98          1HD1      LEU  98  -5.208  -3.308  -2.151
  789   2HD1  LEU  98          2HD1      LEU  98  -6.629  -2.607  -1.375
  790   3HD1  LEU  98          3HD1      LEU  98  -5.498  -3.579  -0.433
  791   1HD2  LEU  98          1HD2      LEU  98  -5.723   0.272  -0.472
  792   2HD2  LEU  98          2HD2      LEU  98  -6.551  -0.682  -1.703
  793   3HD2  LEU  98          3HD2      LEU  98  -5.050   0.155  -2.099
  794    H    LYS  99           H        LYS  99  -6.249  -0.814   3.722
  795    HA   LYS  99           HA       LYS  99  -4.745  -2.948   5.078
  796   1HB   LYS  99          2HB       LYS  99  -4.800  -0.269   5.518
  797   2HB   LYS  99          1HB       LYS  99  -6.003  -0.814   6.687
  798   1HG   LYS  99          2HG       LYS  99  -4.144  -2.653   7.200
  799   2HG   LYS  99          1HG       LYS  99  -3.075  -1.401   6.567
  800   1HD   LYS  99          2HD       LYS  99  -3.214  -0.275   8.506
  801   2HD   LYS  99          1HD       LYS  99  -4.967  -0.174   8.336
  802   1HE   LYS  99          2HE       LYS  99  -4.803  -2.724   9.130
  803   2HE   LYS  99          1HE       LYS  99  -3.319  -2.129   9.873
  804   1HZ   LYS  99          1HZ       LYS  99  -6.097  -1.253  10.344
  805   2HZ   LYS  99          2HZ       LYS  99  -4.789  -0.234  10.714
  806   3HZ   LYS  99          3HZ       LYS  99  -4.932  -1.747  11.473
  807    H    LYS 100           H        LYS 100  -8.020  -1.853   4.581
  808    HA   LYS 100           HA       LYS 100  -8.977  -3.821   6.618
  809   1HB   LYS 100          2HB       LYS 100 -10.229  -1.363   5.389
  810   2HB   LYS 100          1HB       LYS 100 -11.207  -2.577   6.212
  811   1HG   LYS 100          2HG       LYS 100 -10.355  -2.059   8.284
  812   2HG   LYS 100          1HG       LYS 100  -8.775  -1.613   7.639
  813   1HD   LYS 100          2HD       LYS 100 -10.043   0.356   8.502
  814   2HD   LYS 100          1HD       LYS 100  -9.674   0.489   6.783
  815   1HE   LYS 100          2HE       LYS 100 -11.877   0.822   6.439
  816   2HE   LYS 100          1HE       LYS 100 -12.118  -0.871   6.869
  817   1HZ   LYS 100          1HZ       LYS 100 -13.391   0.020   8.472
  818   2HZ   LYS 100          2HZ       LYS 100 -12.610   1.528   8.425
  819   3HZ   LYS 100          3HZ       LYS 100 -11.914   0.235   9.280
  820    H    ALA 101           H        ALA 101  -9.285  -2.824   3.244
  821    HA   ALA 101           HA       ALA 101 -11.301  -4.761   2.567
  822   1HB   ALA 101          1HB       ALA 101  -9.495  -3.884   0.410
  823   2HB   ALA 101          2HB       ALA 101 -10.247  -2.571   1.315
  824   3HB   ALA 101          3HB       ALA 101 -11.253  -3.781   0.520
  825    H    THR 102           H        THR 102  -7.744  -4.734   2.290
  826    HA   THR 102           HA       THR 102  -7.893  -7.691   1.928
  827    HB   THR 102           HB       THR 102  -5.628  -6.705   0.498
  828    HG1  THR 102           HG1      THR 102  -8.108  -5.501  -0.160
  829   1HG2  THR 102          1HG2      THR 102  -8.241  -7.902  -0.463
  830   2HG2  THR 102          2HG2      THR 102  -6.846  -8.821   0.101
  831   3HG2  THR 102          3HG2      THR 102  -6.730  -7.858  -1.372
  832    H    ASN 103           H        ASN 103  -7.406  -6.597   4.393
  833    HA   ASN 103           HA       ASN 103  -4.890  -7.724   5.101
  834   1HB   ASN 103          2HB       ASN 103  -4.329  -5.432   3.897
  835   2HB   ASN 103          1HB       ASN 103  -4.773  -4.755   5.463
  836   1HD2  ASN 103          1HD2      ASN 103  -2.716  -4.250   6.333
  837   2HD2  ASN 103          2HD2      ASN 103  -1.483  -5.394   6.558
  838    H    GLU 104           HN       GLU 104  -7.658  -7.657   6.000
  839    HA   GLU 104           HA       GLU 104  -7.562  -6.191   8.565
  840   1HB   GLU 104          2HB       GLU 104  -9.629  -7.217   6.832
  841   2HB   GLU 104          1HB       GLU 104  -9.847  -7.857   8.462
  842   1HG   GLU 104          2HG       GLU 104  -9.127  -5.031   8.494
  843   2HG   GLU 104          1HG       GLU 104 -10.607  -5.321   7.580
  844    HHA  HEC 105           HHA      HEC 105   4.519  -2.519  -9.126
  845    HHB  HEC 105           HHB      HEC 105   1.518   1.031  -4.841
  846    HHC  HEC 105           HHC      HEC 105  -1.840   3.768  -9.451
  847    HHD  HEC 105           HHD      HEC 105   1.042   0.095 -13.714
  848   1HMA  HEC 105          1HMA      HEC 105   3.005  -1.749  -3.907
  849   2HMA  HEC 105          2HMA      HEC 105   2.972   0.013  -3.860
  850   3HMA  HEC 105          3HMA      HEC 105   4.502  -0.834  -4.086
  851   1HAA  HEC 105          1HAA      HEC 105   5.553  -2.264  -5.642
  852   2HAA  HEC 105          2HAA      HEC 105   5.536  -2.695  -7.341
  853   1HBA  HEC 105          1HBA      HEC 105   3.347  -4.047  -6.532
  854   2HBA  HEC 105          2HBA      HEC 105   4.273  -4.063  -5.029
  855   1HMB  HEC 105          1HMB      HEC 105  -1.038   3.765  -4.305
  856   2HMB  HEC 105          2HMB      HEC 105   0.557   3.055  -4.066
  857   3HMB  HEC 105          3HMB      HEC 105  -0.878   2.032  -4.026
  858    HAB  HEC 105           HAB      HEC 105  -2.309   4.765  -7.710
  859   1HBB  HEC 105          1HBB      HEC 105  -0.705   5.519  -5.733
  860   2HBB  HEC 105          2HBB      HEC 105  -2.161   5.138  -4.813
  861   3HBB  HEC 105          3HBB      HEC 105  -2.232   6.311  -6.125
  862   1HMC  HEC 105          1HMC      HEC 105  -3.099   3.297 -12.753
  863   2HMC  HEC 105          2HMC      HEC 105  -2.748   4.086 -11.215
  864   3HMC  HEC 105          3HMC      HEC 105  -1.900   4.588 -12.677
  865    HAC  HEC 105           HAC      HEC 105  -0.066   1.507 -14.764
  866   1HBC  HEC 105          1HBC      HEC 105  -2.143   3.637 -14.477
  867   2HBC  HEC 105          2HBC      HEC 105  -1.273   3.155 -15.933
  868   3HBC  HEC 105          3HBC      HEC 105  -0.409   3.935 -14.608
  869   1HMD  HEC 105          1HMD      HEC 105   2.586  -2.671 -14.316
  870   2HMD  HEC 105          2HMD      HEC 105   2.541  -0.933 -14.603
  871   3HMD  HEC 105          3HMD      HEC 105   4.085  -1.743 -14.346
  872   1HAD  HEC 105          1HAD      HEC 105   5.599  -2.628 -12.233
  873   2HAD  HEC 105          2HAD      HEC 105   4.987  -3.464 -10.815
  874   1HBD  HEC 105          1HBD      HEC 105   3.506  -3.921 -13.343
  875   2HBD  HEC 105          2HBD      HEC 105   3.901  -5.049 -12.049
  Start of MODEL    8
    1   1H    GLY   1          1HT       GLY   1  -7.000   9.515   5.931
    2   2H    GLY   1          2HT       GLY   1  -7.430   8.284   7.021
    3   3H    GLY   1          3HT       GLY   1  -7.975   9.873   7.272
    4   1HA   GLY   1          1HA       GLY   1  -9.607   9.738   5.726
    5   2HA   GLY   1          2HA       GLY   1  -8.678   8.613   4.736
    6    H    ASP   2           H        ASP   2 -11.398   8.177   5.407
    7    HA   ASP   2           HA       ASP   2 -11.363   6.129   7.548
    8   1HB   ASP   2          2HB       ASP   2 -13.426   7.718   6.145
    9   2HB   ASP   2          1HB       ASP   2 -13.891   6.058   6.512
   10    H    VAL   3           H        VAL   3 -12.794   4.081   6.833
   11    HA   VAL   3           HA       VAL   3 -11.280   2.817   4.702
   12    HB   VAL   3           HB       VAL   3 -11.939   1.430   6.542
   13   1HG1  VAL   3          1HG1      VAL   3 -14.324   2.992   6.430
   14   2HG1  VAL   3          2HG1      VAL   3 -13.853   1.817   7.656
   15   3HG1  VAL   3          3HG1      VAL   3 -14.782   1.300   6.249
   16   1HG2  VAL   3          1HG2      VAL   3 -13.311  -0.311   5.382
   17   2HG2  VAL   3          2HG2      VAL   3 -11.994   0.299   4.382
   18   3HG2  VAL   3          3HG2      VAL   3 -13.644   0.854   4.101
   19    H    GLU   4           H        GLU   4 -14.557   4.134   5.010
   20    HA   GLU   4           HA       GLU   4 -15.434   3.106   2.448
   21   1HB   GLU   4          2HB       GLU   4 -17.323   4.746   2.748
   22   2HB   GLU   4          1HB       GLU   4 -17.111   3.627   4.093
   23   1HG   GLU   4          2HG       GLU   4 -15.463   5.708   4.822
   24   2HG   GLU   4          1HG       GLU   4 -16.790   6.549   4.023
   25    H    LYS   5           H        LYS   5 -14.304   6.349   3.508
   26    HA   LYS   5           HA       LYS   5 -14.570   7.546   0.912
   27   1HB   LYS   5          2HB       LYS   5 -14.084   8.610   3.293
   28   2HB   LYS   5          1HB       LYS   5 -12.404   8.430   2.785
   29   1HG   LYS   5          2HG       LYS   5 -12.863  10.528   1.916
   30   2HG   LYS   5          1HG       LYS   5 -13.321   9.520   0.542
   31   1HD   LYS   5          2HD       LYS   5 -15.426  10.300   0.661
   32   2HD   LYS   5          1HD       LYS   5 -15.566   9.685   2.308
   33   1HE   LYS   5          2HE       LYS   5 -14.088  11.881   2.802
   34   2HE   LYS   5          1HE       LYS   5 -14.939  12.437   1.361
   35   1HZ   LYS   5          1HZ       LYS   5 -16.216  11.306   3.792
   36   2HZ   LYS   5          2HZ       LYS   5 -17.031  11.853   2.406
   37   3HZ   LYS   5          3HZ       LYS   5 -16.169  12.949   3.377
   38    H    GLY   6           H        GLY   6 -12.074   5.559   2.365
   39   1HA   GLY   6          1HA       GLY   6 -10.032   6.176   0.408
   40   2HA   GLY   6          2HA       GLY   6 -10.018   4.799   1.510
   41    H    LYS   7           H        LYS   7 -12.227   3.367   0.808
   42    HA   LYS   7           HA       LYS   7 -11.492   1.821  -1.358
   43   1HB   LYS   7          2HB       LYS   7 -13.322   1.165   0.112
   44   2HB   LYS   7          1HB       LYS   7 -14.319   2.493  -0.486
   45   1HG   LYS   7          2HG       LYS   7 -13.890   1.420  -2.834
   46   2HG   LYS   7          1HG       LYS   7 -13.474  -0.022  -1.909
   47   1HD   LYS   7          2HD       LYS   7 -15.858   0.993  -0.768
   48   2HD   LYS   7          1HD       LYS   7 -16.087   1.031  -2.516
   49   1HE   LYS   7          2HE       LYS   7 -16.783  -1.147  -1.822
   50   2HE   LYS   7          1HE       LYS   7 -15.188  -1.362  -2.545
   51   1HZ   LYS   7          1HZ       LYS   7 -15.631  -0.968   0.359
   52   2HZ   LYS   7          2HZ       LYS   7 -14.190  -1.429  -0.413
   53   3HZ   LYS   7          3HZ       LYS   7 -15.510  -2.496  -0.367
   54    H    LYS   8           H        LYS   8 -13.300   4.858  -1.471
   55    HA   LYS   8           HA       LYS   8 -13.908   4.680  -4.301
   56   1HB   LYS   8          2HB       LYS   8 -14.655   6.332  -2.156
   57   2HB   LYS   8          1HB       LYS   8 -13.805   7.395  -3.278
   58   1HG   LYS   8          2HG       LYS   8 -15.400   5.812  -4.932
   59   2HG   LYS   8          1HG       LYS   8 -16.432   6.151  -3.542
   60   1HD   LYS   8          2HD       LYS   8 -15.716   8.598  -3.794
   61   2HD   LYS   8          1HD       LYS   8 -15.061   8.135  -5.365
   62   1HE   LYS   8          2HE       LYS   8 -17.520   7.012  -5.543
   63   2HE   LYS   8          1HE       LYS   8 -17.888   8.379  -4.492
   64   1HZ   LYS   8          1HZ       LYS   8 -16.624   8.463  -7.174
   65   2HZ   LYS   8          2HZ       LYS   8 -16.716   9.805  -6.137
   66   3HZ   LYS   8          3HZ       LYS   8 -18.136   9.088  -6.731
   67    H    ILE   9           H        ILE   9 -11.439   6.458  -2.401
   68    HA   ILE   9           HA       ILE   9 -10.213   7.776  -4.588
   69    HB   ILE   9           HB       ILE   9  -9.157   6.814  -1.928
   70   1HG1  ILE   9          2HG1      ILE   9  -9.560   9.567  -3.146
   71   2HG1  ILE   9          1HG1      ILE   9 -10.675   8.783  -2.029
   72   1HG2  ILE   9          1HG2      ILE   9  -7.610   8.386  -4.015
   73   2HG2  ILE   9          2HG2      ILE   9  -7.307   6.699  -3.601
   74   3HG2  ILE   9          3HG2      ILE   9  -7.047   7.962  -2.397
   75   1HD1  ILE   9          1HD1      ILE   9  -8.411  10.358  -1.381
   76   2HD1  ILE   9          2HD1      ILE   9  -8.014   8.701  -0.929
   77   3HD1  ILE   9          3HD1      ILE   9  -9.456   9.474  -0.269
   78    H    PHE  10           H        PHE  10  -9.362   4.596  -3.158
   79    HA   PHE  10           HA       PHE  10  -7.332   3.982  -5.073
   80   1HB   PHE  10          2HB       PHE  10  -7.645   2.779  -2.905
   81   2HB   PHE  10          1HB       PHE  10  -9.099   2.032  -3.567
   82    HD1  PHE  10           HD1      PHE  10  -8.835   0.773  -5.841
   83    HD2  PHE  10           HD2      PHE  10  -5.556   1.768  -3.251
   84    HE1  PHE  10           HE1      PHE  10  -7.442  -0.961  -6.938
   85    HE2  PHE  10           HE2      PHE  10  -4.163   0.033  -4.347
   86    HZ   PHE  10           HZ       PHE  10  -5.106  -1.331  -6.191
   87    H    ILE  11           H        ILE  11 -10.801   3.099  -4.985
   88    HA   ILE  11           HA       ILE  11 -10.873   1.516  -7.303
   89    HB   ILE  11           HB       ILE  11 -12.746   2.431  -5.537
   90   1HG1  ILE  11          2HG1      ILE  11 -14.377   1.348  -7.310
   91   2HG1  ILE  11          1HG1      ILE  11 -12.870   0.964  -8.142
   92   1HG2  ILE  11          1HG2      ILE  11 -13.402   3.709  -8.209
   93   2HG2  ILE  11          2HG2      ILE  11 -12.992   4.584  -6.733
   94   3HG2  ILE  11          3HG2      ILE  11 -14.473   3.628  -6.810
   95   1HD1  ILE  11          1HD1      ILE  11 -12.019  -0.115  -6.079
   96   2HD1  ILE  11          2HD1      ILE  11 -13.507  -0.876  -6.641
   97   3HD1  ILE  11          3HD1      ILE  11 -13.549   0.239  -5.276
   98    H    MET  12           H        MET  12 -10.883   5.065  -7.043
   99    HA   MET  12           HA       MET  12 -10.856   5.168 -10.031
  100   1HB   MET  12          2HB       MET  12 -11.549   7.476  -9.859
  101   2HB   MET  12          1HB       MET  12 -12.610   6.509  -8.836
  102   1HG   MET  12          2HG       MET  12 -10.996   7.074  -6.916
  103   2HG   MET  12          1HG       MET  12 -10.329   8.302  -7.993
  104   1HE   MET  12          1HE       MET  12 -11.989   8.306  -5.075
  105   2HE   MET  12          2HE       MET  12 -12.774   9.879  -5.190
  106   3HE   MET  12          3HE       MET  12 -11.088   9.705  -5.673
  107    H    LYS  13           H        LYS  13  -8.635   4.974  -7.665
  108    HA   LYS  13           HA       LYS  13  -6.835   7.003  -8.922
  109   1HB   LYS  13          2HB       LYS  13  -7.177   7.156  -6.434
  110   2HB   LYS  13          1HB       LYS  13  -6.429   5.564  -6.287
  111   1HG   LYS  13          2HG       LYS  13  -4.593   6.977  -5.977
  112   2HG   LYS  13          1HG       LYS  13  -4.503   6.649  -7.709
  113   1HD   LYS  13          2HD       LYS  13  -4.570   8.881  -8.030
  114   2HD   LYS  13          1HD       LYS  13  -6.254   8.822  -7.503
  115   1HE   LYS  13          2HE       LYS  13  -5.317   8.945  -5.104
  116   2HE   LYS  13          1HE       LYS  13  -3.800   9.434  -5.855
  117   1HZ   LYS  13          1HZ       LYS  13  -5.907  11.064  -5.243
  118   2HZ   LYS  13          2HZ       LYS  13  -6.026  10.858  -6.924
  119   3HZ   LYS  13          3HZ       LYS  13  -4.592  11.456  -6.239
  120    H    CYS  14           H        CYS  14  -6.305   3.864  -7.271
  121    HA   CYS  14           HA       CYS  14  -4.581   3.119  -9.601
  122   1HB   CYS  14          2HB       CYS  14  -4.068   1.563  -7.181
  123   2HB   CYS  14          1HB       CYS  14  -2.931   2.442  -8.192
  124    H    SER  15           H        SER  15  -7.380   2.634  -9.576
  125    HA   SER  15           HA       SER  15  -7.730  -0.166  -8.722
  126   1HB   SER  15          2HB       SER  15  -9.526   1.646  -8.566
  127   2HB   SER  15          1HB       SER  15  -9.682   1.502 -10.314
  128    HG   SER  15           HG       SER  15 -10.372  -0.556 -10.087
  129    H    GLN  16           H        GLN  16  -7.994   1.612 -11.814
  130    HA   GLN  16           HA       GLN  16  -8.310  -0.630 -13.494
  131   1HB   GLN  16          2HB       GLN  16  -7.224   0.872 -15.259
  132   2HB   GLN  16          1HB       GLN  16  -8.649   1.526 -14.452
  133   1HG   GLN  16          2HG       GLN  16  -7.310   2.903 -13.013
  134   2HG   GLN  16          1HG       GLN  16  -5.827   2.093 -13.517
  135   1HE2  GLN  16          1HE2      GLN  16  -7.983   4.694 -14.253
  136   2HE2  GLN  16          2HE2      GLN  16  -7.265   5.162 -15.718
  137    H    CYS  17           H        CYS  17  -5.336   0.852 -12.225
  138    HA   CYS  17           HA       CYS  17  -3.702  -1.105 -13.699
  139   1HB   CYS  17          2HB       CYS  17  -3.115   1.267 -11.951
  140   2HB   CYS  17          1HB       CYS  17  -1.851   0.067 -12.231
  141    H    HIS  18           H        HIS  18  -5.125  -0.712 -10.538
  142    HA   HIS  18           HA       HIS  18  -3.884  -3.320  -9.772
  143   1HB   HIS  18          2HB       HIS  18  -4.277  -0.931  -7.955
  144   2HB   HIS  18          1HB       HIS  18  -3.910  -2.546  -7.384
  145    HD1  HIS  18           HD1      HIS  18  -1.518  -3.313  -7.507
  146    HD2  HIS  18           HD2      HIS  18  -2.149   0.283  -9.499
  147    HE1  HIS  18           HE1      HIS  18   0.768  -2.400  -8.074
  148    H    THR  19           H        THR  19  -6.023  -4.062 -10.670
  149    HA   THR  19           HA       THR  19  -8.437  -3.333  -9.199
  150    HB   THR  19           HB       THR  19  -9.334  -5.423 -10.444
  151    HG1  THR  19           HG1      THR  19  -8.019  -6.294 -11.932
  152   1HG2  THR  19          1HG2      THR  19  -9.421  -4.193 -12.588
  153   2HG2  THR  19          2HG2      THR  19  -8.151  -3.113 -12.012
  154   3HG2  THR  19          3HG2      THR  19  -9.726  -3.124 -11.220
  155    H    VAL  20           H        VAL  20  -7.959  -3.805  -7.013
  156    HA   VAL  20           HA       VAL  20  -6.953  -6.438  -6.242
  157    HB   VAL  20           HB       VAL  20  -6.993  -5.585  -3.998
  158   1HG1  VAL  20          1HG1      VAL  20  -5.207  -4.625  -5.276
  159   2HG1  VAL  20          2HG1      VAL  20  -5.908  -3.312  -4.330
  160   3HG1  VAL  20          3HG1      VAL  20  -6.295  -3.469  -6.044
  161   1HG2  VAL  20          1HG2      VAL  20  -9.322  -4.632  -4.167
  162   2HG2  VAL  20          2HG2      VAL  20  -8.644  -3.261  -5.046
  163   3HG2  VAL  20          3HG2      VAL  20  -8.177  -3.553  -3.371
  164    H    GLU  21           H        GLU  21  -9.656  -6.144  -7.624
  165    HA   GLU  21           HA       GLU  21 -11.102  -7.929  -5.769
  166   1HB   GLU  21          2HB       GLU  21 -11.872  -5.168  -6.334
  167   2HB   GLU  21          1HB       GLU  21 -13.136  -6.312  -6.786
  168   1HG   GLU  21          2HG       GLU  21 -12.221  -7.263  -4.330
  169   2HG   GLU  21          1HG       GLU  21 -12.236  -5.511  -4.129
  170    H    LYS  22           H        LYS  22  -9.718  -7.791  -8.530
  171    HA   LYS  22           HA       LYS  22 -11.850  -8.342 -10.439
  172   1HB   LYS  22          2HB       LYS  22  -9.410  -7.457 -10.851
  173   2HB   LYS  22          1HB       LYS  22  -8.989  -9.170 -10.846
  174   1HG   LYS  22          2HG       LYS  22  -9.443  -8.665 -13.121
  175   2HG   LYS  22          1HG       LYS  22 -10.897  -9.477 -12.540
  176   1HD   LYS  22          2HD       LYS  22 -10.901  -6.556 -12.130
  177   2HD   LYS  22          1HD       LYS  22 -10.883  -7.050 -13.824
  178   1HE   LYS  22          2HE       LYS  22 -12.724  -8.699 -12.319
  179   2HE   LYS  22          1HE       LYS  22 -13.113  -6.993 -12.103
  180   1HZ   LYS  22          1HZ       LYS  22 -12.449  -7.583 -14.809
  181   2HZ   LYS  22          2HZ       LYS  22 -13.848  -6.854 -14.175
  182   3HZ   LYS  22          3HZ       LYS  22 -13.738  -8.547 -14.272
  183    H    GLY  23           H        GLY  23 -10.011 -10.195  -8.148
  184   1HA   GLY  23          2HA       GLY  23 -11.126 -12.402  -7.592
  185   2HA   GLY  23          1HA       GLY  23 -11.157 -12.696  -9.331
  186    H    GLY  24           H        GLY  24  -8.378 -11.267  -9.324
  187   1HA   GLY  24          1HA       GLY  24  -6.294 -12.246  -8.054
  188   2HA   GLY  24          2HA       GLY  24  -6.871 -13.766  -8.738
  189    H    LYS  25           H        LYS  25  -7.752 -11.671 -11.031
  190    HA   LYS  25           HA       LYS  25  -5.384 -12.271 -12.670
  191   1HB   LYS  25          2HB       LYS  25  -7.898 -12.327 -13.406
  192   2HB   LYS  25          1HB       LYS  25  -7.702 -10.583 -13.586
  193   1HG   LYS  25          2HG       LYS  25  -5.423 -11.638 -14.795
  194   2HG   LYS  25          1HG       LYS  25  -6.713 -12.735 -15.288
  195   1HD   LYS  25          2HD       LYS  25  -7.910 -10.266 -15.562
  196   2HD   LYS  25          1HD       LYS  25  -6.248  -9.937 -16.054
  197   1HE   LYS  25          2HE       LYS  25  -6.495 -11.087 -17.983
  198   2HE   LYS  25          1HE       LYS  25  -7.236 -12.455 -17.151
  199   1HZ   LYS  25          1HZ       LYS  25  -9.222 -11.794 -17.830
  200   2HZ   LYS  25          2HZ       LYS  25  -8.489 -10.560 -18.740
  201   3HZ   LYS  25          3HZ       LYS  25  -9.004 -10.255 -17.149
  202    H    HIS  26           H        HIS  26  -4.195 -10.582 -13.805
  203    HA   HIS  26           HA       HIS  26  -4.478  -7.846 -12.685
  204   1HB   HIS  26          2HB       HIS  26  -1.791  -8.005 -12.765
  205   2HB   HIS  26          1HB       HIS  26  -2.714  -8.367 -11.311
  206    HD1  HIS  26           HD1      HIS  26  -2.417 -10.618 -14.358
  207    HD2  HIS  26           HD2      HIS  26  -1.184 -10.517 -10.374
  208    HE1  HIS  26           HE1      HIS  26  -1.409 -12.886 -13.862
  209    H    LYS  27           H        LYS  27  -3.932  -6.242 -14.169
  210    HA   LYS  27           HA       LYS  27  -3.097  -7.207 -16.848
  211   1HB   LYS  27          2HB       LYS  27  -5.310  -6.299 -17.005
  212   2HB   LYS  27          1HB       LYS  27  -4.863  -4.893 -16.037
  213   1HG   LYS  27          2HG       LYS  27  -3.476  -4.016 -17.776
  214   2HG   LYS  27          1HG       LYS  27  -3.551  -5.523 -18.688
  215   1HD   LYS  27          2HD       LYS  27  -6.112  -4.105 -18.051
  216   2HD   LYS  27          1HD       LYS  27  -5.098  -3.477 -19.351
  217   1HE   LYS  27          2HE       LYS  27  -5.208  -6.303 -19.664
  218   2HE   LYS  27          1HE       LYS  27  -6.859  -5.743 -19.404
  219   1HZ   LYS  27          1HZ       LYS  27  -6.029  -5.722 -21.769
  220   2HZ   LYS  27          2HZ       LYS  27  -5.023  -4.429 -21.319
  221   3HZ   LYS  27          3HZ       LYS  27  -6.711  -4.273 -21.209
  222    H    THR  28           H        THR  28  -3.224  -3.871 -15.695
  223    HA   THR  28           HA       THR  28  -0.472  -3.436 -16.580
  224    HB   THR  28           HB       THR  28  -2.507  -1.657 -15.211
  225    HG1  THR  28           HG1      THR  28  -1.406  -1.761 -17.821
  226   1HG2  THR  28          1HG2      THR  28  -0.746   0.124 -16.051
  227   2HG2  THR  28          2HG2      THR  28   0.381  -1.223 -15.883
  228   3HG2  THR  28          3HG2      THR  28  -0.537  -0.662 -14.485
  229    H    GLY  29           H        GLY  29  -1.890  -2.421 -13.477
  230   1HA   GLY  29          2HA       GLY  29   0.641  -2.825 -12.115
  231   2HA   GLY  29          1HA       GLY  29  -0.875  -2.359 -11.349
  232    HA   PRO  30           HA       PRO  30   0.115  -7.013 -10.877
  233   1HB   PRO  30          2HB       PRO  30   1.349  -6.967  -8.434
  234   2HB   PRO  30          1HB       PRO  30   2.218  -6.944  -9.972
  235   1HG   PRO  30          2HG       PRO  30   1.668  -4.679  -8.086
  236   2HG   PRO  30          1HG       PRO  30   3.075  -4.956  -9.131
  237   1HD   PRO  30          2HD       PRO  30   1.027  -3.185  -9.740
  238   2HD   PRO  30          1HD       PRO  30   2.091  -3.934 -10.935
  239    H    ASN  31           H        ASN  31  -1.472  -8.201  -9.880
  240    HA   ASN  31           HA       ASN  31  -3.713  -7.038  -8.700
  241   1HB   ASN  31          2HB       ASN  31  -3.572  -9.401  -9.492
  242   2HB   ASN  31          1HB       ASN  31  -2.626  -9.796  -8.058
  243   1HD2  ASN  31          1HD2      ASN  31  -5.625  -7.833  -8.576
  244   2HD2  ASN  31          2HD2      ASN  31  -6.521  -8.630  -7.374
  245    H    LEU  32           H        LEU  32  -3.431  -5.586  -7.040
  246    HA   LEU  32           HA       LEU  32  -1.631  -6.143  -4.816
  247   1HB   LEU  32          2HB       LEU  32  -3.085  -3.854  -5.858
  248   2HB   LEU  32          1HB       LEU  32  -3.279  -3.988  -4.112
  249    HG   LEU  32           HG       LEU  32  -0.951  -3.842  -3.721
  250   1HD1  LEU  32          1HD1      LEU  32  -0.811  -4.918  -6.464
  251   2HD1  LEU  32          2HD1      LEU  32   0.263  -5.191  -5.094
  252   3HD1  LEU  32          3HD1      LEU  32   0.438  -3.736  -6.075
  253   1HD2  LEU  32          1HD2      LEU  32  -1.084  -1.639  -4.202
  254   2HD2  LEU  32          2HD2      LEU  32  -2.175  -1.946  -5.553
  255   3HD2  LEU  32          3HD2      LEU  32  -0.430  -2.020  -5.794
  256    H    HIS  33           H        HIS  33  -3.352  -8.238  -4.785
  257    HA   HIS  33           HA       HIS  33  -5.499  -7.578  -2.836
  258   1HB   HIS  33          2HB       HIS  33  -6.156  -8.950  -4.772
  259   2HB   HIS  33          1HB       HIS  33  -4.918 -10.138  -4.361
  260    HD1  HIS  33           HD1      HIS  33  -6.684 -11.997  -3.902
  261    HD2  HIS  33           HD2      HIS  33  -7.109  -8.635  -1.473
  262    HE1  HIS  33           HE1      HIS  33  -8.288 -12.647  -2.053
  263    H    GLY  34           H        GLY  34  -3.790  -7.207  -1.162
  264   1HA   GLY  34          2HA       GLY  34  -3.347  -8.409   0.976
  265   2HA   GLY  34          1HA       GLY  34  -2.898  -9.813   0.008
  266    H    LEU  35           H        LEU  35  -1.856  -6.907  -1.390
  267    HA   LEU  35           HA       LEU  35   0.889  -7.522  -1.309
  268   1HB   LEU  35          2HB       LEU  35   0.152  -5.889  -2.883
  269   2HB   LEU  35          1HB       LEU  35  -0.577  -4.895  -1.622
  270    HG   LEU  35           HG       LEU  35   2.220  -5.315  -1.041
  271   1HD1  LEU  35          1HD1      LEU  35   1.479  -4.429  -3.825
  272   2HD1  LEU  35          2HD1      LEU  35   2.751  -5.543  -3.324
  273   3HD1  LEU  35          3HD1      LEU  35   2.936  -3.811  -3.046
  274   1HD2  LEU  35          1HD2      LEU  35   0.274  -3.084  -1.419
  275   2HD2  LEU  35          2HD2      LEU  35   1.987  -2.680  -1.515
  276   3HD2  LEU  35          3HD2      LEU  35   1.337  -3.425  -0.055
  277    H    PHE  36           H        PHE  36  -1.124  -5.937   1.080
  278    HA   PHE  36           HA       PHE  36   0.922  -4.685   2.627
  279   1HB   PHE  36          2HB       PHE  36  -1.871  -5.611   3.126
  280   2HB   PHE  36          1HB       PHE  36  -0.861  -5.283   4.534
  281    HD1  PHE  36           HD1      PHE  36  -0.843  -3.648   1.178
  282    HD2  PHE  36           HD2      PHE  36  -1.644  -3.222   5.376
  283    HE1  PHE  36           HE1      PHE  36  -1.191  -1.213   0.863
  284    HE2  PHE  36           HE2      PHE  36  -1.992  -0.787   5.062
  285    HZ   PHE  36           HZ       PHE  36  -1.766   0.218   2.806
  286    H    GLY  37           H        GLY  37   2.040  -5.434   4.491
  287   1HA   GLY  37          2HA       GLY  37   3.261  -7.012   5.721
  288   2HA   GLY  37          1HA       GLY  37   1.793  -7.989   5.681
  289    H    ARG  38           H        ARG  38   3.075  -7.107   2.616
  290    HA   ARG  38           HA       ARG  38   4.556  -9.681   2.405
  291   1HB   ARG  38          2HB       ARG  38   1.977  -9.408   1.449
  292   2HB   ARG  38          1HB       ARG  38   2.955  -9.044   0.026
  293   1HG   ARG  38          2HG       ARG  38   4.281 -11.210   1.046
  294   2HG   ARG  38          1HG       ARG  38   2.614 -11.596   1.470
  295   1HD   ARG  38          2HD       ARG  38   3.110 -12.489  -0.747
  296   2HD   ARG  38          1HD       ARG  38   1.950 -11.168  -0.896
  297    HE   ARG  38           HE       ARG  38   4.853 -10.625  -1.303
  298   1HH1  ARG  38          1HH2      ARG  38   2.928  -8.447  -1.810
  299   2HH1  ARG  38          2HH2      ARG  38   2.643  -8.572  -3.515
  300   1HH2  ARG  38          1HH1      ARG  38   3.921 -11.782  -3.767
  301   2HH2  ARG  38          2HH1      ARG  38   3.204 -10.456  -4.619
  302    H    LYS  39           H        LYS  39   5.929  -9.725   0.415
  303    HA   LYS  39           HA       LYS  39   7.021  -7.018  -0.084
  304   1HB   LYS  39          2HB       LYS  39   8.266  -9.371  -1.392
  305   2HB   LYS  39          1HB       LYS  39   9.022  -8.018  -0.554
  306   1HG   LYS  39          2HG       LYS  39   7.616 -10.363   0.748
  307   2HG   LYS  39          1HG       LYS  39   9.354 -10.078   0.715
  308   1HD   LYS  39          2HD       LYS  39   7.646  -7.875   1.764
  309   2HD   LYS  39          1HD       LYS  39   7.833  -9.303   2.785
  310   1HE   LYS  39          2HE       LYS  39  10.390  -8.599   1.674
  311   2HE   LYS  39          1HE       LYS  39   9.680  -7.176   2.435
  312   1HZ   LYS  39          1HZ       LYS  39   9.374  -9.606   3.954
  313   2HZ   LYS  39          2HZ       LYS  39   9.880  -8.064   4.457
  314   3HZ   LYS  39          3HZ       LYS  39  10.988  -9.132   3.740
  315    H    THR  40           H        THR  40   8.187  -7.664  -2.592
  316    HA   THR  40           HA       THR  40   6.162  -6.778  -4.392
  317    HB   THR  40           HB       THR  40   8.330  -8.363  -5.604
  318    HG1  THR  40           HG1      THR  40   9.544  -6.217  -4.754
  319   1HG2  THR  40          1HG2      THR  40   8.690  -6.089  -6.702
  320   2HG2  THR  40          2HG2      THR  40   7.293  -5.528  -5.784
  321   3HG2  THR  40          3HG2      THR  40   7.108  -6.824  -6.966
  322    H    GLY  41           H        GLY  41   6.370  -8.517  -6.611
  323   1HA   GLY  41          1HA       GLY  41   5.390 -11.126  -5.660
  324   2HA   GLY  41          2HA       GLY  41   4.275 -10.160  -6.620
  325    H    GLN  42           H        GLN  42   4.641 -12.337  -7.901
  326    HA   GLN  42           HA       GLN  42   6.328 -11.682 -10.189
  327   1HB   GLN  42          2HB       GLN  42   7.453 -14.042  -9.959
  328   2HB   GLN  42          1HB       GLN  42   8.115 -12.680  -9.054
  329   1HG   GLN  42          2HG       GLN  42   5.944 -14.033  -7.628
  330   2HG   GLN  42          1HG       GLN  42   7.313 -15.097  -7.954
  331   1HE2  GLN  42          1HE2      GLN  42   6.167 -12.856  -5.722
  332   2HE2  GLN  42          2HE2      GLN  42   7.644 -12.418  -5.010
  333    H    ALA  43           H        ALA  43   3.502 -12.173  -9.715
  334    HA   ALA  43           HA       ALA  43   2.452 -14.663 -10.219
  335   1HB   ALA  43          1HB       ALA  43   0.753 -13.129 -10.222
  336   2HB   ALA  43          2HB       ALA  43   0.952 -13.243 -11.971
  337   3HB   ALA  43          3HB       ALA  43   1.709 -11.921 -11.081
  338    HA   PRO  44           HA       PRO  44   3.942 -16.101 -14.086
  339   1HB   PRO  44          2HB       PRO  44   1.752 -17.525 -14.952
  340   2HB   PRO  44          1HB       PRO  44   2.835 -18.077 -13.661
  341   1HG   PRO  44          2HG       PRO  44   0.082 -16.941 -13.446
  342   2HG   PRO  44          1HG       PRO  44   0.921 -18.066 -12.364
  343   1HD   PRO  44          2HD       PRO  44   0.575 -15.302 -11.910
  344   2HD   PRO  44          1HD       PRO  44   1.713 -16.362 -11.050
  345    H    GLY  45           H        GLY  45   3.732 -15.754 -16.411
  346   1HA   GLY  45          2HA       GLY  45   3.179 -14.421 -18.269
  347   2HA   GLY  45          1HA       GLY  45   1.510 -14.572 -17.708
  348    H    TYR  46           H        TYR  46   3.791 -13.262 -15.496
  349    HA   TYR  46           HA       TYR  46   3.278 -10.461 -16.244
  350   1HB   TYR  46          2HB       TYR  46   1.285 -11.221 -14.881
  351   2HB   TYR  46          1HB       TYR  46   2.388 -11.512 -13.543
  352    HD1  TYR  46           HD1      TYR  46   4.065  -8.873 -14.755
  353    HD2  TYR  46           HD2      TYR  46   0.155  -9.674 -13.200
  354    HE1  TYR  46           HE1      TYR  46   3.859  -6.516 -14.102
  355    HE2  TYR  46           HE2      TYR  46  -0.037  -7.298 -12.549
  356    HH   TYR  46           HH       TYR  46   2.151  -5.349 -12.041
  357    H    SER  47           H        SER  47   5.428  -9.919 -16.228
  358    HA   SER  47           HA       SER  47   7.238 -10.911 -14.154
  359   1HB   SER  47          2HB       SER  47   8.921  -9.564 -15.254
  360   2HB   SER  47          1HB       SER  47   7.957 -10.322 -16.519
  361    HG   SER  47           HG       SER  47   7.083  -8.430 -17.003
  362    H    TYR  48           H        TYR  48   5.951 -10.145 -12.317
  363    HA   TYR  48           HA       TYR  48   5.029  -7.605 -11.740
  364   1HB   TYR  48          2HB       TYR  48   6.139  -9.826 -10.159
  365   2HB   TYR  48          1HB       TYR  48   6.206  -8.257  -9.365
  366    HD1  TYR  48           HD1      TYR  48   3.610  -9.317 -11.812
  367    HD2  TYR  48           HD2      TYR  48   4.581  -8.598  -7.718
  368    HE1  TYR  48           HE1      TYR  48   1.216  -9.558 -11.194
  369    HE2  TYR  48           HE2      TYR  48   2.199  -8.834  -7.087
  370    HH   TYR  48           HH       TYR  48   0.049 -10.273  -8.589
  371    H    THR  49           H        THR  49   6.205  -6.024 -10.110
  372    HA   THR  49           HA       THR  49   8.401  -4.826 -11.466
  373    HB   THR  49           HB       THR  49   8.136  -4.409  -8.522
  374    HG1  THR  49           HG1      THR  49   6.190  -3.422  -8.744
  375   1HG2  THR  49          1HG2      THR  49   7.825  -2.068 -10.114
  376   2HG2  THR  49          2HG2      THR  49   9.125  -3.026 -10.824
  377   3HG2  THR  49          3HG2      THR  49   9.215  -2.537  -9.132
  378    H    ALA  50           H        ALA  50   9.945  -6.499 -11.830
  379    HA   ALA  50           HA       ALA  50  11.085  -8.196  -9.892
  380   1HB   ALA  50          1HB       ALA  50  13.182  -7.987 -11.434
  381   2HB   ALA  50          2HB       ALA  50  12.130  -7.003 -12.451
  382   3HB   ALA  50          3HB       ALA  50  11.707  -8.680 -12.107
  383    H    ALA  51           H        ALA  51  11.972  -4.876 -10.813
  384    HA   ALA  51           HA       ALA  51  14.306  -4.559  -9.300
  385   1HB   ALA  51          1HB       ALA  51  13.443  -2.149  -8.962
  386   2HB   ALA  51          2HB       ALA  51  12.034  -2.662  -9.890
  387   3HB   ALA  51          3HB       ALA  51  13.637  -2.710 -10.622
  388    H    ASN  52           H        ASN  52  11.138  -3.396  -8.063
  389    HA   ASN  52           HA       ASN  52  11.684  -3.148  -5.388
  390   1HB   ASN  52          2HB       ASN  52   9.296  -4.007  -6.918
  391   2HB   ASN  52          1HB       ASN  52   9.283  -4.435  -5.208
  392   1HD2  ASN  52          1HD2      ASN  52  10.380  -2.330  -3.896
  393   2HD2  ASN  52          2HD2      ASN  52   9.571  -0.880  -4.248
  394    H    LYS  53           H        LYS  53  10.845  -6.240  -6.976
  395    HA   LYS  53           HA       LYS  53  10.866  -8.017  -4.874
  396   1HB   LYS  53          2HB       LYS  53  10.674  -8.503  -7.389
  397   2HB   LYS  53          1HB       LYS  53  12.435  -8.606  -7.384
  398   1HG   LYS  53          2HG       LYS  53  12.404 -10.410  -5.792
  399   2HG   LYS  53          1HG       LYS  53  10.676 -10.204  -5.507
  400   1HD   LYS  53          2HD       LYS  53  10.135 -11.454  -7.307
  401   2HD   LYS  53          1HD       LYS  53  11.279 -10.594  -8.337
  402   1HE   LYS  53          2HE       LYS  53  13.089 -11.961  -7.038
  403   2HE   LYS  53          1HE       LYS  53  11.741 -13.017  -6.617
  404   1HZ   LYS  53          1HZ       LYS  53  11.231 -13.077  -9.058
  405   2HZ   LYS  53          2HZ       LYS  53  12.666 -13.861  -8.594
  406   3HZ   LYS  53          3HZ       LYS  53  12.730 -12.327  -9.322
  407    H    ASN  54           H        ASN  54  13.888  -7.542  -6.740
  408    HA   ASN  54           HA       ASN  54  15.531  -8.645  -4.691
  409   1HB   ASN  54          2HB       ASN  54  17.421  -7.737  -5.965
  410   2HB   ASN  54          1HB       ASN  54  16.240  -8.460  -7.058
  411   1HD2  ASN  54          1HD2      ASN  54  16.950  -7.037  -8.829
  412   2HD2  ASN  54          2HD2      ASN  54  16.527  -5.394  -8.846
  413    H    LYS  55           H        LYS  55  14.105  -5.531  -4.992
  414    HA   LYS  55           HA       LYS  55  16.012  -3.967  -3.569
  415   1HB   LYS  55          2HB       LYS  55  13.971  -3.129  -4.837
  416   2HB   LYS  55          1HB       LYS  55  13.009  -3.621  -3.443
  417   1HG   LYS  55          2HG       LYS  55  13.443  -1.458  -2.797
  418   2HG   LYS  55          1HG       LYS  55  14.904  -2.213  -2.157
  419   1HD   LYS  55          2HD       LYS  55  15.642  -1.739  -4.751
  420   2HD   LYS  55          1HD       LYS  55  14.588  -0.361  -4.434
  421   1HE   LYS  55          2HE       LYS  55  16.061   0.582  -2.990
  422   2HE   LYS  55          1HE       LYS  55  16.432  -0.965  -2.225
  423   1HZ   LYS  55          1HZ       LYS  55  17.610   0.221  -4.657
  424   2HZ   LYS  55          2HZ       LYS  55  17.681  -1.454  -4.383
  425   3HZ   LYS  55          3HZ       LYS  55  18.395  -0.379  -3.279
  426    H    GLY  56           H        GLY  56  14.086  -6.569  -2.525
  427   1HA   GLY  56          1HA       GLY  56  13.644  -7.447  -0.393
  428   2HA   GLY  56          2HA       GLY  56  15.102  -6.590   0.111
  429    H    ILE  57           H        ILE  57  12.000  -5.339  -1.118
  430    HA   ILE  57           HA       ILE  57  11.869  -3.611   1.309
  431    HB   ILE  57           HB       ILE  57  11.895  -2.607  -1.051
  432   1HG1  ILE  57          2HG1      ILE  57  11.063  -1.495   1.086
  433   2HG1  ILE  57          1HG1      ILE  57  10.395  -0.853  -0.414
  434   1HG2  ILE  57          1HG2      ILE  57   9.103  -3.791  -1.016
  435   2HG2  ILE  57          2HG2      ILE  57  10.400  -4.198  -2.139
  436   3HG2  ILE  57          3HG2      ILE  57   9.667  -2.594  -2.183
  437   1HD1  ILE  57          1HD1      ILE  57   8.667  -2.951   0.290
  438   2HD1  ILE  57          2HD1      ILE  57   8.347  -1.226   0.455
  439   3HD1  ILE  57          3HD1      ILE  57   9.022  -2.131   1.808
  440    H    ILE  58           H        ILE  58  10.165  -3.824   2.716
  441    HA   ILE  58           HA       ILE  58   8.190  -5.964   2.117
  442    HB   ILE  58           HB       ILE  58   9.166  -6.268   4.264
  443   1HG1  ILE  58          2HG1      ILE  58   7.309  -6.068   5.762
  444   2HG1  ILE  58          1HG1      ILE  58   6.667  -4.675   4.891
  445   1HG2  ILE  58          1HG2      ILE  58   9.156  -3.322   4.250
  446   2HG2  ILE  58          2HG2      ILE  58  10.289  -4.440   5.009
  447   3HG2  ILE  58          3HG2      ILE  58   8.772  -4.038   5.815
  448   1HD1  ILE  58          1HD1      ILE  58   5.851  -5.967   3.142
  449   2HD1  ILE  58          2HD1      ILE  58   5.639  -7.081   4.494
  450   3HD1  ILE  58          3HD1      ILE  58   7.022  -7.258   3.414
  451    H    TRP  59           H        TRP  59   6.693  -4.931   0.774
  452    HA   TRP  59           HA       TRP  59   5.779  -2.344   0.750
  453   1HB   TRP  59          2HB       TRP  59   4.244  -4.915   0.378
  454   2HB   TRP  59          1HB       TRP  59   3.496  -3.337   0.129
  455    HD1  TRP  59           HD1      TRP  59   4.748  -5.824  -1.950
  456    HE1  TRP  59           HE1      TRP  59   5.940  -4.925  -4.052
  457    HE3  TRP  59           HE3      TRP  59   5.571  -0.984  -0.506
  458    HZ2  TRP  59           HZ2      TRP  59   7.088  -2.487  -4.994
  459    HZ3  TRP  59           HZ3      TRP  59   6.716   0.598  -2.032
  460    HH2  TRP  59           HH2      TRP  59   7.476  -0.149  -4.271
  461    H    GLY  60           H        GLY  60   5.485  -1.199   2.608
  462   1HA   GLY  60          1HA       GLY  60   3.410  -2.227   4.502
  463   2HA   GLY  60          2HA       GLY  60   4.860  -1.402   5.081
  464    H    GLU  61           H        GLU  61   3.203   0.111   6.042
  465    HA   GLU  61           HA       GLU  61   1.609   1.773   4.281
  466   1HB   GLU  61          2HB       GLU  61   2.481   2.133   7.165
  467   2HB   GLU  61          1HB       GLU  61   1.348   3.200   6.333
  468   1HG   GLU  61          2HG       GLU  61   0.126   0.915   5.767
  469   2HG   GLU  61          1HG       GLU  61   0.984   0.358   7.204
  470    H    ASP  62           H        ASP  62   4.248   2.814   6.453
  471    HA   ASP  62           HA       ASP  62   4.814   5.195   5.009
  472   1HB   ASP  62          2HB       ASP  62   5.535   4.587   7.387
  473   2HB   ASP  62          1HB       ASP  62   6.835   3.653   6.647
  474    H    THR  63           H        THR  63   6.136   1.917   4.723
  475    HA   THR  63           HA       THR  63   8.301   2.519   2.988
  476    HB   THR  63           HB       THR  63   7.439   0.048   2.118
  477    HG1  THR  63           HG1      THR  63   5.701   0.405   3.737
  478   1HG2  THR  63          1HG2      THR  63   8.820  -0.311   4.587
  479   2HG2  THR  63          2HG2      THR  63   9.435   1.161   3.834
  480   3HG2  THR  63          3HG2      THR  63   9.481  -0.366   2.953
  481    H    LEU  64           H        LEU  64   4.862   2.017   2.327
  482    HA   LEU  64           HA       LEU  64   5.213   2.092  -0.567
  483   1HB   LEU  64          2HB       LEU  64   3.124   1.433   1.210
  484   2HB   LEU  64          1HB       LEU  64   2.553   2.830   0.298
  485    HG   LEU  64           HG       LEU  64   3.648   0.253  -0.864
  486   1HD1  LEU  64          1HD1      LEU  64   1.493  -0.391  -0.646
  487   2HD1  LEU  64          2HD1      LEU  64   1.113   0.807  -1.885
  488   3HD1  LEU  64          3HD1      LEU  64   0.985   1.233  -0.178
  489   1HD2  LEU  64          1HD2      LEU  64   2.357   2.323  -2.566
  490   2HD2  LEU  64          2HD2      LEU  64   3.706   1.249  -2.932
  491   3HD2  LEU  64          3HD2      LEU  64   3.975   2.705  -1.975
  492    H    MET  65           H        MET  65   4.464   4.405   1.983
  493    HA   MET  65           HA       MET  65   3.560   6.576   0.430
  494   1HB   MET  65          2HB       MET  65   3.725   6.456   2.969
  495   2HB   MET  65          1HB       MET  65   5.437   6.846   2.789
  496   1HG   MET  65          2HG       MET  65   4.524   8.972   3.050
  497   2HG   MET  65          1HG       MET  65   4.524   8.818   1.294
  498   1HE   MET  65          1HE       MET  65   3.298  10.799   1.945
  499   2HE   MET  65          2HE       MET  65   1.840  10.862   2.934
  500   3HE   MET  65          3HE       MET  65   1.703  10.716   1.184
  501    H    GLU  66           H        GLU  66   6.867   5.468   1.070
  502    HA   GLU  66           HA       GLU  66   8.120   7.673  -0.317
  503   1HB   GLU  66          2HB       GLU  66   9.304   6.336   1.399
  504   2HB   GLU  66          1HB       GLU  66   9.204   4.922   0.353
  505   1HG   GLU  66          2HG       GLU  66  10.702   5.813  -1.215
  506   2HG   GLU  66          1HG       GLU  66  10.442   7.469  -0.665
  507    H    TYR  67           H        TYR  67   7.810   4.212  -1.141
  508    HA   TYR  67           HA       TYR  67   8.740   4.347  -3.789
  509   1HB   TYR  67          2HB       TYR  67   8.291   2.215  -2.711
  510   2HB   TYR  67          1HB       TYR  67   6.572   2.591  -2.605
  511    HD1  TYR  67           HD1      TYR  67   9.277   2.524  -5.222
  512    HD2  TYR  67           HD2      TYR  67   5.194   1.654  -4.212
  513    HE1  TYR  67           HE1      TYR  67   8.918   1.571  -7.484
  514    HE2  TYR  67           HE2      TYR  67   4.834   0.704  -6.471
  515    HH   TYR  67           HH       TYR  67   6.197  -0.297  -8.276
  516    H    LEU  68           H        LEU  68   5.811   5.617  -2.471
  517    HA   LEU  68           HA       LEU  68   4.521   5.777  -5.127
  518   1HB   LEU  68          2HB       LEU  68   3.540   5.595  -2.510
  519   2HB   LEU  68          1HB       LEU  68   3.194   7.254  -3.000
  520    HG   LEU  68           HG       LEU  68   2.197   6.350  -5.123
  521   1HD1  LEU  68          1HD1      LEU  68   3.480   4.007  -4.347
  522   2HD1  LEU  68          2HD1      LEU  68   2.274   4.142  -5.627
  523   3HD1  LEU  68          3HD1      LEU  68   1.783   3.677  -3.999
  524   1HD2  LEU  68          1HD2      LEU  68   1.138   6.402  -2.493
  525   2HD2  LEU  68          2HD2      LEU  68   0.514   4.938  -3.254
  526   3HD2  LEU  68          3HD2      LEU  68   0.244   6.509  -4.010
  527    H    GLU  69           H        GLU  69   5.966   7.898  -2.681
  528    HA   GLU  69           HA       GLU  69   5.351  10.387  -3.905
  529   1HB   GLU  69          2HB       GLU  69   6.573   9.710  -1.636
  530   2HB   GLU  69          1HB       GLU  69   8.011   9.945  -2.618
  531   1HG   GLU  69          2HG       GLU  69   7.703  12.204  -2.774
  532   2HG   GLU  69          1HG       GLU  69   5.948  12.058  -2.853
  533    H    ASN  70           H        ASN  70   7.516   7.842  -4.701
  534    HA   ASN  70           HA       ASN  70   8.091   8.823  -7.313
  535   1HB   ASN  70          2HB       ASN  70  10.603   9.200  -6.891
  536   2HB   ASN  70          1HB       ASN  70   9.516  10.490  -6.377
  537   1HD2  ASN  70          1HD2      ASN  70  11.610  10.831  -4.926
  538   2HD2  ASN  70          2HD2      ASN  70  11.584  10.056  -3.416
  539    HA   PRO  71           HA       PRO  71   8.923   4.411  -6.546
  540   1HB   PRO  71          2HB       PRO  71   7.597   3.579  -8.810
  541   2HB   PRO  71          1HB       PRO  71   6.807   3.837  -7.246
  542   1HG   PRO  71          2HG       PRO  71   6.721   5.536  -9.696
  543   2HG   PRO  71          1HG       PRO  71   5.527   5.379  -8.397
  544   1HD   PRO  71          2HD       PRO  71   7.358   7.509  -8.700
  545   2HD   PRO  71          1HD       PRO  71   6.417   7.147  -7.237
  546    H    LYS  72           H        LYS  72   9.069   6.128  -9.684
  547    HA   LYS  72           HA       LYS  72  10.991   4.399 -10.889
  548   1HB   LYS  72          2HB       LYS  72   9.580   6.290 -11.971
  549   2HB   LYS  72          1HB       LYS  72  10.867   7.365 -11.425
  550   1HG   LYS  72          2HG       LYS  72  12.426   6.463 -12.870
  551   2HG   LYS  72          1HG       LYS  72  11.657   4.875 -12.876
  552   1HD   LYS  72          2HD       LYS  72   9.929   6.965 -13.978
  553   2HD   LYS  72          1HD       LYS  72  11.433   6.782 -14.880
  554   1HE   LYS  72          2HE       LYS  72  10.286   5.102 -15.924
  555   2HE   LYS  72          1HE       LYS  72  10.782   4.172 -14.508
  556   1HZ   LYS  72          1HZ       LYS  72   8.274   4.348 -15.232
  557   2HZ   LYS  72          2HZ       LYS  72   8.342   5.772 -14.307
  558   3HZ   LYS  72          3HZ       LYS  72   8.721   4.276 -13.598
  559    H    LYS  73           H        LYS  73  11.244   6.822  -8.441
  560    HA   LYS  73           HA       LYS  73  14.162   7.111  -8.771
  561   1HB   LYS  73          2HB       LYS  73  12.213   8.242  -6.741
  562   2HB   LYS  73          1HB       LYS  73  13.941   8.599  -6.759
  563   1HG   LYS  73          2HG       LYS  73  12.456   8.963  -9.319
  564   2HG   LYS  73          1HG       LYS  73  12.155  10.142  -8.042
  565   1HD   LYS  73          2HD       LYS  73  14.870   9.389  -9.163
  566   2HD   LYS  73          1HD       LYS  73  14.006  10.898  -9.463
  567   1HE   LYS  73          2HE       LYS  73  15.030  11.739  -7.641
  568   2HE   LYS  73          1HE       LYS  73  14.042  10.644  -6.674
  569   1HZ   LYS  73          1HZ       LYS  73  16.833  10.424  -7.459
  570   2HZ   LYS  73          2HZ       LYS  73  15.938   8.981  -7.478
  571   3HZ   LYS  73          3HZ       LYS  73  16.057   9.892  -6.049
  572    H    TYR  74           H        TYR  74  11.836   5.615  -6.544
  573    HA   TYR  74           HA       TYR  74  13.905   4.631  -4.740
  574   1HB   TYR  74          2HB       TYR  74  11.597   5.005  -3.950
  575   2HB   TYR  74          1HB       TYR  74  11.002   3.805  -5.095
  576    HD1  TYR  74           HD1      TYR  74  10.040   2.421  -3.308
  577    HD2  TYR  74           HD2      TYR  74  14.234   3.337  -3.411
  578    HE1  TYR  74           HE1      TYR  74  10.469   0.629  -1.648
  579    HE2  TYR  74           HE2      TYR  74  14.664   1.543  -1.751
  580    HH   TYR  74           HH       TYR  74  13.550   0.265  -0.097
  581    H    ILE  75           H        ILE  75  11.559   2.802  -6.726
  582    HA   ILE  75           HA       ILE  75  13.524   0.640  -7.031
  583    HB   ILE  75           HB       ILE  75  10.711   0.755  -8.111
  584   1HG1  ILE  75          2HG1      ILE  75  10.732   1.454  -5.712
  585   2HG1  ILE  75          1HG1      ILE  75   9.937  -0.101  -5.955
  586   1HG2  ILE  75          1HG2      ILE  75  11.671  -1.204  -8.836
  587   2HG2  ILE  75          2HG2      ILE  75  11.060  -1.728  -7.267
  588   3HG2  ILE  75          3HG2      ILE  75  12.762  -1.305  -7.455
  589   1HD1  ILE  75          1HD1      ILE  75  12.768   0.361  -4.986
  590   2HD1  ILE  75          2HD1      ILE  75  12.121  -1.224  -5.409
  591   3HD1  ILE  75          3HD1      ILE  75  11.430  -0.319  -4.062
  592    HA   PRO  76           HA       PRO  76  14.386   2.583 -11.016
  593   1HB   PRO  76          2HB       PRO  76  16.702   1.166 -11.447
  594   2HB   PRO  76          1HB       PRO  76  16.618   2.635 -10.459
  595   1HG   PRO  76          2HG       PRO  76  16.867  -0.208  -9.581
  596   2HG   PRO  76          1HG       PRO  76  17.413   1.270  -8.771
  597   1HD   PRO  76          2HD       PRO  76  15.096  -0.201  -8.110
  598   2HD   PRO  76          1HD       PRO  76  15.461   1.454  -7.581
  599    H    GLY  77           H        GLY  77  12.544   1.451 -11.982
  600   1HA   GLY  77          2HA       GLY  77  12.923  -0.139 -14.139
  601   2HA   GLY  77          1HA       GLY  77  12.937  -1.337 -12.844
  602    H    THR  78           H        THR  78  11.000   0.326 -11.248
  603    HA   THR  78           HA       THR  78   8.608  -0.938 -11.768
  604    HB   THR  78           HB       THR  78   9.020   0.663  -9.873
  605    HG1  THR  78           HG1      THR  78   6.855  -0.019 -10.926
  606   1HG2  THR  78          1HG2      THR  78   9.948   2.495 -11.281
  607   2HG2  THR  78          2HG2      THR  78   8.616   3.044 -10.262
  608   3HG2  THR  78          3HG2      THR  78   8.347   2.739 -11.978
  609    H    LYS  79           H        LYS  79   6.813  -0.597 -13.103
  610    HA   LYS  79           HA       LYS  79   7.309   1.202 -15.436
  611   1HB   LYS  79          2HB       LYS  79   5.285  -1.044 -15.306
  612   2HB   LYS  79          1HB       LYS  79   5.941  -0.255 -16.741
  613   1HG   LYS  79          2HG       LYS  79   8.203  -1.187 -15.412
  614   2HG   LYS  79          1HG       LYS  79   7.027  -2.482 -15.196
  615   1HD   LYS  79          2HD       LYS  79   6.562  -2.090 -17.759
  616   2HD   LYS  79          1HD       LYS  79   8.176  -1.378 -17.735
  617   1HE   LYS  79          2HE       LYS  79   8.903  -3.511 -18.012
  618   2HE   LYS  79          1HE       LYS  79   8.561  -3.682 -16.291
  619   1HZ   LYS  79          1HZ       LYS  79   7.050  -5.191 -16.814
  620   2HZ   LYS  79          2HZ       LYS  79   7.293  -4.933 -18.475
  621   3HZ   LYS  79          3HZ       LYS  79   6.153  -4.002 -17.627
  622    H    MET  80           H        MET  80   6.048   1.697 -12.649
  623    HA   MET  80           HA       MET  80   3.254   2.151 -12.968
  624   1HB   MET  80          2HB       MET  80   5.260   3.649 -11.265
  625   2HB   MET  80          1HB       MET  80   3.517   3.778 -11.113
  626   1HG   MET  80          2HG       MET  80   4.115   1.023 -11.087
  627   2HG   MET  80          1HG       MET  80   5.289   1.772 -10.020
  628   1HE   MET  80          1HE       MET  80   2.793   4.021  -7.929
  629   2HE   MET  80          2HE       MET  80   2.117   4.174  -9.549
  630   3HE   MET  80          3HE       MET  80   3.863   4.242  -9.320
  631    H    ILE  81           H        ILE  81   2.189   3.655 -14.160
  632    HA   ILE  81           HA       ILE  81   3.772   5.863 -15.376
  633    HB   ILE  81           HB       ILE  81   0.898   5.043 -15.925
  634   1HG1  ILE  81          2HG1      ILE  81   3.191   4.443 -17.766
  635   2HG1  ILE  81          1HG1      ILE  81   2.900   3.373 -16.394
  636   1HG2  ILE  81          1HG2      ILE  81   1.068   7.164 -16.827
  637   2HG2  ILE  81          2HG2      ILE  81   1.719   6.228 -18.173
  638   3HG2  ILE  81          3HG2      ILE  81   2.813   7.041 -17.053
  639   1HD1  ILE  81          1HD1      ILE  81   0.683   2.870 -17.138
  640   2HD1  ILE  81          2HD1      ILE  81   1.718   2.729 -18.558
  641   3HD1  ILE  81          3HD1      ILE  81   0.719   4.165 -18.334
  642    H    PHE  82           H        PHE  82   2.934   5.658 -12.539
  643    HA   PHE  82           HA       PHE  82   0.730   7.382 -11.986
  644   1HB   PHE  82          2HB       PHE  82   2.351   5.784 -10.493
  645   2HB   PHE  82          1HB       PHE  82   2.973   7.376 -10.061
  646    HD1  PHE  82           HD1      PHE  82   2.100   7.866  -7.939
  647    HD2  PHE  82           HD2      PHE  82  -0.485   6.302 -10.990
  648    HE1  PHE  82           HE1      PHE  82   0.140   8.237  -6.464
  649    HE2  PHE  82           HE2      PHE  82  -2.448   6.673  -9.517
  650    HZ   PHE  82           HZ       PHE  82  -2.135   7.640  -7.255
  651    H    VAL  83           H        VAL  83   0.928   9.554 -10.964
  652    HA   VAL  83           HA       VAL  83   2.912  11.200 -12.448
  653    HB   VAL  83           HB       VAL  83   0.713  11.994 -12.836
  654   1HG1  VAL  83          1HG1      VAL  83   0.303  11.534  -9.871
  655   2HG1  VAL  83          2HG1      VAL  83  -0.526  10.742 -11.212
  656   3HG1  VAL  83          3HG1      VAL  83  -0.838  12.442 -10.863
  657   1HG2  VAL  83          1HG2      VAL  83   0.836  14.191 -12.071
  658   2HG2  VAL  83          2HG2      VAL  83   2.497  13.660 -11.807
  659   3HG2  VAL  83          3HG2      VAL  83   1.361  13.708 -10.458
  660    H    GLY  84           H        GLY  84   1.913  10.267  -9.223
  661   1HA   GLY  84          2HA       GLY  84   3.518  10.370  -7.379
  662   2HA   GLY  84          1HA       GLY  84   4.248  11.782  -8.148
  663    H    ILE  85           H        ILE  85   1.096  10.734  -6.805
  664    HA   ILE  85           HA       ILE  85   0.048  13.353  -6.416
  665    HB   ILE  85           HB       ILE  85  -0.489  10.796  -4.874
  666   1HG1  ILE  85          2HG1      ILE  85  -0.997  10.579  -7.250
  667   2HG1  ILE  85          1HG1      ILE  85  -2.510  10.731  -6.355
  668   1HG2  ILE  85          1HG2      ILE  85  -2.005  13.420  -4.999
  669   2HG2  ILE  85          2HG2      ILE  85  -1.214  12.732  -3.581
  670   3HG2  ILE  85          3HG2      ILE  85  -2.631  11.939  -4.273
  671   1HD1  ILE  85          1HD1      ILE  85  -1.375  12.500  -8.378
  672   2HD1  ILE  85          2HD1      ILE  85  -1.784  13.368  -6.898
  673   3HD1  ILE  85          3HD1      ILE  85  -3.019  12.437  -7.743
  674    H    LYS  86           H        LYS  86   0.847  14.919  -5.103
  675    HA   LYS  86           HA       LYS  86   2.659  14.172  -2.892
  676   1HB   LYS  86          2HB       LYS  86   3.079  16.587  -2.714
  677   2HB   LYS  86          1HB       LYS  86   3.257  16.058  -4.387
  678   1HG   LYS  86          2HG       LYS  86   0.611  16.671  -4.359
  679   2HG   LYS  86          1HG       LYS  86   1.213  17.828  -3.172
  680   1HD   LYS  86          2HD       LYS  86   2.770  18.761  -4.738
  681   2HD   LYS  86          1HD       LYS  86   2.486  17.457  -5.892
  682   1HE   LYS  86          2HE       LYS  86   0.796  18.620  -6.810
  683   2HE   LYS  86          1HE       LYS  86  -0.034  18.657  -5.254
  684   1HZ   LYS  86          1HZ       LYS  86   2.205  20.496  -5.728
  685   2HZ   LYS  86          2HZ       LYS  86   0.849  20.684  -4.722
  686   3HZ   LYS  86          3HZ       LYS  86   0.692  20.855  -6.405
  687    H    LYS  87           H        LYS  87  -0.631  14.538  -3.279
  688    HA   LYS  87           HA       LYS  87  -1.326  16.010  -0.902
  689   1HB   LYS  87          2HB       LYS  87  -2.781  14.077  -2.697
  690   2HB   LYS  87          1HB       LYS  87  -3.525  14.633  -1.197
  691   1HG   LYS  87          2HG       LYS  87  -4.278  16.217  -2.755
  692   2HG   LYS  87          1HG       LYS  87  -2.876  17.016  -2.043
  693   1HD   LYS  87          2HD       LYS  87  -1.473  16.326  -3.907
  694   2HD   LYS  87          1HD       LYS  87  -2.793  15.377  -4.591
  695   1HE   LYS  87          2HE       LYS  87  -3.861  17.948  -4.199
  696   2HE   LYS  87          1HE       LYS  87  -2.253  18.210  -4.873
  697   1HZ   LYS  87          1HZ       LYS  87  -3.819  17.951  -6.648
  698   2HZ   LYS  87          2HZ       LYS  87  -4.391  16.486  -6.001
  699   3HZ   LYS  87          3HZ       LYS  87  -2.811  16.586  -6.619
  700    H    LYS  88           H        LYS  88  -0.687  15.330   1.088
  701    HA   LYS  88           HA       LYS  88  -0.033  12.587   1.695
  702   1HB   LYS  88          2HB       LYS  88   0.536  14.971   2.872
  703   2HB   LYS  88          1HB       LYS  88  -0.749  14.395   3.935
  704   1HG   LYS  88          2HG       LYS  88   0.455  12.284   4.279
  705   2HG   LYS  88          1HG       LYS  88   1.727  12.814   3.179
  706   1HD   LYS  88          2HD       LYS  88   1.437  14.910   5.028
  707   2HD   LYS  88          1HD       LYS  88   1.372  13.433   5.989
  708   1HE   LYS  88          2HE       LYS  88   3.422  12.820   4.321
  709   2HE   LYS  88          1HE       LYS  88   3.617  14.570   4.423
  710   1HZ   LYS  88          1HZ       LYS  88   3.090  13.239   6.938
  711   2HZ   LYS  88          2HZ       LYS  88   4.202  14.468   6.569
  712   3HZ   LYS  88          3HZ       LYS  88   4.578  12.847   6.227
  713    H    GLU  89           H        GLU  89  -2.893  14.608   2.207
  714    HA   GLU  89           HA       GLU  89  -4.330  12.787   3.868
  715   1HB   GLU  89          2HB       GLU  89  -4.933  15.193   3.496
  716   2HB   GLU  89          1HB       GLU  89  -5.481  14.760   1.876
  717   1HG   GLU  89          2HG       GLU  89  -7.398  13.825   2.650
  718   2HG   GLU  89          1HG       GLU  89  -6.575  13.037   3.996
  719    H    GLU  90           H        GLU  90  -4.199  13.169   0.330
  720    HA   GLU  90           HA       GLU  90  -6.204  11.216  -0.269
  721   1HB   GLU  90          2HB       GLU  90  -4.190  12.742  -1.734
  722   2HB   GLU  90          1HB       GLU  90  -4.383  11.112  -2.378
  723   1HG   GLU  90          2HG       GLU  90  -5.959  12.646  -3.472
  724   2HG   GLU  90          1HG       GLU  90  -6.835  11.464  -2.500
  725    H    ARG  91           H        ARG  91  -2.641  10.933  -0.127
  726    HA   ARG  91           HA       ARG  91  -2.473   8.172  -0.724
  727   1HB   ARG  91          2HB       ARG  91  -0.675  10.150  -0.058
  728   2HB   ARG  91          1HB       ARG  91  -0.594   9.086   1.346
  729   1HG   ARG  91          2HG       ARG  91   0.687   7.668   0.163
  730   2HG   ARG  91          1HG       ARG  91  -0.665   7.411  -0.941
  731   1HD   ARG  91          2HD       ARG  91   0.610   8.376  -2.536
  732   2HD   ARG  91          1HD       ARG  91   0.345   9.899  -1.689
  733    HE   ARG  91           HE       ARG  91   2.558   8.342  -0.592
  734   1HH1  ARG  91          1HH1      ARG  91   1.911   9.834  -3.551
  735   2HH1  ARG  91          2HH1      ARG  91   3.289  10.882  -3.516
  736   1HH2  ARG  91          1HH2      ARG  91   4.183  10.036  -0.276
  737   2HH2  ARG  91          2HH2      ARG  91   4.576  10.994  -1.664
  738    H    ALA  92           H        ALA  92  -3.038   9.811   2.380
  739    HA   ALA  92           HA       ALA  92  -2.869   7.566   4.082
  740   1HB   ALA  92          1HB       ALA  92  -3.104   9.637   5.177
  741   2HB   ALA  92          2HB       ALA  92  -4.672   8.873   5.433
  742   3HB   ALA  92          3HB       ALA  92  -4.485  10.107   4.187
  743    H    ASP  93           H        ASP  93  -5.644   8.769   2.192
  744    HA   ASP  93           HA       ASP  93  -7.531   6.855   3.144
  745   1HB   ASP  93          2HB       ASP  93  -7.424   8.893   1.107
  746   2HB   ASP  93          1HB       ASP  93  -8.156   7.432   0.443
  747    H    LEU  94           H        LEU  94  -5.084   6.693   0.607
  748    HA   LEU  94           HA       LEU  94  -6.027   4.297  -0.649
  749   1HB   LEU  94          2HB       LEU  94  -3.187   5.333  -0.396
  750   2HB   LEU  94          1HB       LEU  94  -3.743   4.124  -1.553
  751    HG   LEU  94           HG       LEU  94  -5.078   6.817  -1.418
  752   1HD1  LEU  94          1HD1      LEU  94  -2.990   6.453  -3.477
  753   2HD1  LEU  94          2HD1      LEU  94  -2.378   6.637  -1.832
  754   3HD1  LEU  94          3HD1      LEU  94  -3.406   7.885  -2.535
  755   1HD2  LEU  94          1HD2      LEU  94  -6.211   5.176  -2.758
  756   2HD2  LEU  94          2HD2      LEU  94  -4.703   4.656  -3.509
  757   3HD2  LEU  94          3HD2      LEU  94  -5.373   6.244  -3.884
  758    H    ILE  95           H        ILE  95  -3.467   4.754   1.821
  759    HA   ILE  95           HA       ILE  95  -2.966   1.984   2.232
  760    HB   ILE  95           HB       ILE  95  -2.802   3.980   4.478
  761   1HG1  ILE  95          2HG1      ILE  95  -1.909   5.316   2.751
  762   2HG1  ILE  95          1HG1      ILE  95  -0.489   4.520   3.425
  763   1HG2  ILE  95          1HG2      ILE  95  -2.122   1.584   4.773
  764   2HG2  ILE  95          2HG2      ILE  95  -0.802   2.723   5.034
  765   3HG2  ILE  95          3HG2      ILE  95  -0.902   1.820   3.522
  766   1HD1  ILE  95          1HD1      ILE  95  -1.785   4.153   0.781
  767   2HD1  ILE  95          2HD1      ILE  95  -1.210   2.683   1.568
  768   3HD1  ILE  95          3HD1      ILE  95  -0.086   4.001   1.234
  769    H    ALA  96           H        ALA  96  -5.325   4.173   3.716
  770    HA   ALA  96           HA       ALA  96  -6.268   2.466   5.760
  771   1HB   ALA  96          1HB       ALA  96  -7.859   4.432   4.090
  772   2HB   ALA  96          2HB       ALA  96  -6.942   4.831   5.543
  773   3HB   ALA  96          3HB       ALA  96  -8.352   3.777   5.652
  774    H    TYR  97           H        TYR  97  -7.376   2.739   2.372
  775    HA   TYR  97           HA       TYR  97  -9.442   0.803   2.544
  776   1HB   TYR  97          2HB       TYR  97  -9.262   2.257   0.605
  777   2HB   TYR  97          1HB       TYR  97  -7.680   1.586   0.207
  778    HD1  TYR  97           HD1      TYR  97  -7.836   0.282  -1.724
  779    HD2  TYR  97           HD2      TYR  97 -10.927   0.026   1.246
  780    HE1  TYR  97           HE1      TYR  97  -8.932  -1.526  -3.019
  781    HE2  TYR  97           HE2      TYR  97 -12.024  -1.782  -0.049
  782    HH   TYR  97           HH       TYR  97 -11.108  -2.551  -3.269
  783    H    LEU  98           H        LEU  98  -6.075   0.409   1.410
  784    HA   LEU  98           HA       LEU  98  -6.252  -2.439   1.133
  785   1HB   LEU  98          2HB       LEU  98  -4.026  -0.444   1.290
  786   2HB   LEU  98          1HB       LEU  98  -3.632  -2.150   1.497
  787    HG   LEU  98           HG       LEU  98  -3.429  -1.592  -0.857
  788   1HD1  LEU  98          1HD1      LEU  98  -4.695  -3.738   0.026
  789   2HD1  LEU  98          2HD1      LEU  98  -4.659  -3.376  -1.700
  790   3HD1  LEU  98          3HD1      LEU  98  -6.087  -2.977  -0.746
  791   1HD2  LEU  98          1HD2      LEU  98  -4.965  -0.350  -2.047
  792   2HD2  LEU  98          2HD2      LEU  98  -5.276   0.310  -0.442
  793   3HD2  LEU  98          3HD2      LEU  98  -6.332  -0.939  -1.102
  794    H    LYS  99           H        LYS  99  -6.036  -0.440   3.913
  795    HA   LYS  99           HA       LYS  99  -4.713  -2.415   5.589
  796   1HB   LYS  99          2HB       LYS  99  -5.119   0.289   5.805
  797   2HB   LYS  99          1HB       LYS  99  -6.315  -0.349   6.935
  798   1HG   LYS  99          2HG       LYS  99  -3.834  -1.798   7.222
  799   2HG   LYS  99          1HG       LYS  99  -3.538  -0.065   7.375
  800   1HD   LYS  99          2HD       LYS  99  -5.504   0.018   8.981
  801   2HD   LYS  99          1HD       LYS  99  -5.491  -1.745   8.965
  802   1HE   LYS  99          2HE       LYS  99  -4.117  -1.322  10.791
  803   2HE   LYS  99          1HE       LYS  99  -2.920  -1.414   9.499
  804   1HZ   LYS  99          1HZ       LYS  99  -3.928   1.195   9.595
  805   2HZ   LYS  99          2HZ       LYS  99  -2.348   0.664   9.920
  806   3HZ   LYS  99          3HZ       LYS  99  -3.494   0.749  11.172
  807    H    LYS 100           H        LYS 100  -8.019  -1.589   4.755
  808    HA   LYS 100           HA       LYS 100  -9.006  -3.482   6.832
  809   1HB   LYS 100          2HB       LYS 100 -10.082  -1.250   6.720
  810   2HB   LYS 100          1HB       LYS 100 -10.550  -1.574   5.050
  811   1HG   LYS 100          2HG       LYS 100 -11.302  -3.685   6.977
  812   2HG   LYS 100          1HG       LYS 100 -12.124  -2.142   7.211
  813   1HD   LYS 100          2HD       LYS 100 -13.120  -2.197   5.099
  814   2HD   LYS 100          1HD       LYS 100 -11.905  -3.296   4.445
  815   1HE   LYS 100          2HE       LYS 100 -13.576  -4.837   4.747
  816   2HE   LYS 100          1HE       LYS 100 -12.927  -4.874   6.386
  817   1HZ   LYS 100          1HZ       LYS 100 -14.543  -3.143   6.985
  818   2HZ   LYS 100          2HZ       LYS 100 -15.294  -4.574   6.462
  819   3HZ   LYS 100          3HZ       LYS 100 -15.205  -3.231   5.426
  820    H    ALA 101           H        ALA 101  -9.627  -2.749   3.381
  821    HA   ALA 101           HA       ALA 101 -11.024  -5.154   2.827
  822   1HB   ALA 101          1HB       ALA 101  -9.359  -3.387   1.015
  823   2HB   ALA 101          2HB       ALA 101 -11.104  -3.306   1.263
  824   3HB   ALA 101          3HB       ALA 101 -10.394  -4.693   0.438
  825    H    THR 102           H        THR 102  -7.599  -4.539   3.159
  826    HA   THR 102           HA       THR 102  -7.130  -7.434   2.676
  827    HB   THR 102           HB       THR 102  -4.876  -6.111   1.611
  828    HG1  THR 102           HG1      THR 102  -7.338  -5.104   0.626
  829   1HG2  THR 102          1HG2      THR 102  -5.768  -8.284   0.901
  830   2HG2  THR 102          2HG2      THR 102  -5.620  -7.199  -0.480
  831   3HG2  THR 102          3HG2      THR 102  -7.201  -7.493   0.245
  832    H    ASN 103           H        ASN 103  -7.236  -6.254   5.193
  833    HA   ASN 103           HA       ASN 103  -4.810  -7.046   6.376
  834   1HB   ASN 103          2HB       ASN 103  -4.362  -4.692   5.031
  835   2HB   ASN 103          1HB       ASN 103  -4.734  -4.116   6.656
  836   1HD2  ASN 103          1HD2      ASN 103  -2.544  -3.584   7.253
  837   2HD2  ASN 103          2HD2      ASN 103  -1.339  -4.765   7.434
  838    H    GLU 104           HN       GLU 104  -7.460  -7.367   7.076
  839    HA   GLU 104           HA       GLU 104  -7.566  -5.852   9.646
  840   1HB   GLU 104          2HB       GLU 104  -9.222  -4.971   7.939
  841   2HB   GLU 104          1HB       GLU 104 -10.005  -6.549   7.992
  842   1HG   GLU 104          2HG       GLU 104  -9.774  -5.951  10.664
  843   2HG   GLU 104          1HG       GLU 104 -10.061  -4.359   9.961
  844    HHA  HEC 105           HHA      HEC 105   4.099  -2.912  -8.835
  845    HHB  HEC 105           HHB      HEC 105   1.190   0.763  -4.584
  846    HHC  HEC 105           HHC      HEC 105  -1.718   3.872  -9.262
  847    HHD  HEC 105           HHD      HEC 105   1.149   0.169 -13.500
  848   1HMA  HEC 105          1HMA      HEC 105   2.209  -1.969  -3.639
  849   2HMA  HEC 105          2HMA      HEC 105   2.770  -0.299  -3.589
  850   3HMA  HEC 105          3HMA      HEC 105   3.932  -1.614  -3.762
  851   1HAA  HEC 105          1HAA      HEC 105   4.906  -2.865  -5.220
  852   2HAA  HEC 105          2HAA      HEC 105   5.151  -3.064  -6.943
  853   1HBA  HEC 105          1HBA      HEC 105   2.848  -4.437  -6.671
  854   2HBA  HEC 105          2HBA      HEC 105   3.523  -4.678  -5.060
  855   1HMB  HEC 105          1HMB      HEC 105  -1.450   2.190  -3.920
  856   2HMB  HEC 105          2HMB      HEC 105  -0.818   3.828  -4.074
  857   3HMB  HEC 105          3HMB      HEC 105   0.280   2.488  -3.752
  858    HAB  HEC 105           HAB      HEC 105  -2.088   4.931  -7.534
  859   1HBB  HEC 105          1HBB      HEC 105  -2.055   5.164  -4.610
  860   2HBB  HEC 105          2HBB      HEC 105  -0.538   5.433  -5.469
  861   3HBB  HEC 105          3HBB      HEC 105  -1.959   6.397  -5.867
  862   1HMC  HEC 105          1HMC      HEC 105  -2.438   3.863 -12.986
  863   2HMC  HEC 105          2HMC      HEC 105  -2.912   3.882 -11.287
  864   3HMC  HEC 105          3HMC      HEC 105  -1.604   4.924 -11.850
  865    HAC  HEC 105           HAC      HEC 105  -0.152   1.298 -14.522
  866   1HBC  HEC 105          1HBC      HEC 105  -0.988   4.126 -14.155
  867   2HBC  HEC 105          2HBC      HEC 105  -1.182   3.294 -15.698
  868   3HBC  HEC 105          3HBC      HEC 105   0.421   3.465 -14.984
  869   1HMD  HEC 105          1HMD      HEC 105   2.272  -2.465 -14.186
  870   2HMD  HEC 105          2HMD      HEC 105   2.951  -0.843 -14.324
  871   3HMD  HEC 105          3HMD      HEC 105   4.007  -2.216 -13.995
  872   1HAD  HEC 105          1HAD      HEC 105   5.429  -2.946 -11.628
  873   2HAD  HEC 105          2HAD      HEC 105   4.434  -3.939 -10.580
  874   1HBD  HEC 105          1HBD      HEC 105   3.212  -3.985 -13.135
  875   2HBD  HEC 105          2HBD      HEC 105   4.032  -5.304 -12.305
  Start of MODEL    9
    1   1H    GLY   1          1HT       GLY   1  -8.916  10.349   6.774
    2   2H    GLY   1          2HT       GLY   1  -9.825   9.188   5.930
    3   3H    GLY   1          3HT       GLY   1  -9.463   8.957   7.573
    4   1HA   GLY   1          1HA       GLY   1 -10.850  10.778   8.217
    5   2HA   GLY   1          2HA       GLY   1 -11.133  11.174   6.522
    6    H    ASP   2           H        ASP   2 -12.239   9.471   5.207
    7    HA   ASP   2           HA       ASP   2 -14.050   7.814   6.920
    8   1HB   ASP   2          2HB       ASP   2 -14.732   9.873   5.142
    9   2HB   ASP   2          1HB       ASP   2 -15.104   8.383   4.273
   10    H    VAL   3           H        VAL   3 -14.933   5.875   5.711
   11    HA   VAL   3           HA       VAL   3 -12.704   4.576   4.254
   12    HB   VAL   3           HB       VAL   3 -13.850   3.407   6.149
   13   1HG1  VAL   3          1HG1      VAL   3 -16.192   3.040   4.289
   14   2HG1  VAL   3          2HG1      VAL   3 -16.131   4.414   5.393
   15   3HG1  VAL   3          3HG1      VAL   3 -16.112   2.769   6.031
   16   1HG2  VAL   3          1HG2      VAL   3 -12.712   2.122   4.371
   17   2HG2  VAL   3          2HG2      VAL   3 -14.196   2.126   3.418
   18   3HG2  VAL   3          3HG2      VAL   3 -14.136   1.260   4.954
   19    H    GLU   4           H        GLU   4 -16.085   5.530   3.781
   20    HA   GLU   4           HA       GLU   4 -16.418   4.292   1.215
   21   1HB   GLU   4          2HB       GLU   4 -17.760   6.791   2.298
   22   2HB   GLU   4          1HB       GLU   4 -18.335   5.802   0.955
   23   1HG   GLU   4          2HG       GLU   4 -17.960   3.957   3.000
   24   2HG   GLU   4          1HG       GLU   4 -18.621   5.365   3.832
   25    H    LYS   5           H        LYS   5 -14.512   6.930   2.205
   26    HA   LYS   5           HA       LYS   5 -14.569   8.249  -0.442
   27   1HB   LYS   5          2HB       LYS   5 -13.411   8.875   2.243
   28   2HB   LYS   5          1HB       LYS   5 -12.629   9.575   0.827
   29   1HG   LYS   5          2HG       LYS   5 -14.593  10.726   0.169
   30   2HG   LYS   5          1HG       LYS   5 -15.616   9.749   1.223
   31   1HD   LYS   5          2HD       LYS   5 -14.509  10.736   3.204
   32   2HD   LYS   5          1HD       LYS   5 -13.514  11.733   2.143
   33   1HE   LYS   5          2HE       LYS   5 -15.673  12.653   1.170
   34   2HE   LYS   5          1HE       LYS   5 -16.519  11.837   2.485
   35   1HZ   LYS   5          1HZ       LYS   5 -14.246  13.636   3.035
   36   2HZ   LYS   5          2HZ       LYS   5 -15.504  13.159   4.071
   37   3HZ   LYS   5          3HZ       LYS   5 -15.807  14.259   2.813
   38    H    GLY   6           H        GLY   6 -12.099   6.756   1.682
   39   1HA   GLY   6          1HA       GLY   6  -9.983   6.748  -0.190
   40   2HA   GLY   6          2HA       GLY   6 -10.147   5.582   1.123
   41    H    LYS   7           H        LYS   7 -12.606   4.393   0.288
   42    HA   LYS   7           HA       LYS   7 -11.714   2.359  -1.442
   43   1HB   LYS   7          2HB       LYS   7 -13.698   1.974  -0.156
   44   2HB   LYS   7          1HB       LYS   7 -14.504   3.377  -0.859
   45   1HG   LYS   7          2HG       LYS   7 -14.657   2.319  -3.010
   46   2HG   LYS   7          1HG       LYS   7 -13.599   1.001  -2.503
   47   1HD   LYS   7          2HD       LYS   7 -15.243  -0.003  -1.200
   48   2HD   LYS   7          1HD       LYS   7 -16.121   1.508  -0.962
   49   1HE   LYS   7          2HE       LYS   7 -17.494   0.396  -2.493
   50   2HE   LYS   7          1HE       LYS   7 -16.493   1.385  -3.556
   51   1HZ   LYS   7          1HZ       LYS   7 -16.343  -0.693  -4.505
   52   2HZ   LYS   7          2HZ       LYS   7 -16.330  -1.505  -3.013
   53   3HZ   LYS   7          3HZ       LYS   7 -14.951  -0.660  -3.537
   54    H    LYS   8           H        LYS   8 -13.337   5.421  -2.217
   55    HA   LYS   8           HA       LYS   8 -13.570   4.807  -5.048
   56   1HB   LYS   8          2HB       LYS   8 -14.735   6.665  -3.444
   57   2HB   LYS   8          1HB       LYS   8 -13.486   7.649  -4.208
   58   1HG   LYS   8          2HG       LYS   8 -14.295   7.179  -6.391
   59   2HG   LYS   8          1HG       LYS   8 -15.289   5.839  -5.817
   60   1HD   LYS   8          2HD       LYS   8 -16.934   7.229  -4.986
   61   2HD   LYS   8          1HD       LYS   8 -15.808   8.549  -4.672
   62   1HE   LYS   8          2HE       LYS   8 -15.615   8.382  -7.376
   63   2HE   LYS   8          1HE       LYS   8 -17.290   7.880  -7.148
   64   1HZ   LYS   8          1HZ       LYS   8 -17.670   9.875  -5.837
   65   2HZ   LYS   8          2HZ       LYS   8 -17.124  10.270  -7.397
   66   3HZ   LYS   8          3HZ       LYS   8 -16.062  10.361  -6.074
   67    H    ILE   9           H        ILE   9 -11.118   6.226  -2.991
   68    HA   ILE   9           HA       ILE   9  -9.589   7.562  -4.994
   69    HB   ILE   9           HB       ILE   9  -8.681   6.190  -2.445
   70   1HG1  ILE   9          2HG1      ILE   9  -9.265   9.104  -3.068
   71   2HG1  ILE   9          1HG1      ILE   9 -10.343   8.031  -2.173
   72   1HG2  ILE   9          1HG2      ILE   9  -6.710   7.733  -2.679
   73   2HG2  ILE   9          2HG2      ILE   9  -7.275   8.133  -4.300
   74   3HG2  ILE   9          3HG2      ILE   9  -6.777   6.484  -3.920
   75   1HD1  ILE   9          1HD1      ILE   9  -7.849   9.350  -1.298
   76   2HD1  ILE   9          2HD1      ILE   9  -7.998   7.658  -0.822
   77   3HD1  ILE   9          3HD1      ILE   9  -9.237   8.819  -0.348
   78    H    PHE  10           H        PHE  10  -8.874   4.351  -3.540
   79    HA   PHE  10           HA       PHE  10  -7.051   3.601  -5.617
   80   1HB   PHE  10          2HB       PHE  10  -7.275   2.492  -3.339
   81   2HB   PHE  10          1HB       PHE  10  -8.723   1.696  -3.956
   82    HD1  PHE  10           HD1      PHE  10  -5.070   1.833  -4.065
   83    HD2  PHE  10           HD2      PHE  10  -8.566   0.084  -5.852
   84    HE1  PHE  10           HE1      PHE  10  -3.657   0.103  -5.144
   85    HE2  PHE  10           HE2      PHE  10  -7.138  -1.647  -6.928
   86    HZ   PHE  10           HZ       PHE  10  -4.704  -1.637  -6.577
   87    H    ILE  11           H        ILE  11 -10.527   3.018  -5.155
   88    HA   ILE  11           HA       ILE  11 -10.926   1.366  -7.446
   89    HB   ILE  11           HB       ILE  11 -12.734   3.220  -5.892
   90   1HG1  ILE  11          2HG1      ILE  11 -11.916   0.989  -4.975
   91   2HG1  ILE  11          1HG1      ILE  11 -13.668   1.175  -5.054
   92   1HG2  ILE  11          1HG2      ILE  11 -13.930   3.337  -7.854
   93   2HG2  ILE  11          2HG2      ILE  11 -14.500   1.761  -7.303
   94   3HG2  ILE  11          3HG2      ILE  11 -13.211   1.863  -8.503
   95   1HD1  ILE  11          1HD1      ILE  11 -13.881  -0.494  -6.566
   96   2HD1  ILE  11          2HD1      ILE  11 -12.223  -0.928  -6.144
   97   3HD1  ILE  11          3HD1      ILE  11 -12.537   0.111  -7.536
   98    H    MET  12           H        MET  12 -10.263   4.741  -7.153
   99    HA   MET  12           HA       MET  12 -10.819   5.053 -10.075
  100   1HB   MET  12          2HB       MET  12 -12.445   6.283  -8.542
  101   2HB   MET  12          1HB       MET  12 -11.077   7.279  -8.042
  102   1HG   MET  12          2HG       MET  12 -11.771   8.574  -9.803
  103   2HG   MET  12          1HG       MET  12 -10.779   7.439 -10.719
  104   1HE   MET  12          1HE       MET  12 -12.793   7.136 -13.373
  105   2HE   MET  12          2HE       MET  12 -11.760   8.273 -12.509
  106   3HE   MET  12          3HE       MET  12 -13.472   8.632 -12.718
  107    H    LYS  13           H        LYS  13  -8.360   4.514  -8.251
  108    HA   LYS  13           HA       LYS  13  -6.682   6.640  -9.510
  109   1HB   LYS  13          2HB       LYS  13  -7.031   6.991  -7.018
  110   2HB   LYS  13          1HB       LYS  13  -6.160   5.478  -6.763
  111   1HG   LYS  13          2HG       LYS  13  -4.168   6.464  -7.127
  112   2HG   LYS  13          1HG       LYS  13  -4.743   7.222  -8.612
  113   1HD   LYS  13          2HD       LYS  13  -6.042   8.556  -6.477
  114   2HD   LYS  13          1HD       LYS  13  -4.343   8.420  -6.024
  115   1HE   LYS  13          2HE       LYS  13  -4.730  10.479  -7.319
  116   2HE   LYS  13          1HE       LYS  13  -3.686   9.371  -8.210
  117   1HZ   LYS  13          1HZ       LYS  13  -5.487  10.351  -9.565
  118   2HZ   LYS  13          2HZ       LYS  13  -6.625   9.557  -8.585
  119   3HZ   LYS  13          3HZ       LYS  13  -5.531   8.656  -9.521
  120    H    CYS  14           H        CYS  14  -6.566   3.447  -7.884
  121    HA   CYS  14           HA       CYS  14  -4.549   2.657  -9.945
  122   1HB   CYS  14          2HB       CYS  14  -4.365   1.148  -7.432
  123   2HB   CYS  14          1HB       CYS  14  -3.085   1.893  -8.381
  124    H    SER  15           H        SER  15  -7.565   2.311  -9.646
  125    HA   SER  15           HA       SER  15  -7.841  -0.602  -9.275
  126   1HB   SER  15          2HB       SER  15  -9.563   1.319  -8.685
  127   2HB   SER  15          1HB       SER  15 -10.030   1.125 -10.368
  128    HG   SER  15           HG       SER  15 -11.027  -0.623  -9.793
  129    H    GLN  16           H        GLN  16  -6.810   1.342 -11.758
  130    HA   GLN  16           HA       GLN  16  -8.115  -0.214 -13.912
  131   1HB   GLN  16          2HB       GLN  16  -6.267   2.177 -13.869
  132   2HB   GLN  16          1HB       GLN  16  -6.627   1.311 -15.363
  133   1HG   GLN  16          2HG       GLN  16  -9.083   1.635 -14.847
  134   2HG   GLN  16          1HG       GLN  16  -8.594   2.708 -13.535
  135   1HE2  GLN  16          1HE2      GLN  16  -9.555   4.581 -14.640
  136   2HE2  GLN  16          2HE2      GLN  16  -8.809   5.267 -16.001
  137    H    CYS  17           H        CYS  17  -4.873   0.457 -12.613
  138    HA   CYS  17           HA       CYS  17  -3.756  -1.739 -14.246
  139   1HB   CYS  17          2HB       CYS  17  -2.609   0.461 -12.549
  140   2HB   CYS  17          1HB       CYS  17  -1.628  -0.970 -12.865
  141    H    HIS  18           H        HIS  18  -4.526  -0.937 -10.877
  142    HA   HIS  18           HA       HIS  18  -3.744  -3.724 -10.107
  143   1HB   HIS  18          2HB       HIS  18  -4.207  -1.309  -8.342
  144   2HB   HIS  18          1HB       HIS  18  -3.744  -2.912  -7.784
  145    HD1  HIS  18           HD1      HIS  18  -1.303  -3.529  -7.913
  146    HD2  HIS  18           HD2      HIS  18  -2.161   0.020  -9.891
  147    HE1  HIS  18           HE1      HIS  18   0.924  -2.449  -8.426
  148    H    THR  19           H        THR  19  -5.821  -4.585 -10.899
  149    HA   THR  19           HA       THR  19  -8.273  -3.567  -9.666
  150    HB   THR  19           HB       THR  19  -9.197  -5.775 -10.711
  151    HG1  THR  19           HG1      THR  19  -7.711  -6.993 -11.511
  152   1HG2  THR  19          1HG2      THR  19  -9.854  -4.319 -12.286
  153   2HG2  THR  19          2HG2      THR  19  -8.256  -4.382 -13.029
  154   3HG2  THR  19          3HG2      THR  19  -8.594  -3.203 -11.762
  155    H    VAL  20           H        VAL  20  -8.185  -3.850  -7.445
  156    HA   VAL  20           HA       VAL  20  -7.261  -6.402  -6.317
  157    HB   VAL  20           HB       VAL  20  -7.429  -5.327  -4.198
  158   1HG1  VAL  20          1HG1      VAL  20  -6.558  -3.501  -6.425
  159   2HG1  VAL  20          2HG1      VAL  20  -5.563  -4.402  -5.281
  160   3HG1  VAL  20          3HG1      VAL  20  -6.455  -2.979  -4.744
  161   1HG2  VAL  20          1HG2      VAL  20  -9.663  -4.011  -5.453
  162   2HG2  VAL  20          2HG2      VAL  20  -8.585  -2.794  -4.768
  163   3HG2  VAL  20          3HG2      VAL  20  -9.244  -4.066  -3.740
  164    H    GLU  21           H        GLU  21  -9.682  -6.443  -7.994
  165    HA   GLU  21           HA       GLU  21 -11.419  -7.860  -6.097
  166   1HB   GLU  21          2HB       GLU  21 -12.085  -5.196  -7.207
  167   2HB   GLU  21          1HB       GLU  21 -13.359  -6.408  -7.347
  168   1HG   GLU  21          2HG       GLU  21 -12.952  -6.915  -4.872
  169   2HG   GLU  21          1HG       GLU  21 -11.990  -5.436  -4.831
  170    H    LYS  22           H        LYS  22  -9.782  -8.203  -8.665
  171    HA   LYS  22           HA       LYS  22 -11.849  -8.959 -10.624
  172   1HB   LYS  22          2HB       LYS  22  -9.411  -7.981 -11.019
  173   2HB   LYS  22          1HB       LYS  22  -8.962  -9.684 -10.934
  174   1HG   LYS  22          2HG       LYS  22  -9.640  -9.939 -13.064
  175   2HG   LYS  22          1HG       LYS  22 -11.281  -9.523 -12.566
  176   1HD   LYS  22          2HD       LYS  22 -11.083  -7.330 -13.247
  177   2HD   LYS  22          1HD       LYS  22  -9.349  -7.278 -12.925
  178   1HE   LYS  22          2HE       LYS  22  -8.914  -7.718 -15.087
  179   2HE   LYS  22          1HE       LYS  22  -9.834  -9.219 -14.979
  180   1HZ   LYS  22          1HZ       LYS  22 -10.872  -7.918 -16.624
  181   2HZ   LYS  22          2HZ       LYS  22 -10.839  -6.517 -15.662
  182   3HZ   LYS  22          3HZ       LYS  22 -11.870  -7.805 -15.257
  183    H    GLY  23           H        GLY  23  -9.077 -10.714  -9.169
  184   1HA   GLY  23          2HA       GLY  23 -10.128 -12.816  -7.888
  185   2HA   GLY  23          1HA       GLY  23 -10.567 -13.247  -9.541
  186    H    GLY  24           H        GLY  24  -7.675 -12.113  -7.746
  187   1HA   GLY  24          1HA       GLY  24  -5.448 -12.843  -7.868
  188   2HA   GLY  24          2HA       GLY  24  -6.090 -14.388  -8.428
  189    H    LYS  25           H        LYS  25  -7.115 -11.754 -10.323
  190    HA   LYS  25           HA       LYS  25  -5.234 -12.590 -12.472
  191   1HB   LYS  25          2HB       LYS  25  -7.816 -12.515 -12.743
  192   2HB   LYS  25          1HB       LYS  25  -7.607 -10.765 -12.836
  193   1HG   LYS  25          2HG       LYS  25  -6.645 -10.862 -14.897
  194   2HG   LYS  25          1HG       LYS  25  -5.741 -12.327 -14.513
  195   1HD   LYS  25          2HD       LYS  25  -7.772 -13.678 -14.792
  196   2HD   LYS  25          1HD       LYS  25  -8.708 -12.221 -15.132
  197   1HE   LYS  25          2HE       LYS  25  -6.291 -12.520 -16.793
  198   2HE   LYS  25          1HE       LYS  25  -7.508 -13.770 -17.052
  199   1HZ   LYS  25          1HZ       LYS  25  -7.531 -11.236 -18.086
  200   2HZ   LYS  25          2HZ       LYS  25  -8.677 -11.180 -16.833
  201   3HZ   LYS  25          3HZ       LYS  25  -8.828 -12.329 -18.075
  202    H    HIS  26           H        HIS  26  -4.210 -10.904 -13.782
  203    HA   HIS  26           HA       HIS  26  -4.204  -8.165 -12.718
  204   1HB   HIS  26          2HB       HIS  26  -1.498  -8.567 -12.910
  205   2HB   HIS  26          1HB       HIS  26  -2.394  -8.563 -11.396
  206    HD1  HIS  26           HD1      HIS  26  -2.430 -11.325 -14.009
  207    HD2  HIS  26           HD2      HIS  26  -1.080 -10.671 -10.115
  208    HE1  HIS  26           HE1      HIS  26  -1.638 -13.567 -13.140
  209    H    LYS  27           H        LYS  27  -4.293  -6.918 -14.515
  210    HA   LYS  27           HA       LYS  27  -3.314  -8.010 -17.064
  211   1HB   LYS  27          2HB       LYS  27  -5.532  -7.036 -17.121
  212   2HB   LYS  27          1HB       LYS  27  -4.933  -5.540 -16.407
  213   1HG   LYS  27          2HG       LYS  27  -4.670  -4.806 -18.530
  214   2HG   LYS  27          1HG       LYS  27  -3.280  -5.888 -18.607
  215   1HD   LYS  27          2HD       LYS  27  -4.912  -7.726 -19.289
  216   2HD   LYS  27          1HD       LYS  27  -6.115  -6.453 -19.497
  217   1HE   LYS  27          2HE       LYS  27  -3.492  -6.773 -20.971
  218   2HE   LYS  27          1HE       LYS  27  -5.119  -6.790 -21.650
  219   1HZ   LYS  27          1HZ       LYS  27  -5.185  -4.430 -20.527
  220   2HZ   LYS  27          2HZ       LYS  27  -4.538  -4.653 -22.082
  221   3HZ   LYS  27          3HZ       LYS  27  -3.506  -4.528 -20.739
  222    H    THR  28           H        THR  28  -3.313  -4.590 -16.203
  223    HA   THR  28           HA       THR  28  -0.518  -4.406 -17.123
  224    HB   THR  28           HB       THR  28  -2.554  -2.324 -16.284
  225    HG1  THR  28           HG1      THR  28  -2.894  -2.178 -18.355
  226   1HG2  THR  28          1HG2      THR  28  -0.919  -0.644 -16.983
  227   2HG2  THR  28          2HG2      THR  28   0.254  -1.910 -17.352
  228   3HG2  THR  28          3HG2      THR  28  -0.243  -1.626 -15.684
  229    H    GLY  29           H        GLY  29  -2.376  -3.767 -14.143
  230   1HA   GLY  29          2HA       GLY  29   0.196  -3.366 -12.710
  231   2HA   GLY  29          1HA       GLY  29  -1.383  -2.919 -12.086
  232    HA   PRO  30           HA       PRO  30   0.074  -7.314 -10.782
  233   1HB   PRO  30          2HB       PRO  30   1.181  -6.661  -8.362
  234   2HB   PRO  30          1HB       PRO  30   2.108  -6.853  -9.855
  235   1HG   PRO  30          2HG       PRO  30   1.244  -4.324  -8.488
  236   2HG   PRO  30          1HG       PRO  30   2.725  -4.661  -9.403
  237   1HD   PRO  30          2HD       PRO  30   0.593  -3.260 -10.458
  238   2HD   PRO  30          1HD       PRO  30   1.751  -4.187 -11.429
  239    H    ASN  31           H        ASN  31  -1.455  -8.446  -9.794
  240    HA   ASN  31           HA       ASN  31  -3.839  -7.385  -8.788
  241   1HB   ASN  31          2HB       ASN  31  -3.459  -9.787  -9.378
  242   2HB   ASN  31          1HB       ASN  31  -2.572  -9.979  -7.864
  243   1HD2  ASN  31          1HD2      ASN  31  -5.649  -8.257  -8.664
  244   2HD2  ASN  31          2HD2      ASN  31  -6.563  -9.040  -7.468
  245    H    LEU  32           H        LEU  32  -3.711  -5.772  -7.267
  246    HA   LEU  32           HA       LEU  32  -1.985  -5.985  -4.936
  247   1HB   LEU  32          2HB       LEU  32  -3.614  -3.945  -6.226
  248   2HB   LEU  32          1HB       LEU  32  -3.817  -3.926  -4.477
  249    HG   LEU  32           HG       LEU  32  -1.568  -3.419  -4.089
  250   1HD1  LEU  32          1HD1      LEU  32  -0.071  -3.632  -6.380
  251   2HD1  LEU  32          2HD1      LEU  32  -1.172  -5.001  -6.541
  252   3HD1  LEU  32          3HD1      LEU  32  -0.143  -4.860  -5.116
  253   1HD2  LEU  32          1HD2      LEU  32  -0.982  -1.922  -6.310
  254   2HD2  LEU  32          2HD2      LEU  32  -2.033  -1.384  -5.000
  255   3HD2  LEU  32          3HD2      LEU  32  -2.731  -2.094  -6.455
  256    H    HIS  33           H        HIS  33  -3.120  -8.145  -4.338
  257    HA   HIS  33           HA       HIS  33  -5.664  -7.636  -2.871
  258   1HB   HIS  33          2HB       HIS  33  -5.420  -9.622  -4.469
  259   2HB   HIS  33          1HB       HIS  33  -4.319 -10.316  -3.276
  260    HD1  HIS  33           HD1      HIS  33  -5.580 -11.989  -1.926
  261    HD2  HIS  33           HD2      HIS  33  -7.900  -8.622  -2.740
  262    HE1  HIS  33           HE1      HIS  33  -7.785 -12.331  -0.726
  263    H    GLY  34           H        GLY  34  -2.614  -9.440  -2.329
  264   1HA   GLY  34          2HA       GLY  34  -2.846  -8.704   0.562
  265   2HA   GLY  34          1HA       GLY  34  -2.040 -10.162  -0.022
  266    H    LEU  35           H        LEU  35  -1.748  -6.930  -1.435
  267    HA   LEU  35           HA       LEU  35   1.018  -6.958  -1.797
  268   1HB   LEU  35          2HB       LEU  35  -0.395  -5.201  -2.738
  269   2HB   LEU  35          1HB       LEU  35  -0.744  -4.584  -1.123
  270    HG   LEU  35           HG       LEU  35   1.836  -4.370  -0.890
  271   1HD1  LEU  35          1HD1      LEU  35   1.446  -4.787  -3.851
  272   2HD1  LEU  35          2HD1      LEU  35   2.645  -5.519  -2.785
  273   3HD1  LEU  35          3HD1      LEU  35   2.791  -3.822  -3.243
  274   1HD2  LEU  35          1HD2      LEU  35  -0.076  -2.579  -1.405
  275   2HD2  LEU  35          2HD2      LEU  35   0.778  -2.468  -2.944
  276   3HD2  LEU  35          3HD2      LEU  35   1.629  -2.128  -1.437
  277    H    PHE  36           H        PHE  36  -0.784  -6.307   1.154
  278    HA   PHE  36           HA       PHE  36   1.494  -5.238   2.607
  279   1HB   PHE  36          2HB       PHE  36  -1.103  -6.420   3.635
  280   2HB   PHE  36          1HB       PHE  36   0.044  -5.471   4.581
  281    HD1  PHE  36           HD1      PHE  36  -2.320  -5.365   1.726
  282    HD2  PHE  36           HD2      PHE  36   0.150  -3.079   4.396
  283    HE1  PHE  36           HE1      PHE  36  -3.386  -3.276   0.924
  284    HE2  PHE  36           HE2      PHE  36  -0.917  -0.989   3.594
  285    HZ   PHE  36           HZ       PHE  36  -2.685  -1.087   1.857
  286    H    GLY  37           H        GLY  37   3.139  -6.411   3.444
  287   1HA   GLY  37          2HA       GLY  37   4.185  -8.205   4.595
  288   2HA   GLY  37          1HA       GLY  37   2.659  -9.086   4.546
  289    H    ARG  38           H        ARG  38   2.942  -8.133   1.468
  290    HA   ARG  38           HA       ARG  38   4.448 -10.606   0.720
  291   1HB   ARG  38          2HB       ARG  38   2.076 -10.612   0.042
  292   2HB   ARG  38          1HB       ARG  38   2.318  -9.094  -0.825
  293   1HG   ARG  38          2HG       ARG  38   4.086 -10.252  -2.200
  294   2HG   ARG  38          1HG       ARG  38   3.609 -11.767  -1.432
  295   1HD   ARG  38          2HD       ARG  38   1.913 -11.979  -2.892
  296   2HD   ARG  38          1HD       ARG  38   1.238 -10.450  -2.332
  297    HE   ARG  38           HE       ARG  38   2.562 -10.837  -4.835
  298   1HH1  ARG  38          1HH2      ARG  38   0.874  -8.494  -3.520
  299   2HH1  ARG  38          2HH2      ARG  38   1.960  -7.179  -3.823
  300   1HH2  ARG  38          1HH1      ARG  38   4.634  -9.226  -4.644
  301   2HH2  ARG  38          2HH1      ARG  38   4.088  -7.594  -4.460
  302    H    LYS  39           H        LYS  39   6.511  -9.997   0.202
  303    HA   LYS  39           HA       LYS  39   7.281  -7.412  -0.728
  304   1HB   LYS  39          2HB       LYS  39   9.433  -8.372  -1.165
  305   2HB   LYS  39          1HB       LYS  39   8.799  -9.218   0.247
  306   1HG   LYS  39          2HG       LYS  39   8.005 -11.050  -1.221
  307   2HG   LYS  39          1HG       LYS  39   8.685 -10.212  -2.617
  308   1HD   LYS  39          2HD       LYS  39  10.928 -10.278  -1.446
  309   2HD   LYS  39          1HD       LYS  39  10.192 -11.336  -0.241
  310   1HE   LYS  39          2HE       LYS  39  10.340 -13.120  -1.610
  311   2HE   LYS  39          1HE       LYS  39   9.576 -12.238  -2.932
  312   1HZ   LYS  39          1HZ       LYS  39  12.432 -12.444  -2.248
  313   2HZ   LYS  39          2HZ       LYS  39  11.863 -11.093  -3.105
  314   3HZ   LYS  39          3HZ       LYS  39  11.674 -12.653  -3.750
  315    H    THR  40           H        THR  40   7.804  -6.705  -2.856
  316    HA   THR  40           HA       THR  40   6.036  -7.270  -4.928
  317    HB   THR  40           HB       THR  40   7.292  -5.422  -5.473
  318    HG1  THR  40           HG1      THR  40   7.571  -6.474  -7.322
  319   1HG2  THR  40          1HG2      THR  40   8.958  -5.176  -3.930
  320   2HG2  THR  40          2HG2      THR  40   9.968  -5.776  -5.242
  321   3HG2  THR  40          3HG2      THR  40   9.405  -6.881  -3.992
  322    H    GLY  41           H        GLY  41   6.838  -8.222  -7.166
  323   1HA   GLY  41          2HA       GLY  41   7.302 -10.188  -8.354
  324   2HA   GLY  41          1HA       GLY  41   8.713 -10.325  -7.308
  325    H    GLN  42           H        GLN  42   5.398 -11.346  -7.800
  326    HA   GLN  42           HA       GLN  42   5.887 -13.646  -6.020
  327   1HB   GLN  42          2HB       GLN  42   4.611 -11.458  -4.945
  328   2HB   GLN  42          1HB       GLN  42   3.254 -12.432  -5.514
  329   1HG   GLN  42          2HG       GLN  42   3.801 -13.086  -3.228
  330   2HG   GLN  42          1HG       GLN  42   4.222 -14.403  -4.324
  331   1HE2  GLN  42          1HE2      GLN  42   6.059 -11.376  -3.762
  332   2HE2  GLN  42          2HE2      GLN  42   7.455 -12.145  -3.184
  333    H    ALA  43           H        ALA  43   3.565 -11.947  -8.129
  334    HA   ALA  43           HA       ALA  43   1.885 -14.159  -8.701
  335   1HB   ALA  43          1HB       ALA  43   2.610 -11.650 -10.189
  336   2HB   ALA  43          2HB       ALA  43   1.059 -12.120  -9.494
  337   3HB   ALA  43          3HB       ALA  43   1.626 -12.879 -10.981
  338    HA   PRO  44           HA       PRO  44   4.516 -16.702 -11.154
  339   1HB   PRO  44          2HB       PRO  44   2.551 -18.266 -12.268
  340   2HB   PRO  44          1HB       PRO  44   3.100 -18.430 -10.590
  341   1HG   PRO  44          2HG       PRO  44   0.568 -17.250 -11.627
  342   2HG   PRO  44          1HG       PRO  44   0.905 -17.972 -10.045
  343   1HD   PRO  44          2HD       PRO  44   0.766 -15.195 -10.623
  344   2HD   PRO  44          1HD       PRO  44   1.373 -15.929  -9.123
  345    H    GLY  45           H        GLY  45   1.488 -16.030 -12.972
  346   1HA   GLY  45          2HA       GLY  45   3.034 -15.771 -15.462
  347   2HA   GLY  45          1HA       GLY  45   1.276 -15.697 -15.320
  348    H    TYR  46           H        TYR  46   3.817 -13.804 -13.681
  349    HA   TYR  46           HA       TYR  46   3.152 -11.384 -15.184
  350   1HB   TYR  46          2HB       TYR  46   1.294 -11.631 -13.473
  351   2HB   TYR  46          1HB       TYR  46   2.517 -11.476 -12.220
  352    HD1  TYR  46           HD1      TYR  46   4.059  -9.360 -14.269
  353    HD2  TYR  46           HD2      TYR  46   0.221  -9.627 -12.401
  354    HE1  TYR  46           HE1      TYR  46   3.857  -6.927 -14.363
  355    HE2  TYR  46           HE2      TYR  46   0.048  -7.166 -12.500
  356    HH   TYR  46           HH       TYR  46   1.186  -5.246 -12.840
  357    H    SER  47           H        SER  47   5.197 -10.609 -15.462
  358    HA   SER  47           HA       SER  47   7.286 -11.084 -13.458
  359   1HB   SER  47          2HB       SER  47   7.206  -9.563 -16.076
  360   2HB   SER  47          1HB       SER  47   8.618  -9.546 -15.023
  361    HG   SER  47           HG       SER  47   8.837 -11.723 -15.296
  362    H    TYR  48           H        TYR  48   6.023  -9.990 -11.736
  363    HA   TYR  48           HA       TYR  48   5.091  -7.386 -11.599
  364   1HB   TYR  48          2HB       TYR  48   6.368  -9.265  -9.705
  365   2HB   TYR  48          1HB       TYR  48   6.309  -7.592  -9.188
  366    HD1  TYR  48           HD1      TYR  48   3.836  -9.432 -11.284
  367    HD2  TYR  48           HD2      TYR  48   4.726  -7.642  -7.498
  368    HE1  TYR  48           HE1      TYR  48   1.495  -9.808 -10.561
  369    HE2  TYR  48           HE2      TYR  48   2.378  -8.004  -6.767
  370    HH   TYR  48           HH       TYR  48   0.002  -9.533  -8.952
  371    H    THR  49           H        THR  49   6.378  -5.615 -10.180
  372    HA   THR  49           HA       THR  49   8.458  -4.559 -11.808
  373    HB   THR  49           HB       THR  49   8.832  -3.614  -9.143
  374    HG1  THR  49           HG1      THR  49   6.936  -4.335  -8.430
  375   1HG2  THR  49          1HG2      THR  49   7.340  -2.510 -11.534
  376   2HG2  THR  49          2HG2      THR  49   9.032  -2.230 -11.119
  377   3HG2  THR  49          3HG2      THR  49   7.752  -1.570 -10.099
  378    H    ALA  50           H        ALA  50   9.956  -6.310 -12.114
  379    HA   ALA  50           HA       ALA  50  11.222  -7.834 -10.123
  380   1HB   ALA  50          1HB       ALA  50  11.481  -7.573 -12.858
  381   2HB   ALA  50          2HB       ALA  50  12.500  -8.591 -11.839
  382   3HB   ALA  50          3HB       ALA  50  13.030  -6.967 -12.274
  383    H    ALA  51           H        ALA  51  12.003  -4.577 -11.298
  384    HA   ALA  51           HA       ALA  51  14.467  -4.166 -10.046
  385   1HB   ALA  51          1HB       ALA  51  12.180  -2.184 -10.227
  386   2HB   ALA  51          2HB       ALA  51  13.367  -2.490 -11.491
  387   3HB   ALA  51          3HB       ALA  51  13.875  -1.779  -9.960
  388    H    ASN  52           H        ASN  52  11.326  -3.194  -8.546
  389    HA   ASN  52           HA       ASN  52  12.358  -2.768  -5.960
  390   1HB   ASN  52          2HB       ASN  52   9.818  -2.781  -7.118
  391   2HB   ASN  52          1HB       ASN  52   9.733  -4.045  -5.893
  392   1HD2  ASN  52          1HD2      ASN  52   8.406  -1.408  -5.731
  393   2HD2  ASN  52          2HD2      ASN  52   9.051  -0.629  -4.367
  394    H    LYS  53           H        LYS  53  11.213  -5.784  -7.457
  395    HA   LYS  53           HA       LYS  53  11.286  -7.493  -5.236
  396   1HB   LYS  53          2HB       LYS  53  10.496  -8.298  -7.376
  397   2HB   LYS  53          1HB       LYS  53  12.077  -8.029  -8.111
  398   1HG   LYS  53          2HG       LYS  53  13.029  -9.684  -6.452
  399   2HG   LYS  53          1HG       LYS  53  11.372 -10.058  -5.975
  400   1HD   LYS  53          2HD       LYS  53  10.843 -10.992  -8.059
  401   2HD   LYS  53          1HD       LYS  53  12.163 -10.155  -8.876
  402   1HE   LYS  53          2HE       LYS  53  12.828 -12.108  -6.704
  403   2HE   LYS  53          1HE       LYS  53  12.369 -12.729  -8.290
  404   1HZ   LYS  53          1HZ       LYS  53  14.338 -12.172  -9.100
  405   2HZ   LYS  53          2HZ       LYS  53  14.841 -11.775  -7.528
  406   3HZ   LYS  53          3HZ       LYS  53  14.194 -10.577  -8.545
  407    H    ASN  54           H        ASN  54  13.985  -6.328  -7.214
  408    HA   ASN  54           HA       ASN  54  15.905  -7.995  -5.801
  409   1HB   ASN  54          2HB       ASN  54  16.050  -5.927  -7.963
  410   2HB   ASN  54          1HB       ASN  54  17.523  -6.368  -7.098
  411   1HD2  ASN  54          1HD2      ASN  54  15.296  -7.391  -9.551
  412   2HD2  ASN  54          2HD2      ASN  54  15.983  -8.917  -9.835
  413    H    LYS  55           H        LYS  55  14.584  -4.798  -5.417
  414    HA   LYS  55           HA       LYS  55  16.773  -3.809  -3.796
  415   1HB   LYS  55          2HB       LYS  55  14.963  -2.454  -5.097
  416   2HB   LYS  55          1HB       LYS  55  13.972  -2.724  -3.661
  417   1HG   LYS  55          2HG       LYS  55  15.394  -1.490  -2.280
  418   2HG   LYS  55          1HG       LYS  55  16.782  -1.710  -3.346
  419   1HD   LYS  55          2HD       LYS  55  15.739  -0.232  -5.022
  420   2HD   LYS  55          1HD       LYS  55  14.347  -0.010  -3.961
  421   1HE   LYS  55          2HE       LYS  55  15.533   1.289  -2.445
  422   2HE   LYS  55          1HE       LYS  55  17.081   0.565  -2.880
  423   1HZ   LYS  55          1HZ       LYS  55  15.497   2.411  -4.583
  424   2HZ   LYS  55          2HZ       LYS  55  16.989   1.714  -4.999
  425   3HZ   LYS  55          3HZ       LYS  55  16.896   2.823  -3.716
  426    H    GLY  56           H        GLY  56  14.684  -6.254  -3.209
  427   1HA   GLY  56          1HA       GLY  56  13.836  -7.252  -1.258
  428   2HA   GLY  56          2HA       GLY  56  15.246  -6.532  -0.478
  429    H    ILE  57           H        ILE  57  12.191  -5.285  -1.874
  430    HA   ILE  57           HA       ILE  57  11.980  -3.503   0.506
  431    HB   ILE  57           HB       ILE  57  11.893  -2.727  -2.025
  432   1HG1  ILE  57          2HG1      ILE  57  11.564  -1.350   0.063
  433   2HG1  ILE  57          1HG1      ILE  57  10.631  -0.792  -1.325
  434   1HG2  ILE  57          1HG2      ILE  57   9.561  -2.562  -2.839
  435   2HG2  ILE  57          2HG2      ILE  57   9.017  -3.522  -1.464
  436   3HG2  ILE  57          3HG2      ILE  57  10.067  -4.244  -2.683
  437   1HD1  ILE  57          1HD1      ILE  57   9.009  -2.707  -0.045
  438   2HD1  ILE  57          2HD1      ILE  57   8.776  -0.958  -0.060
  439   3HD1  ILE  57          3HD1      ILE  57   9.685  -1.716   1.248
  440    H    ILE  58           H        ILE  58  10.356  -3.807   1.970
  441    HA   ILE  58           HA       ILE  58   8.440  -6.014   1.433
  442    HB   ILE  58           HB       ILE  58   9.841  -5.893   3.573
  443   1HG1  ILE  58          2HG1      ILE  58   7.755  -7.263   3.287
  444   2HG1  ILE  58          1HG1      ILE  58   8.021  -6.732   4.947
  445   1HG2  ILE  58          1HG2      ILE  58   7.792  -3.909   4.520
  446   2HG2  ILE  58          2HG2      ILE  58   9.264  -3.341   3.733
  447   3HG2  ILE  58          3HG2      ILE  58   9.367  -4.297   5.212
  448   1HD1  ILE  58          1HD1      ILE  58   6.023  -5.708   2.940
  449   2HD1  ILE  58          2HD1      ILE  58   6.543  -4.689   4.283
  450   3HD1  ILE  58          3HD1      ILE  58   5.752  -6.233   4.601
  451    H    TRP  59           H        TRP  59   6.567  -5.329   0.501
  452    HA   TRP  59           HA       TRP  59   5.687  -2.640   0.445
  453   1HB   TRP  59          2HB       TRP  59   4.255  -5.250  -0.027
  454   2HB   TRP  59          1HB       TRP  59   3.426  -3.698  -0.169
  455    HD1  TRP  59           HD1      TRP  59   4.684  -5.986  -2.430
  456    HE1  TRP  59           HE1      TRP  59   5.808  -4.932  -4.494
  457    HE3  TRP  59           HE3      TRP  59   5.454  -1.237  -0.698
  458    HZ2  TRP  59           HZ2      TRP  59   6.897  -2.416  -5.302
  459    HZ3  TRP  59           HZ3      TRP  59   6.538   0.461  -2.136
  460    HH2  TRP  59           HH2      TRP  59   7.258  -0.121  -4.435
  461    H    GLY  60           H        GLY  60   5.325  -1.546   2.297
  462   1HA   GLY  60          1HA       GLY  60   3.333  -2.712   4.193
  463   2HA   GLY  60          2HA       GLY  60   4.795  -1.934   4.801
  464    H    GLU  61           H        GLU  61   3.357  -0.385   5.887
  465    HA   GLU  61           HA       GLU  61   1.655   1.357   4.283
  466   1HB   GLU  61          2HB       GLU  61   1.346   0.775   6.765
  467   2HB   GLU  61          1HB       GLU  61   2.655   1.915   7.081
  468   1HG   GLU  61          2HG       GLU  61   1.338   3.640   5.775
  469   2HG   GLU  61          1HG       GLU  61  -0.008   2.499   5.766
  470    H    ASP  62           H        ASP  62   4.529   2.095   6.296
  471    HA   ASP  62           HA       ASP  62   4.996   4.622   5.032
  472   1HB   ASP  62          2HB       ASP  62   6.355   2.907   7.005
  473   2HB   ASP  62          1HB       ASP  62   7.445   3.907   6.045
  474    H    THR  63           H        THR  63   6.273   1.372   4.458
  475    HA   THR  63           HA       THR  63   8.328   2.060   2.633
  476    HB   THR  63           HB       THR  63   7.399  -0.356   1.689
  477    HG1  THR  63           HG1      THR  63   7.042  -1.171   4.091
  478   1HG2  THR  63          1HG2      THR  63   9.051  -0.027   4.202
  479   2HG2  THR  63          2HG2      THR  63   9.676   0.329   2.592
  480   3HG2  THR  63          3HG2      THR  63   9.166  -1.309   2.997
  481    H    LEU  64           H        LEU  64   4.881   1.323   2.028
  482    HA   LEU  64           HA       LEU  64   5.060   1.650  -0.826
  483   1HB   LEU  64          2HB       LEU  64   3.041   1.012   1.066
  484   2HB   LEU  64          1HB       LEU  64   2.464   2.407   0.155
  485    HG   LEU  64           HG       LEU  64   3.479  -0.198  -1.015
  486   1HD1  LEU  64          1HD1      LEU  64   1.044  -0.081  -1.949
  487   2HD1  LEU  64          2HD1      LEU  64   0.766   1.047  -0.622
  488   3HD1  LEU  64          3HD1      LEU  64   1.286  -0.604  -0.282
  489   1HD2  LEU  64          1HD2      LEU  64   2.484   1.001  -3.134
  490   2HD2  LEU  64          2HD2      LEU  64   4.117   1.403  -2.600
  491   3HD2  LEU  64          3HD2      LEU  64   2.771   2.472  -2.206
  492    H    MET  65           H        MET  65   4.493   3.876   1.849
  493    HA   MET  65           HA       MET  65   3.569   6.130   0.438
  494   1HB   MET  65          2HB       MET  65   3.772   5.985   2.918
  495   2HB   MET  65          1HB       MET  65   5.526   6.108   2.757
  496   1HG   MET  65          2HG       MET  65   4.022   8.198   1.321
  497   2HG   MET  65          1HG       MET  65   3.848   8.253   3.076
  498   1HE   MET  65          1HE       MET  65   5.130  10.218   3.906
  499   2HE   MET  65          2HE       MET  65   6.804   9.874   4.335
  500   3HE   MET  65          3HE       MET  65   5.543   8.707   4.726
  501    H    GLU  66           H        GLU  66   6.877   4.910   0.840
  502    HA   GLU  66           HA       GLU  66   8.124   7.156  -0.473
  503   1HB   GLU  66          2HB       GLU  66   9.271   5.519   1.085
  504   2HB   GLU  66          1HB       GLU  66   9.221   4.346  -0.233
  505   1HG   GLU  66          2HG       GLU  66  11.246   5.256  -0.766
  506   2HG   GLU  66          1HG       GLU  66  10.254   6.496  -1.537
  507    H    TYR  67           H        TYR  67   7.716   3.771  -1.596
  508    HA   TYR  67           HA       TYR  67   8.468   4.224  -4.274
  509   1HB   TYR  67          2HB       TYR  67   8.117   1.969  -3.345
  510   2HB   TYR  67          1HB       TYR  67   6.383   2.276  -3.245
  511    HD1  TYR  67           HD1      TYR  67   5.174   1.221  -4.925
  512    HD2  TYR  67           HD2      TYR  67   9.052   2.824  -5.841
  513    HE1  TYR  67           HE1      TYR  67   4.906   0.514  -7.285
  514    HE2  TYR  67           HE2      TYR  67   8.785   2.117  -8.204
  515    HH   TYR  67           HH       TYR  67   6.337   1.620  -9.709
  516    H    LEU  68           H        LEU  68   5.628   5.279  -2.626
  517    HA   LEU  68           HA       LEU  68   4.135   5.645  -5.147
  518   1HB   LEU  68          2HB       LEU  68   3.402   5.351  -2.420
  519   2HB   LEU  68          1HB       LEU  68   2.898   6.968  -2.912
  520    HG   LEU  68           HG       LEU  68   1.767   5.993  -4.895
  521   1HD1  LEU  68          1HD1      LEU  68   1.600   3.269  -4.085
  522   2HD1  LEU  68          2HD1      LEU  68   3.311   3.696  -4.115
  523   3HD1  LEU  68          3HD1      LEU  68   2.322   3.913  -5.560
  524   1HD2  LEU  68          1HD2      LEU  68   0.906   5.998  -2.276
  525   2HD2  LEU  68          2HD2      LEU  68   0.607   4.328  -2.762
  526   3HD2  LEU  68          3HD2      LEU  68  -0.118   5.654  -3.672
  527    H    GLU  69           H        GLU  69   5.988   7.513  -2.823
  528    HA   GLU  69           HA       GLU  69   5.206  10.125  -3.655
  529   1HB   GLU  69          2HB       GLU  69   6.783   9.368  -1.711
  530   2HB   GLU  69          1HB       GLU  69   8.047   9.431  -2.932
  531   1HG   GLU  69          2HG       GLU  69   8.138  11.604  -2.097
  532   2HG   GLU  69          1HG       GLU  69   7.032  11.803  -3.455
  533    H    ASN  70           H        ASN  70   7.216   7.668  -5.005
  534    HA   ASN  70           HA       ASN  70   7.215   8.787  -7.634
  535   1HB   ASN  70          2HB       ASN  70   9.938   8.991  -7.413
  536   2HB   ASN  70          1HB       ASN  70   8.834  10.364  -7.359
  537   1HD2  ASN  70          1HD2      ASN  70   9.467   7.840  -4.866
  538   2HD2  ASN  70          2HD2      ASN  70   9.943   8.938  -3.662
  539    HA   PRO  71           HA       PRO  71   8.254   4.388  -7.479
  540   1HB   PRO  71          2HB       PRO  71   6.903   3.798  -9.807
  541   2HB   PRO  71          1HB       PRO  71   6.128   3.873  -8.215
  542   1HG   PRO  71          2HG       PRO  71   6.006   5.837 -10.458
  543   2HG   PRO  71          1HG       PRO  71   4.824   5.524  -9.176
  544   1HD   PRO  71          2HD       PRO  71   6.631   7.692  -9.252
  545   2HD   PRO  71          1HD       PRO  71   5.713   7.154  -7.829
  546    H    LYS  72           H        LYS  72   8.349   6.493 -10.356
  547    HA   LYS  72           HA       LYS  72  10.283   4.899 -11.770
  548   1HB   LYS  72          2HB       LYS  72   8.656   6.742 -12.660
  549   2HB   LYS  72          1HB       LYS  72   9.948   7.855 -12.206
  550   1HG   LYS  72          2HG       LYS  72  10.334   7.268 -14.501
  551   2HG   LYS  72          1HG       LYS  72  11.530   6.387 -13.549
  552   1HD   LYS  72          2HD       LYS  72  10.108   4.378 -13.601
  553   2HD   LYS  72          1HD       LYS  72   8.893   5.254 -14.533
  554   1HE   LYS  72          2HE       LYS  72  11.665   5.284 -15.609
  555   2HE   LYS  72          1HE       LYS  72  10.801   3.750 -15.699
  556   1HZ   LYS  72          1HZ       LYS  72  10.467   5.201 -17.655
  557   2HZ   LYS  72          2HZ       LYS  72   9.704   6.337 -16.650
  558   3HZ   LYS  72          3HZ       LYS  72   9.022   4.796 -16.866
  559    H    LYS  73           H        LYS  73  10.544   6.966  -9.079
  560    HA   LYS  73           HA       LYS  73  13.414   7.503  -9.656
  561   1HB   LYS  73          2HB       LYS  73  13.127   9.472  -8.587
  562   2HB   LYS  73          1HB       LYS  73  11.404   9.120  -8.563
  563   1HG   LYS  73          2HG       LYS  73  11.866   9.524  -6.302
  564   2HG   LYS  73          1HG       LYS  73  11.972   7.766  -6.390
  565   1HD   LYS  73          2HD       LYS  73  14.459   8.034  -6.789
  566   2HD   LYS  73          1HD       LYS  73  14.264   9.746  -6.416
  567   1HE   LYS  73          2HE       LYS  73  12.970   8.094  -4.410
  568   2HE   LYS  73          1HE       LYS  73  14.675   7.671  -4.575
  569   1HZ   LYS  73          1HZ       LYS  73  15.297   9.586  -3.666
  570   2HZ   LYS  73          2HZ       LYS  73  13.681   9.787  -3.180
  571   3HZ   LYS  73          3HZ       LYS  73  14.232  10.497  -4.622
  572    H    TYR  74           H        TYR  74  11.260   5.891  -7.361
  573    HA   TYR  74           HA       TYR  74  13.439   5.072  -5.602
  574   1HB   TYR  74          2HB       TYR  74  11.073   5.317  -4.823
  575   2HB   TYR  74          1HB       TYR  74  10.629   3.948  -5.840
  576    HD1  TYR  74           HD1      TYR  74  13.775   4.378  -3.888
  577    HD2  TYR  74           HD2      TYR  74  10.022   2.315  -4.226
  578    HE1  TYR  74           HE1      TYR  74  14.470   2.817  -2.089
  579    HE2  TYR  74           HE2      TYR  74  10.717   0.755  -2.427
  580    HH   TYR  74           HH       TYR  74  13.195   1.335  -0.351
  581    H    ILE  75           H        ILE  75  11.174   3.043  -7.500
  582    HA   ILE  75           HA       ILE  75  13.336   1.074  -7.846
  583    HB   ILE  75           HB       ILE  75  10.527   0.765  -8.857
  584   1HG1  ILE  75          2HG1      ILE  75  10.407   1.665  -6.517
  585   2HG1  ILE  75          1HG1      ILE  75   9.811   0.012  -6.652
  586   1HG2  ILE  75          1HG2      ILE  75  11.915  -1.368  -7.397
  587   2HG2  ILE  75          2HG2      ILE  75  12.759  -0.817  -8.843
  588   3HG2  ILE  75          3HG2      ILE  75  11.102  -1.410  -8.960
  589   1HD1  ILE  75          1HD1      ILE  75  11.246   0.085  -4.720
  590   2HD1  ILE  75          2HD1      ILE  75  12.516   0.906  -5.628
  591   3HD1  ILE  75          3HD1      ILE  75  12.123  -0.775  -5.985
  592    HA   PRO  76           HA       PRO  76  13.744   2.948 -11.928
  593   1HB   PRO  76          2HB       PRO  76  16.181   1.785 -12.447
  594   2HB   PRO  76          1HB       PRO  76  15.986   3.264 -11.489
  595   1HG   PRO  76          2HG       PRO  76  16.607   0.498 -10.566
  596   2HG   PRO  76          1HG       PRO  76  17.010   2.049  -9.811
  597   1HD   PRO  76          2HD       PRO  76  14.910   0.319  -9.026
  598   2HD   PRO  76          1HD       PRO  76  15.119   2.008  -8.514
  599    H    GLY  77           H        GLY  77  11.886   1.219 -12.272
  600   1HA   GLY  77          2HA       GLY  77  12.565  -0.380 -14.538
  601   2HA   GLY  77          1HA       GLY  77  12.456  -1.422 -13.120
  602    H    THR  78           H        THR  78  10.345   0.028 -11.781
  603    HA   THR  78           HA       THR  78   8.056  -1.228 -12.711
  604    HB   THR  78           HB       THR  78   8.261   0.161 -10.592
  605    HG1  THR  78           HG1      THR  78   6.256  -0.550 -11.040
  606   1HG2  THR  78          1HG2      THR  78   7.133   2.557 -11.656
  607   2HG2  THR  78          2HG2      THR  78   8.620   2.218 -12.542
  608   3HG2  THR  78          3HG2      THR  78   8.656   2.365 -10.785
  609    H    LYS  79           H        LYS  79   6.195  -0.431 -13.925
  610    HA   LYS  79           HA       LYS  79   7.050   1.349 -16.165
  611   1HB   LYS  79          2HB       LYS  79   4.841  -0.732 -16.065
  612   2HB   LYS  79          1HB       LYS  79   5.262   0.246 -17.471
  613   1HG   LYS  79          2HG       LYS  79   7.508  -0.732 -17.513
  614   2HG   LYS  79          1HG       LYS  79   7.145  -1.668 -16.063
  615   1HD   LYS  79          2HD       LYS  79   6.278  -3.296 -17.346
  616   2HD   LYS  79          1HD       LYS  79   5.054  -2.164 -17.928
  617   1HE   LYS  79          2HE       LYS  79   6.154  -2.879 -19.896
  618   2HE   LYS  79          1HE       LYS  79   6.885  -1.314 -19.542
  619   1HZ   LYS  79          1HZ       LYS  79   8.826  -2.265 -18.862
  620   2HZ   LYS  79          2HZ       LYS  79   8.353  -3.404 -20.031
  621   3HZ   LYS  79          3HZ       LYS  79   8.094  -3.717 -18.381
  622    H    MET  80           H        MET  80   5.268   1.396 -13.345
  623    HA   MET  80           HA       MET  80   3.088   3.053 -14.444
  624   1HB   MET  80          2HB       MET  80   2.103   2.978 -12.265
  625   2HB   MET  80          1HB       MET  80   2.763   1.380 -12.563
  626   1HG   MET  80          2HG       MET  80   4.660   1.795 -11.192
  627   2HG   MET  80          1HG       MET  80   4.260   3.493 -11.043
  628   1HE   MET  80          1HE       MET  80   2.979   3.936  -8.069
  629   2HE   MET  80          2HE       MET  80   1.556   4.088  -9.096
  630   3HE   MET  80          3HE       MET  80   3.141   4.520  -9.731
  631    H    ILE  81           H        ILE  81   3.308   5.176 -14.694
  632    HA   ILE  81           HA       ILE  81   5.545   6.572 -13.319
  633    HB   ILE  81           HB       ILE  81   3.769   7.545 -15.583
  634   1HG1  ILE  81          2HG1      ILE  81   6.243   7.146 -16.663
  635   2HG1  ILE  81          1HG1      ILE  81   6.173   5.817 -15.506
  636   1HG2  ILE  81          1HG2      ILE  81   4.755   9.525 -15.153
  637   2HG2  ILE  81          2HG2      ILE  81   6.300   8.791 -15.581
  638   3HG2  ILE  81          3HG2      ILE  81   5.763   8.800 -13.901
  639   1HD1  ILE  81          1HD1      ILE  81   4.762   6.128 -18.029
  640   2HD1  ILE  81          2HD1      ILE  81   3.640   5.846 -16.698
  641   3HD1  ILE  81          3HD1      ILE  81   4.936   4.693 -17.019
  642    H    PHE  82           H        PHE  82   3.453   5.887 -11.697
  643    HA   PHE  82           HA       PHE  82   1.317   7.730 -11.461
  644   1HB   PHE  82          2HB       PHE  82   1.577   5.550 -10.254
  645   2HB   PHE  82          1HB       PHE  82   2.773   6.316  -9.213
  646    HD1  PHE  82           HD1      PHE  82   2.115   8.135  -7.670
  647    HD2  PHE  82           HD2      PHE  82  -0.770   6.016 -10.046
  648    HE1  PHE  82           HE1      PHE  82   0.292   8.989  -6.222
  649    HE2  PHE  82           HE2      PHE  82  -2.591   6.874  -8.599
  650    HZ   PHE  82           HZ       PHE  82  -2.054   8.351  -6.688
  651    H    VAL  83           H        VAL  83   1.099   9.638 -10.235
  652    HA   VAL  83           HA       VAL  83   3.606  11.147  -9.885
  653    HB   VAL  83           HB       VAL  83   1.604  12.175 -10.973
  654   1HG1  VAL  83          1HG1      VAL  83  -0.428  12.349  -9.925
  655   2HG1  VAL  83          2HG1      VAL  83   0.296  12.526  -8.327
  656   3HG1  VAL  83          3HG1      VAL  83   0.158  10.928  -9.060
  657   1HG2  VAL  83          1HG2      VAL  83   1.559  14.119  -9.051
  658   2HG2  VAL  83          2HG2      VAL  83   2.853  13.937 -10.236
  659   3HG2  VAL  83          3HG2      VAL  83   3.035  13.255  -8.619
  660    H    GLY  84           H        GLY  84   4.393  11.853  -7.895
  661   1HA   GLY  84          2HA       GLY  84   3.641  10.328  -5.559
  662   2HA   GLY  84          1HA       GLY  84   4.779  11.675  -5.582
  663    H    ILE  85           H        ILE  85   1.885  10.739  -4.306
  664    HA   ILE  85           HA       ILE  85   0.228  13.041  -4.617
  665    HB   ILE  85           HB       ILE  85   0.410  11.245  -2.181
  666   1HG1  ILE  85          2HG1      ILE  85  -1.729  10.526  -3.915
  667   2HG1  ILE  85          1HG1      ILE  85  -0.272  10.625  -4.904
  668   1HG2  ILE  85          1HG2      ILE  85  -1.497  12.247  -1.477
  669   2HG2  ILE  85          2HG2      ILE  85  -2.196  12.240  -3.096
  670   3HG2  ILE  85          3HG2      ILE  85  -1.090  13.528  -2.619
  671   1HD1  ILE  85          1HD1      ILE  85   0.557   8.735  -4.001
  672   2HD1  ILE  85          2HD1      ILE  85  -1.012   8.500  -3.231
  673   3HD1  ILE  85          3HD1      ILE  85   0.280   9.330  -2.363
  674    H    LYS  86           H        LYS  86   0.442  15.067  -3.784
  675    HA   LYS  86           HA       LYS  86   2.687  15.576  -1.922
  676   1HB   LYS  86          2HB       LYS  86   1.168  17.135  -3.905
  677   2HB   LYS  86          1HB       LYS  86   1.507  18.018  -2.416
  678   1HG   LYS  86          2HG       LYS  86   3.712  16.435  -3.686
  679   2HG   LYS  86          1HG       LYS  86   3.277  17.996  -4.382
  680   1HD   LYS  86          2HD       LYS  86   4.836  18.689  -2.819
  681   2HD   LYS  86          1HD       LYS  86   3.375  18.759  -1.833
  682   1HE   LYS  86          2HE       LYS  86   3.978  16.952  -0.571
  683   2HE   LYS  86          1HE       LYS  86   4.723  16.121  -1.937
  684   1HZ   LYS  86          1HZ       LYS  86   6.600  17.630  -1.789
  685   2HZ   LYS  86          2HZ       LYS  86   6.373  16.813  -0.316
  686   3HZ   LYS  86          3HZ       LYS  86   5.884  18.432  -0.478
  687    H    LYS  87           H        LYS  87   0.391  14.175  -0.885
  688    HA   LYS  87           HA       LYS  87  -0.369  16.108   1.235
  689   1HB   LYS  87          2HB       LYS  87  -2.137  15.361  -0.825
  690   2HB   LYS  87          1HB       LYS  87  -2.622  14.409   0.578
  691   1HG   LYS  87          2HG       LYS  87  -2.997  16.330   1.902
  692   2HG   LYS  87          1HG       LYS  87  -2.067  17.363   0.815
  693   1HD   LYS  87          2HD       LYS  87  -4.342  16.001  -0.471
  694   2HD   LYS  87          1HD       LYS  87  -4.803  17.150   0.787
  695   1HE   LYS  87          2HE       LYS  87  -2.701  18.291  -0.814
  696   2HE   LYS  87          1HE       LYS  87  -4.000  17.733  -1.870
  697   1HZ   LYS  87          1HZ       LYS  87  -5.318  19.357  -1.175
  698   2HZ   LYS  87          2HZ       LYS  87  -3.968  20.047  -0.407
  699   3HZ   LYS  87          3HZ       LYS  87  -5.011  19.023   0.460
  700    H    LYS  88           H        LYS  88   0.299  15.116   3.075
  701    HA   LYS  88           HA       LYS  88   0.850  12.307   3.261
  702   1HB   LYS  88          2HB       LYS  88   1.962  13.879   4.747
  703   2HB   LYS  88          1HB       LYS  88   0.416  14.393   5.418
  704   1HG   LYS  88          2HG       LYS  88   1.152  12.855   7.020
  705   2HG   LYS  88          1HG       LYS  88   0.120  11.855   5.998
  706   1HD   LYS  88          2HD       LYS  88   1.980  10.507   5.995
  707   2HD   LYS  88          1HD       LYS  88   2.439  11.567   4.662
  708   1HE   LYS  88          2HE       LYS  88   4.138  12.482   5.842
  709   2HE   LYS  88          1HE       LYS  88   3.132  12.684   7.276
  710   1HZ   LYS  88          1HZ       LYS  88   4.097  10.925   8.173
  711   2HZ   LYS  88          2HZ       LYS  88   5.094  10.756   6.808
  712   3HZ   LYS  88          3HZ       LYS  88   3.601   9.947   6.878
  713    H    GLU  89           H        GLU  89  -2.034  14.207   3.789
  714    HA   GLU  89           HA       GLU  89  -3.432  12.205   5.335
  715   1HB   GLU  89          2HB       GLU  89  -4.523  14.510   3.697
  716   2HB   GLU  89          1HB       GLU  89  -5.425  13.583   4.896
  717   1HG   GLU  89          2HG       GLU  89  -4.510  14.727   6.619
  718   2HG   GLU  89          1HG       GLU  89  -2.887  14.603   5.940
  719    H    GLU  90           H        GLU  90  -3.426  13.137   1.891
  720    HA   GLU  90           HA       GLU  90  -5.441  11.324   1.031
  721   1HB   GLU  90          2HB       GLU  90  -3.802  13.180  -0.198
  722   2HB   GLU  90          1HB       GLU  90  -3.223  11.653  -0.865
  723   1HG   GLU  90          2HG       GLU  90  -5.320  11.114  -1.781
  724   2HG   GLU  90          1HG       GLU  90  -6.174  12.235  -0.720
  725    H    ARG  91           H        ARG  91  -1.949  10.872   1.502
  726    HA   ARG  91           HA       ARG  91  -1.838   8.218   0.410
  727   1HB   ARG  91          2HB       ARG  91  -0.040  10.034   1.699
  728   2HB   ARG  91          1HB       ARG  91   0.063   8.480   2.526
  729   1HG   ARG  91          2HG       ARG  91   1.052   7.475   0.753
  730   2HG   ARG  91          1HG       ARG  91  -0.052   8.231  -0.397
  731   1HD   ARG  91          2HD       ARG  91   2.399   8.926  -0.592
  732   2HD   ARG  91          1HD       ARG  91   1.234  10.244  -0.458
  733    HE   ARG  91           HE       ARG  91   1.992   9.701   2.169
  734   1HH1  ARG  91          1HH2      ARG  91   4.319   9.315  -0.129
  735   2HH1  ARG  91          2HH2      ARG  91   5.288  10.673   0.333
  736   1HH2  ARG  91          1HH1      ARG  91   2.905  11.993   2.472
  737   2HH2  ARG  91          2HH1      ARG  91   4.487  12.191   1.796
  738    H    ALA  92           H        ALA  92  -2.221   9.408   3.759
  739    HA   ALA  92           HA       ALA  92  -2.368   6.906   5.055
  740   1HB   ALA  92          1HB       ALA  92  -3.287   9.659   5.623
  741   2HB   ALA  92          2HB       ALA  92  -2.433   8.520   6.665
  742   3HB   ALA  92          3HB       ALA  92  -4.181   8.391   6.462
  743    H    ASP  93           H        ASP  93  -4.839   8.709   3.284
  744    HA   ASP  93           HA       ASP  93  -7.011   6.951   3.988
  745   1HB   ASP  93          2HB       ASP  93  -6.576   9.226   2.165
  746   2HB   ASP  93          1HB       ASP  93  -7.756   8.050   1.586
  747    H    LEU  94           H        LEU  94  -4.554   6.960   1.480
  748    HA   LEU  94           HA       LEU  94  -5.769   5.030  -0.260
  749   1HB   LEU  94          2HB       LEU  94  -2.914   5.887   0.229
  750   2HB   LEU  94          1HB       LEU  94  -3.308   4.610  -0.922
  751    HG   LEU  94           HG       LEU  94  -4.529   7.382  -0.987
  752   1HD1  LEU  94          1HD1      LEU  94  -1.931   6.929  -1.508
  753   2HD1  LEU  94          2HD1      LEU  94  -2.892   8.070  -2.452
  754   3HD1  LEU  94          3HD1      LEU  94  -2.606   6.439  -3.063
  755   1HD2  LEU  94          1HD2      LEU  94  -5.997   5.914  -2.102
  756   2HD2  LEU  94          2HD2      LEU  94  -4.679   4.922  -2.722
  757   3HD2  LEU  94          3HD2      LEU  94  -4.975   6.519  -3.407
  758    H    ILE  95           H        ILE  95  -3.151   4.603   2.138
  759    HA   ILE  95           HA       ILE  95  -3.255   1.732   2.068
  760    HB   ILE  95           HB       ILE  95  -2.361   3.327   4.465
  761   1HG1  ILE  95          2HG1      ILE  95  -1.354   4.592   2.741
  762   2HG1  ILE  95          1HG1      ILE  95  -0.112   3.417   3.175
  763   1HG2  ILE  95          1HG2      ILE  95  -1.917   0.644   3.310
  764   2HG2  ILE  95          2HG2      ILE  95  -1.808   1.181   4.986
  765   3HG2  ILE  95          3HG2      ILE  95  -0.456   1.446   3.885
  766   1HD1  ILE  95          1HD1      ILE  95  -0.112   3.195   0.863
  767   2HD1  ILE  95          2HD1      ILE  95  -1.837   3.538   0.727
  768   3HD1  ILE  95          3HD1      ILE  95  -1.293   1.961   1.304
  769    H    ALA  96           H        ALA  96  -5.000   4.170   3.850
  770    HA   ALA  96           HA       ALA  96  -6.045   2.566   5.948
  771   1HB   ALA  96          1HB       ALA  96  -7.214   4.976   4.535
  772   2HB   ALA  96          2HB       ALA  96  -6.278   4.973   6.029
  773   3HB   ALA  96          3HB       ALA  96  -7.895   4.271   6.001
  774    H    TYR  97           H        TYR  97  -7.242   3.133   2.636
  775    HA   TYR  97           HA       TYR  97  -9.639   1.575   3.033
  776   1HB   TYR  97          2HB       TYR  97  -9.715   3.162   1.256
  777   2HB   TYR  97          1HB       TYR  97  -8.196   2.581   0.574
  778    HD1  TYR  97           HD1      TYR  97  -8.378   1.268  -1.341
  779    HD2  TYR  97           HD2      TYR  97 -11.510   1.128   1.595
  780    HE1  TYR  97           HE1      TYR  97  -9.612  -0.369  -2.734
  781    HE2  TYR  97           HE2      TYR  97 -12.750  -0.502   0.196
  782    HH   TYR  97           HH       TYR  97 -12.660  -1.815  -1.607
  783    H    LEU  98           H        LEU  98  -6.585   0.939   1.291
  784    HA   LEU  98           HA       LEU  98  -7.178  -1.761   0.652
  785   1HB   LEU  98          2HB       LEU  98  -4.790  -0.038   0.691
  786   2HB   LEU  98          1HB       LEU  98  -4.443  -1.749   0.926
  787    HG   LEU  98           HG       LEU  98  -4.399  -1.315  -1.452
  788   1HD1  LEU  98          1HD1      LEU  98  -6.204  -3.115  -0.213
  789   2HD1  LEU  98          2HD1      LEU  98  -5.483  -3.251  -1.816
  790   3HD1  LEU  98          3HD1      LEU  98  -7.041  -2.449  -1.616
  791   1HD2  LEU  98          1HD2      LEU  98  -6.538  -0.447  -2.543
  792   2HD2  LEU  98          2HD2      LEU  98  -5.624   0.739  -1.610
  793   3HD2  LEU  98          3HD2      LEU  98  -7.072   0.003  -0.924
  794    H    LYS  99           H        LYS  99  -6.404  -0.334   3.689
  795    HA   LYS  99           HA       LYS  99  -5.348  -2.802   4.834
  796   1HB   LYS  99          2HB       LYS  99  -5.462  -0.053   5.620
  797   2HB   LYS  99          1HB       LYS  99  -6.208  -1.028   6.886
  798   1HG   LYS  99          2HG       LYS  99  -4.235  -1.965   7.480
  799   2HG   LYS  99          1HG       LYS  99  -3.755  -2.221   5.803
  800   1HD   LYS  99          2HD       LYS  99  -3.324   0.306   5.703
  801   2HD   LYS  99          1HD       LYS  99  -3.454   0.288   7.462
  802   1HE   LYS  99          2HE       LYS  99  -1.751  -1.867   6.755
  803   2HE   LYS  99          1HE       LYS  99  -1.213  -0.470   5.822
  804   1HZ   LYS  99          1HZ       LYS  99  -1.815   0.404   8.401
  805   2HZ   LYS  99          2HZ       LYS  99  -0.294   0.338   7.646
  806   3HZ   LYS  99          3HZ       LYS  99  -0.853  -0.984   8.555
  807    H    LYS 100           H        LYS 100  -8.351  -0.902   5.141
  808    HA   LYS 100           HA       LYS 100  -9.674  -2.734   6.900
  809   1HB   LYS 100          2HB       LYS 100 -10.497  -0.455   6.581
  810   2HB   LYS 100          1HB       LYS 100 -10.813  -0.781   4.877
  811   1HG   LYS 100          2HG       LYS 100 -12.060  -2.585   6.911
  812   2HG   LYS 100          1HG       LYS 100 -12.753  -0.979   6.685
  813   1HD   LYS 100          2HD       LYS 100 -12.443  -1.734   4.095
  814   2HD   LYS 100          1HD       LYS 100 -12.736  -3.303   4.845
  815   1HE   LYS 100          2HE       LYS 100 -14.915  -2.829   5.216
  816   2HE   LYS 100          1HE       LYS 100 -14.536  -1.229   5.854
  817   1HZ   LYS 100          1HZ       LYS 100 -14.915  -2.038   3.035
  818   2HZ   LYS 100          2HZ       LYS 100 -14.118  -0.596   3.449
  819   3HZ   LYS 100          3HZ       LYS 100 -15.736  -0.837   3.906
  820    H    ALA 101           H        ALA 101  -9.387  -2.584   3.385
  821    HA   ALA 101           HA       ALA 101 -11.326  -4.704   2.955
  822   1HB   ALA 101          1HB       ALA 101  -9.646  -2.946   1.294
  823   2HB   ALA 101          2HB       ALA 101 -11.280  -3.543   1.004
  824   3HB   ALA 101          3HB       ALA 101  -9.889  -4.561   0.627
  825    H    THR 102           H        THR 102  -7.755  -4.480   2.666
  826    HA   THR 102           HA       THR 102  -7.722  -7.464   2.908
  827    HB   THR 102           HB       THR 102  -6.983  -6.600   0.676
  828    HG1  THR 102           HG1      THR 102  -5.458  -8.097   2.425
  829   1HG2  THR 102          1HG2      THR 102  -5.916  -4.578   0.935
  830   2HG2  THR 102          2HG2      THR 102  -4.503  -5.633   0.930
  831   3HG2  THR 102          3HG2      THR 102  -5.161  -5.049   2.458
  832    H    ASN 103           H        ASN 103  -7.691  -5.757   5.189
  833    HA   ASN 103           HA       ASN 103  -5.316  -6.741   6.491
  834   1HB   ASN 103          2HB       ASN 103  -4.591  -4.605   5.168
  835   2HB   ASN 103          1HB       ASN 103  -5.454  -3.739   6.439
  836   1HD2  ASN 103          1HD2      ASN 103  -2.393  -4.544   5.698
  837   2HD2  ASN 103          2HD2      ASN 103  -1.757  -4.837   7.244
  838    H    GLU 104           HN       GLU 104  -8.115  -6.926   6.943
  839    HA   GLU 104           HA       GLU 104  -8.196  -5.983   9.717
  840   1HB   GLU 104          2HB       GLU 104  -9.042  -4.006   8.537
  841   2HB   GLU 104          1HB       GLU 104 -10.220  -5.001   7.682
  842   1HG   GLU 104          2HG       GLU 104 -10.293  -5.330  10.605
  843   2HG   GLU 104          1HG       GLU 104 -10.700  -3.701  10.061
  844    HHA  HEC 105           HHA      HEC 105   4.330  -2.696  -9.206
  845    HHB  HEC 105           HHB      HEC 105   1.197   0.870  -5.039
  846    HHC  HEC 105           HHC      HEC 105  -2.026   3.577  -9.765
  847    HHD  HEC 105           HHD      HEC 105   1.022  -0.073 -13.923
  848   1HMA  HEC 105          1HMA      HEC 105   3.599  -1.933  -4.151
  849   2HMA  HEC 105          2HMA      HEC 105   2.129  -0.976  -3.977
  850   3HMA  HEC 105          3HMA      HEC 105   3.692  -0.172  -4.119
  851   1HAA  HEC 105          1HAA      HEC 105   4.734  -2.887  -5.473
  852   2HAA  HEC 105          2HAA      HEC 105   5.564  -2.507  -6.968
  853   1HBA  HEC 105          1HBA      HEC 105   5.081  -4.795  -7.178
  854   2HBA  HEC 105          2HBA      HEC 105   3.776  -4.028  -8.074
  855   1HMB  HEC 105          1HMB      HEC 105  -0.338   1.962  -4.199
  856   2HMB  HEC 105          2HMB      HEC 105  -1.800   2.889  -4.536
  857   3HMB  HEC 105          3HMB      HEC 105  -0.231   3.696  -4.507
  858    HAB  HEC 105           HAB      HEC 105  -2.509   4.603  -8.063
  859   1HBB  HEC 105          1HBB      HEC 105  -2.179   5.012  -5.156
  860   2HBB  HEC 105          2HBB      HEC 105  -2.468   6.174  -6.449
  861   3HBB  HEC 105          3HBB      HEC 105  -0.870   5.457  -6.251
  862   1HMC  HEC 105          1HMC      HEC 105  -1.971   4.472 -12.803
  863   2HMC  HEC 105          2HMC      HEC 105  -3.057   3.162 -13.268
  864   3HMC  HEC 105          3HMC      HEC 105  -3.020   3.725 -11.597
  865    HAC  HEC 105           HAC      HEC 105  -0.046   1.402 -15.019
  866   1HBC  HEC 105          1HBC      HEC 105  -1.036   3.814 -14.530
  867   2HBC  HEC 105          2HBC      HEC 105  -2.473   3.032 -15.185
  868   3HBC  HEC 105          3HBC      HEC 105  -0.985   3.077 -16.130
  869   1HMD  HEC 105          1HMD      HEC 105   2.987  -0.962 -14.740
  870   2HMD  HEC 105          2HMD      HEC 105   3.959  -2.390 -14.390
  871   3HMD  HEC 105          3HMD      HEC 105   2.209  -2.535 -14.553
  872   1HAD  HEC 105          1HAD      HEC 105   5.544  -2.832 -12.100
  873   2HAD  HEC 105          2HAD      HEC 105   4.670  -3.811 -10.933
  874   1HBD  HEC 105          1HBD      HEC 105   3.305  -4.063 -13.406
  875   2HBD  HEC 105          2HBD      HEC 105   4.231  -5.294 -12.551
  Start of MODEL   10
    1   1H    GLY   1          1HT       GLY   1  -9.287   9.798   9.292
    2   2H    GLY   1          2HT       GLY   1  -9.234   9.768   7.594
    3   3H    GLY   1          3HT       GLY   1  -7.839   9.415   8.497
    4   1HA   GLY   1          1HA       GLY   1  -8.553   7.324   7.866
    5   2HA   GLY   1          2HA       GLY   1  -9.214   7.510   9.491
    6    H    ASP   2           H        ASP   2  -9.988   6.912   6.236
    7    HA   ASP   2           HA       ASP   2 -12.833   6.699   6.906
    8   1HB   ASP   2          2HB       ASP   2 -11.853   8.672   4.822
    9   2HB   ASP   2          1HB       ASP   2 -13.532   8.156   4.987
   10    H    VAL   3           H        VAL   3 -12.909   4.569   6.253
   11    HA   VAL   3           HA       VAL   3 -11.568   3.668   3.817
   12    HB   VAL   3           HB       VAL   3 -11.956   2.245   5.891
   13   1HG1  VAL   3          1HG1      VAL   3 -14.116   1.304   6.276
   14   2HG1  VAL   3          2HG1      VAL   3 -14.738   1.924   4.747
   15   3HG1  VAL   3          3HG1      VAL   3 -14.386   3.035   6.072
   16   1HG2  VAL   3          1HG2      VAL   3 -11.726   1.547   3.267
   17   2HG2  VAL   3          2HG2      VAL   3 -13.254   0.766   3.673
   18   3HG2  VAL   3          3HG2      VAL   3 -11.795   0.376   4.583
   19    H    GLU   4           H        GLU   4 -14.857   4.531   4.782
   20    HA   GLU   4           HA       GLU   4 -16.306   3.532   2.588
   21   1HB   GLU   4          2HB       GLU   4 -17.904   5.376   3.018
   22   2HB   GLU   4          1HB       GLU   4 -17.382   4.610   4.520
   23   1HG   GLU   4          2HG       GLU   4 -15.732   6.395   4.878
   24   2HG   GLU   4          1HG       GLU   4 -16.210   7.156   3.360
   25    H    LYS   5           H        LYS   5 -14.303   6.449   2.812
   26    HA   LYS   5           HA       LYS   5 -14.958   7.103  -0.012
   27   1HB   LYS   5          2HB       LYS   5 -13.969   9.238   0.391
   28   2HB   LYS   5          1HB       LYS   5 -14.906   8.870   1.839
   29   1HG   LYS   5          2HG       LYS   5 -12.798   7.951   2.875
   30   2HG   LYS   5          1HG       LYS   5 -11.914   8.560   1.475
   31   1HD   LYS   5          2HD       LYS   5 -13.505  10.182   3.479
   32   2HD   LYS   5          1HD       LYS   5 -11.764  10.235   3.206
   33   1HE   LYS   5          2HE       LYS   5 -12.173  11.928   1.768
   34   2HE   LYS   5          1HE       LYS   5 -12.833  10.705   0.681
   35   1HZ   LYS   5          1HZ       LYS   5 -14.211  12.644   2.346
   36   2HZ   LYS   5          2HZ       LYS   5 -14.905  11.095   2.293
   37   3HZ   LYS   5          3HZ       LYS   5 -14.667  11.972   0.857
   38    H    GLY   6           H        GLY   6 -12.595   5.486   1.841
   39   1HA   GLY   6          1HA       GLY   6 -10.251   6.035   0.282
   40   2HA   GLY   6          2HA       GLY   6 -10.491   4.605   1.288
   41    H    LYS   7           H        LYS   7 -12.792   3.562   0.001
   42    HA   LYS   7           HA       LYS   7 -11.606   2.091  -2.136
   43   1HB   LYS   7          2HB       LYS   7 -13.645   1.450  -0.726
   44   2HB   LYS   7          1HB       LYS   7 -14.579   2.512  -1.779
   45   1HG   LYS   7          2HG       LYS   7 -13.636   1.204  -3.745
   46   2HG   LYS   7          1HG       LYS   7 -13.017   0.044  -2.568
   47   1HD   LYS   7          2HD       LYS   7 -15.886   0.826  -2.335
   48   2HD   LYS   7          1HD       LYS   7 -15.441  -0.232  -3.675
   49   1HE   LYS   7          2HE       LYS   7 -14.146  -1.577  -1.839
   50   2HE   LYS   7          1HE       LYS   7 -15.213  -0.730  -0.719
   51   1HZ   LYS   7          1HZ       LYS   7 -16.314  -2.086  -3.091
   52   2HZ   LYS   7          2HZ       LYS   7 -17.082  -1.703  -1.625
   53   3HZ   LYS   7          3HZ       LYS   7 -15.958  -2.975  -1.692
   54    H    LYS   8           H        LYS   8 -13.178   5.190  -2.071
   55    HA   LYS   8           HA       LYS   8 -13.791   5.230  -4.926
   56   1HB   LYS   8          2HB       LYS   8 -14.071   7.068  -2.624
   57   2HB   LYS   8          1HB       LYS   8 -13.786   7.856  -4.177
   58   1HG   LYS   8          2HG       LYS   8 -15.650   6.496  -5.151
   59   2HG   LYS   8          1HG       LYS   8 -15.983   5.869  -3.537
   60   1HD   LYS   8          2HD       LYS   8 -16.929   7.821  -2.830
   61   2HD   LYS   8          1HD       LYS   8 -15.786   8.817  -3.732
   62   1HE   LYS   8          2HE       LYS   8 -17.399   9.163  -5.265
   63   2HE   LYS   8          1HE       LYS   8 -17.300   7.451  -5.678
   64   1HZ   LYS   8          1HZ       LYS   8 -19.122   8.778  -3.768
   65   2HZ   LYS   8          2HZ       LYS   8 -18.826   7.107  -3.693
   66   3HZ   LYS   8          3HZ       LYS   8 -19.514   7.789  -5.088
   67    H    ILE   9           H        ILE   9 -11.228   6.494  -2.814
   68    HA   ILE   9           HA       ILE   9  -9.816   7.945  -4.834
   69    HB   ILE   9           HB       ILE   9  -8.777   6.565  -2.338
   70   1HG1  ILE   9          2HG1      ILE   9  -9.619   9.422  -2.921
   71   2HG1  ILE   9          1HG1      ILE   9 -10.447   8.285  -1.858
   72   1HG2  ILE   9          1HG2      ILE   9  -7.514   8.598  -4.199
   73   2HG2  ILE   9          2HG2      ILE   9  -6.937   6.965  -3.868
   74   3HG2  ILE   9          3HG2      ILE   9  -6.877   8.195  -2.605
   75   1HD1  ILE   9          1HD1      ILE   9  -7.553   8.831  -1.341
   76   2HD1  ILE   9          2HD1      ILE   9  -8.841   8.446  -0.201
   77   3HD1  ILE   9          3HD1      ILE   9  -8.724  10.067  -0.884
   78    H    PHE  10           H        PHE  10  -9.342   4.618  -3.593
   79    HA   PHE  10           HA       PHE  10  -7.289   3.920  -5.462
   80   1HB   PHE  10          2HB       PHE  10  -7.968   2.633  -3.367
   81   2HB   PHE  10          1HB       PHE  10  -9.332   2.013  -4.295
   82    HD1  PHE  10           HD1      PHE  10  -8.935   0.635  -6.339
   83    HD2  PHE  10           HD2      PHE  10  -5.734   1.837  -3.740
   84    HE1  PHE  10           HE1      PHE  10  -7.466  -1.089  -7.351
   85    HE2  PHE  10           HE2      PHE  10  -4.265   0.114  -4.752
   86    HZ   PHE  10           HZ       PHE  10  -5.132  -1.350  -6.558
   87    H    ILE  11           H        ILE  11 -10.823   3.709  -5.578
   88    HA   ILE  11           HA       ILE  11 -11.035   2.289  -8.042
   89    HB   ILE  11           HB       ILE  11 -12.839   4.225  -6.595
   90   1HG1  ILE  11          2HG1      ILE  11 -12.422   1.800  -5.859
   91   2HG1  ILE  11          1HG1      ILE  11 -14.107   2.266  -6.091
   92   1HG2  ILE  11          1HG2      ILE  11 -14.581   3.787  -8.249
   93   2HG2  ILE  11          2HG2      ILE  11 -13.483   2.763  -9.175
   94   3HG2  ILE  11          3HG2      ILE  11 -13.181   4.497  -9.054
   95   1HD1  ILE  11          1HD1      ILE  11 -14.371   0.874  -7.868
   96   2HD1  ILE  11          2HD1      ILE  11 -12.938   0.064  -7.234
   97   3HD1  ILE  11          3HD1      ILE  11 -12.780   1.257  -8.524
   98    H    MET  12           H        MET  12 -10.145   5.557  -7.307
   99    HA   MET  12           HA       MET  12 -10.202   6.178 -10.235
  100   1HB   MET  12          2HB       MET  12 -11.580   7.522  -8.295
  101   2HB   MET  12          1HB       MET  12 -10.082   8.451  -8.357
  102   1HG   MET  12          2HG       MET  12 -10.419   9.118 -10.546
  103   2HG   MET  12          1HG       MET  12 -11.367   7.686 -10.946
  104   1HE   MET  12          1HE       MET  12 -13.228  11.387 -11.068
  105   2HE   MET  12          2HE       MET  12 -12.041  10.417 -11.936
  106   3HE   MET  12          3HE       MET  12 -11.543  11.356 -10.531
  107    H    LYS  13           H        LYS  13  -8.053   5.153  -8.107
  108    HA   LYS  13           HA       LYS  13  -5.963   7.059  -9.083
  109   1HB   LYS  13          2HB       LYS  13  -6.645   6.967  -6.489
  110   2HB   LYS  13          1HB       LYS  13  -5.492   5.631  -6.510
  111   1HG   LYS  13          2HG       LYS  13  -3.912   7.239  -6.272
  112   2HG   LYS  13          1HG       LYS  13  -4.178   7.540  -7.989
  113   1HD   LYS  13          2HD       LYS  13  -5.426   9.441  -7.606
  114   2HD   LYS  13          1HD       LYS  13  -6.035   8.855  -6.057
  115   1HE   LYS  13          2HE       LYS  13  -3.727   9.159  -5.109
  116   2HE   LYS  13          1HE       LYS  13  -3.254   9.915  -6.630
  117   1HZ   LYS  13          1HZ       LYS  13  -4.982  11.569  -6.306
  118   2HZ   LYS  13          2HZ       LYS  13  -3.904  11.563  -4.992
  119   3HZ   LYS  13          3HZ       LYS  13  -5.435  10.843  -4.843
  120    H    CYS  14           H        CYS  14  -6.291   3.772  -7.635
  121    HA   CYS  14           HA       CYS  14  -4.349   2.872  -9.722
  122   1HB   CYS  14          2HB       CYS  14  -4.158   1.279  -7.293
  123   2HB   CYS  14          1HB       CYS  14  -2.878   2.073  -8.200
  124    H    SER  15           H        SER  15  -7.385   2.668  -9.336
  125    HA   SER  15           HA       SER  15  -7.754  -0.238  -8.992
  126   1HB   SER  15          2HB       SER  15  -9.494   1.252  -8.143
  127   2HB   SER  15          1HB       SER  15  -9.701   1.963  -9.742
  128    HG   SER  15           HG       SER  15 -10.670  -0.371  -8.712
  129    H    GLN  16           H        GLN  16  -6.455   1.461 -11.397
  130    HA   GLN  16           HA       GLN  16  -7.907   0.092 -13.596
  131   1HB   GLN  16          2HB       GLN  16  -5.693   2.159 -13.758
  132   2HB   GLN  16          1HB       GLN  16  -6.720   1.603 -15.074
  133   1HG   GLN  16          2HG       GLN  16  -8.623   2.694 -14.229
  134   2HG   GLN  16          1HG       GLN  16  -7.938   2.820 -12.607
  135   1HE2  GLN  16          1HE2      GLN  16  -8.071   4.341 -15.766
  136   2HE2  GLN  16          2HE2      GLN  16  -7.132   5.697 -15.365
  137    H    CYS  17           H        CYS  17  -4.556   0.713 -12.513
  138    HA   CYS  17           HA       CYS  17  -3.579  -1.575 -14.073
  139   1HB   CYS  17          2HB       CYS  17  -2.314   0.515 -12.312
  140   2HB   CYS  17          1HB       CYS  17  -1.411  -0.941 -12.723
  141    H    HIS  18           H        HIS  18  -4.550  -0.851 -10.783
  142    HA   HIS  18           HA       HIS  18  -3.733  -3.620  -9.983
  143   1HB   HIS  18          2HB       HIS  18  -4.212  -1.184  -8.244
  144   2HB   HIS  18          1HB       HIS  18  -3.832  -2.797  -7.643
  145    HD1  HIS  18           HD1      HIS  18  -1.400  -3.525  -7.698
  146    HD2  HIS  18           HD2      HIS  18  -2.061   0.055  -9.708
  147    HE1  HIS  18           HE1      HIS  18   0.884  -2.570  -8.231
  148    H    THR  19           H        THR  19  -5.716  -4.557 -10.768
  149    HA   THR  19           HA       THR  19  -8.278  -3.547  -9.783
  150    HB   THR  19           HB       THR  19  -9.257  -5.417 -10.949
  151    HG1  THR  19           HG1      THR  19  -6.703  -6.459 -10.582
  152   1HG2  THR  19          1HG2      THR  19  -8.738  -4.652 -13.014
  153   2HG2  THR  19          2HG2      THR  19  -7.039  -5.092 -12.839
  154   3HG2  THR  19          3HG2      THR  19  -7.626  -3.565 -12.183
  155    H    VAL  20           H        VAL  20  -7.782  -3.594  -7.474
  156    HA   VAL  20           HA       VAL  20  -7.223  -6.176  -6.205
  157    HB   VAL  20           HB       VAL  20  -7.039  -4.949  -4.183
  158   1HG1  VAL  20          1HG1      VAL  20  -5.308  -4.385  -5.883
  159   2HG1  VAL  20          2HG1      VAL  20  -5.614  -3.052  -4.770
  160   3HG1  VAL  20          3HG1      VAL  20  -6.294  -3.016  -6.397
  161   1HG2  VAL  20          1HG2      VAL  20  -7.860  -2.376  -4.470
  162   2HG2  VAL  20          2HG2      VAL  20  -8.892  -3.649  -3.815
  163   3HG2  VAL  20          3HG2      VAL  20  -9.028  -3.189  -5.512
  164    H    GLU  21           H        GLU  21  -9.775  -5.880  -7.724
  165    HA   GLU  21           HA       GLU  21 -11.540  -6.917  -5.616
  166   1HB   GLU  21          2HB       GLU  21 -13.403  -5.347  -6.415
  167   2HB   GLU  21          1HB       GLU  21 -12.149  -4.621  -5.408
  168   1HG   GLU  21          2HG       GLU  21 -11.359  -3.328  -7.105
  169   2HG   GLU  21          1HG       GLU  21 -11.552  -4.612  -8.299
  170    H    LYS  22           H        LYS  22 -10.197  -7.601  -8.313
  171    HA   LYS  22           HA       LYS  22 -12.614  -8.274  -9.906
  172   1HB   LYS  22          2HB       LYS  22 -10.494  -7.258 -10.937
  173   2HB   LYS  22          1HB       LYS  22  -9.733  -8.823 -10.647
  174   1HG   LYS  22          2HG       LYS  22 -10.538  -9.231 -12.762
  175   2HG   LYS  22          1HG       LYS  22 -11.977  -9.680 -11.847
  176   1HD   LYS  22          2HD       LYS  22 -13.016  -7.573 -12.250
  177   2HD   LYS  22          1HD       LYS  22 -11.509  -6.859 -12.826
  178   1HE   LYS  22          2HE       LYS  22 -12.894  -7.367 -14.752
  179   2HE   LYS  22          1HE       LYS  22 -11.536  -8.490 -14.734
  180   1HZ   LYS  22          1HZ       LYS  22 -13.127 -10.030 -14.918
  181   2HZ   LYS  22          2HZ       LYS  22 -14.355  -8.995 -14.363
  182   3HZ   LYS  22          3HZ       LYS  22 -13.347  -9.794 -13.253
  183    H    GLY  23           H        GLY  23  -9.618  -9.978  -8.914
  184   1HA   GLY  23          2HA       GLY  23 -10.541 -12.081  -7.470
  185   2HA   GLY  23          1HA       GLY  23 -11.027 -12.555  -9.100
  186    H    GLY  24           H        GLY  24  -8.114 -11.189  -7.509
  187   1HA   GLY  24          1HA       GLY  24  -5.859 -11.804  -7.727
  188   2HA   GLY  24          2HA       GLY  24  -6.439 -13.408  -8.178
  189    H    LYS  25           H        LYS  25  -7.677 -10.848 -10.088
  190    HA   LYS  25           HA       LYS  25  -6.061 -11.794 -12.378
  191   1HB   LYS  25          2HB       LYS  25  -8.505 -11.581 -12.658
  192   2HB   LYS  25          1HB       LYS  25  -8.399  -9.863 -12.270
  193   1HG   LYS  25          2HG       LYS  25  -8.215  -9.614 -14.529
  194   2HG   LYS  25          1HG       LYS  25  -6.530 -10.053 -14.247
  195   1HD   LYS  25          2HD       LYS  25  -8.550 -12.238 -14.611
  196   2HD   LYS  25          1HD       LYS  25  -7.964 -11.374 -16.032
  197   1HE   LYS  25          2HE       LYS  25  -5.642 -11.870 -14.602
  198   2HE   LYS  25          1HE       LYS  25  -6.587 -13.339 -14.353
  199   1HZ   LYS  25          1HZ       LYS  25  -5.215 -13.440 -16.360
  200   2HZ   LYS  25          2HZ       LYS  25  -6.037 -12.093 -16.993
  201   3HZ   LYS  25          3HZ       LYS  25  -6.868 -13.550 -16.722
  202    H    HIS  26           H        HIS  26  -4.683 -10.424 -13.560
  203    HA   HIS  26           HA       HIS  26  -4.381  -7.620 -12.672
  204   1HB   HIS  26          2HB       HIS  26  -1.764  -8.295 -12.805
  205   2HB   HIS  26          1HB       HIS  26  -2.673  -8.283 -11.298
  206    HD1  HIS  26           HD1      HIS  26  -2.976 -10.914 -14.014
  207    HD2  HIS  26           HD2      HIS  26  -1.501 -10.555 -10.130
  208    HE1  HIS  26           HE1      HIS  26  -2.398 -13.256 -13.248
  209    H    LYS  27           H        LYS  27  -3.905  -6.322 -14.400
  210    HA   LYS  27           HA       LYS  27  -3.105  -7.669 -16.920
  211   1HB   LYS  27          2HB       LYS  27  -5.031  -5.490 -16.314
  212   2HB   LYS  27          1HB       LYS  27  -4.096  -5.327 -17.801
  213   1HG   LYS  27          2HG       LYS  27  -5.097  -8.042 -17.444
  214   2HG   LYS  27          1HG       LYS  27  -6.404  -6.860 -17.476
  215   1HD   LYS  27          2HD       LYS  27  -4.220  -6.629 -19.512
  216   2HD   LYS  27          1HD       LYS  27  -5.451  -7.872 -19.733
  217   1HE   LYS  27          2HE       LYS  27  -7.010  -5.734 -19.083
  218   2HE   LYS  27          1HE       LYS  27  -5.687  -4.930 -19.928
  219   1HZ   LYS  27          1HZ       LYS  27  -5.996  -6.625 -21.720
  220   2HZ   LYS  27          2HZ       LYS  27  -7.279  -5.525 -21.545
  221   3HZ   LYS  27          3HZ       LYS  27  -7.424  -7.106 -20.941
  222    H    THR  28           H        THR  28  -3.083  -4.244 -15.959
  223    HA   THR  28           HA       THR  28  -0.308  -4.040 -16.959
  224    HB   THR  28           HB       THR  28  -2.260  -1.944 -15.962
  225    HG1  THR  28           HG1      THR  28  -2.902  -1.996 -17.941
  226   1HG2  THR  28          1HG2      THR  28  -0.015  -1.170 -15.533
  227   2HG2  THR  28          2HG2      THR  28  -0.596  -0.353 -16.985
  228   3HG2  THR  28          3HG2      THR  28   0.525  -1.708 -17.123
  229    H    GLY  29           H        GLY  29  -2.124  -3.609 -13.934
  230   1HA   GLY  29          2HA       GLY  29   0.466  -3.274 -12.494
  231   2HA   GLY  29          1HA       GLY  29  -1.104  -2.812 -11.848
  232    HA   PRO  30           HA       PRO  30   0.153  -7.348 -10.864
  233   1HB   PRO  30          2HB       PRO  30   1.316  -6.971  -8.407
  234   2HB   PRO  30          1HB       PRO  30   2.223  -7.081  -9.923
  235   1HG   PRO  30          2HG       PRO  30   1.515  -4.642  -8.325
  236   2HG   PRO  30          1HG       PRO  30   2.963  -4.968  -9.294
  237   1HD   PRO  30          2HD       PRO  30   0.869  -3.369 -10.162
  238   2HD   PRO  30          1HD       PRO  30   1.985  -4.228 -11.244
  239    H    ASN  31           H        ASN  31  -1.453  -8.466  -9.914
  240    HA   ASN  31           HA       ASN  31  -3.740  -7.320  -8.797
  241   1HB   ASN  31          2HB       ASN  31  -3.793  -9.627  -9.474
  242   2HB   ASN  31          1HB       ASN  31  -2.523 -10.052  -8.325
  243   1HD2  ASN  31          1HD2      ASN  31  -5.625  -8.205  -8.026
  244   2HD2  ASN  31          2HD2      ASN  31  -6.184  -9.092  -6.690
  245    H    LEU  32           H        LEU  32  -3.445  -5.797  -7.190
  246    HA   LEU  32           HA       LEU  32  -1.700  -6.306  -4.912
  247   1HB   LEU  32          2HB       LEU  32  -3.163  -4.047  -6.042
  248   2HB   LEU  32          1HB       LEU  32  -3.311  -4.117  -4.288
  249    HG   LEU  32           HG       LEU  32  -0.993  -3.908  -3.956
  250   1HD1  LEU  32          1HD1      LEU  32  -0.860  -5.329  -6.499
  251   2HD1  LEU  32          2HD1      LEU  32   0.333  -5.244  -5.203
  252   3HD1  LEU  32          3HD1      LEU  32   0.284  -3.987  -6.440
  253   1HD2  LEU  32          1HD2      LEU  32  -2.090  -2.246  -6.162
  254   2HD2  LEU  32          2HD2      LEU  32  -0.341  -2.190  -5.941
  255   3HD2  LEU  32          3HD2      LEU  32  -1.411  -1.751  -4.610
  256    H    HIS  33           H        HIS  33  -3.083  -8.394  -4.523
  257    HA   HIS  33           HA       HIS  33  -5.585  -7.796  -3.037
  258   1HB   HIS  33          2HB       HIS  33  -5.279  -9.689  -4.819
  259   2HB   HIS  33          1HB       HIS  33  -4.488 -10.558  -3.506
  260    HD1  HIS  33           HD1      HIS  33  -6.433 -12.268  -3.285
  261    HD2  HIS  33           HD2      HIS  33  -7.603  -8.312  -2.686
  262    HE1  HIS  33           HE1      HIS  33  -8.763 -12.353  -2.296
  263    H    GLY  34           H        GLY  34  -2.301  -8.182  -2.407
  264   1HA   GLY  34          2HA       GLY  34  -2.702  -8.202   0.446
  265   2HA   GLY  34          1HA       GLY  34  -2.158  -9.786  -0.109
  266    H    LEU  35           H        LEU  35  -1.319  -6.355  -0.735
  267    HA   LEU  35           HA       LEU  35   1.455  -7.053  -1.239
  268   1HB   LEU  35          2HB       LEU  35   0.356  -5.155  -2.389
  269   2HB   LEU  35          1HB       LEU  35   0.174  -4.337  -0.837
  270    HG   LEU  35           HG       LEU  35   2.870  -5.048  -0.912
  271   1HD1  LEU  35          1HD1      LEU  35   3.611  -4.063  -3.094
  272   2HD1  LEU  35          2HD1      LEU  35   1.927  -4.060  -3.619
  273   3HD1  LEU  35          3HD1      LEU  35   2.742  -5.587  -3.280
  274   1HD2  LEU  35          1HD2      LEU  35   3.207  -2.601  -1.203
  275   2HD2  LEU  35          2HD2      LEU  35   1.936  -2.953  -0.033
  276   3HD2  LEU  35          3HD2      LEU  35   1.513  -2.439  -1.665
  277    H    PHE  36           H        PHE  36  -0.407  -5.844   1.487
  278    HA   PHE  36           HA       PHE  36   1.840  -4.995   3.073
  279   1HB   PHE  36          2HB       PHE  36  -0.920  -5.931   3.921
  280   2HB   PHE  36          1HB       PHE  36   0.241  -5.121   4.972
  281    HD1  PHE  36           HD1      PHE  36  -1.822  -4.726   1.907
  282    HD2  PHE  36           HD2      PHE  36   0.566  -2.753   4.882
  283    HE1  PHE  36           HE1      PHE  36  -2.591  -2.530   1.063
  284    HE2  PHE  36           HE2      PHE  36  -0.207  -0.552   4.041
  285    HZ   PHE  36           HZ       PHE  36  -1.785  -0.439   2.131
  286    H    GLY  37           H        GLY  37   3.343  -6.264   4.033
  287   1HA   GLY  37          2HA       GLY  37   4.271  -8.129   5.145
  288   2HA   GLY  37          1HA       GLY  37   2.649  -8.814   5.253
  289    H    ARG  38           H        ARG  38   3.997  -7.764   2.193
  290    HA   ARG  38           HA       ARG  38   4.696 -10.546   1.449
  291   1HB   ARG  38          2HB       ARG  38   2.166  -9.576   0.891
  292   2HB   ARG  38          1HB       ARG  38   3.050  -9.229  -0.595
  293   1HG   ARG  38          2HG       ARG  38   3.720 -11.869   0.397
  294   2HG   ARG  38          1HG       ARG  38   1.977 -11.710   0.186
  295   1HD   ARG  38          2HD       ARG  38   4.154 -11.380  -1.874
  296   2HD   ARG  38          1HD       ARG  38   2.731 -12.418  -1.935
  297    HE   ARG  38           HE       ARG  38   1.408 -10.219  -2.093
  298   1HH1  ARG  38          1HH1      ARG  38   2.954 -11.082  -4.604
  299   2HH1  ARG  38          2HH1      ARG  38   3.660  -9.574  -5.082
  300   1HH2  ARG  38          1HH2      ARG  38   3.074  -8.029  -2.032
  301   2HH2  ARG  38          2HH2      ARG  38   3.731  -7.847  -3.624
  302    H    LYS  39           H        LYS  39   6.634 -10.393   0.428
  303    HA   LYS  39           HA       LYS  39   7.759  -7.906  -0.451
  304   1HB   LYS  39          2HB       LYS  39   9.456  -9.414  -1.588
  305   2HB   LYS  39          1HB       LYS  39   9.245  -9.709   0.138
  306   1HG   LYS  39          2HG       LYS  39   7.319 -11.264  -1.327
  307   2HG   LYS  39          1HG       LYS  39   8.930 -11.570  -1.979
  308   1HD   LYS  39          2HD       LYS  39   9.501 -12.772  -0.164
  309   2HD   LYS  39          1HD       LYS  39   9.023 -11.458   0.911
  310   1HE   LYS  39          2HE       LYS  39   6.954 -12.350   1.302
  311   2HE   LYS  39          1HE       LYS  39   6.800 -12.972  -0.341
  312   1HZ   LYS  39          1HZ       LYS  39   7.123 -14.621   1.586
  313   2HZ   LYS  39          2HZ       LYS  39   8.755 -14.152   1.520
  314   3HZ   LYS  39          3HZ       LYS  39   8.014 -14.852   0.161
  315    H    THR  40           H        THR  40   8.576  -7.726  -2.853
  316    HA   THR  40           HA       THR  40   6.174  -7.859  -4.550
  317    HB   THR  40           HB       THR  40   7.196  -6.274  -5.874
  318    HG1  THR  40           HG1      THR  40   8.882  -7.289  -6.717
  319   1HG2  THR  40          1HG2      THR  40   7.898  -4.691  -4.408
  320   2HG2  THR  40          2HG2      THR  40   9.223  -5.696  -3.820
  321   3HG2  THR  40          3HG2      THR  40   7.597  -5.918  -3.178
  322    H    GLY  41           H        GLY  41   6.685  -8.514  -6.963
  323   1HA   GLY  41          2HA       GLY  41   7.171 -10.252  -8.453
  324   2HA   GLY  41          1HA       GLY  41   8.669 -10.459  -7.550
  325    H    GLN  42           H        GLN  42   5.426 -11.649  -8.012
  326    HA   GLN  42           HA       GLN  42   6.133 -14.119  -6.611
  327   1HB   GLN  42          2HB       GLN  42   4.866 -12.096  -5.123
  328   2HB   GLN  42          1HB       GLN  42   3.593 -13.253  -5.519
  329   1HG   GLN  42          2HG       GLN  42   4.736 -13.855  -3.406
  330   2HG   GLN  42          1HG       GLN  42   4.974 -15.091  -4.641
  331   1HE2  GLN  42          1HE2      GLN  42   6.587 -12.130  -3.353
  332   2HE2  GLN  42          2HE2      GLN  42   8.165 -12.702  -3.611
  333    H    ALA  43           H        ALA  43   3.262 -12.295  -7.759
  334    HA   ALA  43           HA       ALA  43   1.622 -14.382  -8.518
  335   1HB   ALA  43          1HB       ALA  43   1.145 -11.921  -8.809
  336   2HB   ALA  43          2HB       ALA  43   0.646 -12.919 -10.175
  337   3HB   ALA  43          3HB       ALA  43   2.126 -11.965 -10.274
  338    HA   PRO  44           HA       PRO  44   4.067 -16.538 -11.539
  339   1HB   PRO  44          2HB       PRO  44   2.139 -18.381 -12.200
  340   2HB   PRO  44          1HB       PRO  44   3.110 -18.471 -10.721
  341   1HG   PRO  44          2HG       PRO  44   0.255 -17.679 -11.044
  342   2HG   PRO  44          1HG       PRO  44   1.074 -18.370  -9.634
  343   1HD   PRO  44          2HD       PRO  44   0.396 -15.642  -9.994
  344   2HD   PRO  44          1HD       PRO  44   1.481 -16.298  -8.749
  345    H    GLY  45           H        GLY  45   4.296 -16.332 -13.774
  346   1HA   GLY  45          2HA       GLY  45   3.603 -16.017 -16.033
  347   2HA   GLY  45          1HA       GLY  45   1.947 -15.787 -15.467
  348    H    TYR  46           H        TYR  46   2.168 -13.753 -13.675
  349    HA   TYR  46           HA       TYR  46   2.716 -11.457 -15.415
  350   1HB   TYR  46          2HB       TYR  46   0.739 -11.572 -13.881
  351   2HB   TYR  46          1HB       TYR  46   1.844 -11.536 -12.513
  352    HD1  TYR  46           HD1      TYR  46   3.607  -9.497 -14.617
  353    HD2  TYR  46           HD2      TYR  46  -0.172  -9.520 -12.584
  354    HE1  TYR  46           HE1      TYR  46   3.560  -7.045 -14.683
  355    HE2  TYR  46           HE2      TYR  46  -0.173  -7.054 -12.637
  356    HH   TYR  46           HH       TYR  46   1.424  -5.205 -12.838
  357    H    SER  47           H        SER  47   4.879 -11.056 -15.634
  358    HA   SER  47           HA       SER  47   6.739 -11.400 -13.412
  359   1HB   SER  47          2HB       SER  47   8.060  -9.865 -15.286
  360   2HB   SER  47          1HB       SER  47   8.041 -11.626 -15.261
  361    HG   SER  47           HG       SER  47   7.294 -11.134 -17.237
  362    H    TYR  48           H        TYR  48   5.584  -9.973 -11.895
  363    HA   TYR  48           HA       TYR  48   4.889  -7.305 -12.144
  364   1HB   TYR  48          2HB       TYR  48   6.341  -8.728  -9.927
  365   2HB   TYR  48          1HB       TYR  48   5.834  -7.061  -9.766
  366    HD1  TYR  48           HD1      TYR  48   3.633  -9.077 -11.806
  367    HD2  TYR  48           HD2      TYR  48   4.614  -7.977  -7.787
  368    HE1  TYR  48           HE1      TYR  48   1.410  -9.872 -11.039
  369    HE2  TYR  48           HE2      TYR  48   2.387  -8.761  -7.014
  370    HH   TYR  48           HH       TYR  48  -0.099  -9.067  -8.618
  371    H    THR  49           H        THR  49   6.296  -5.380 -11.219
  372    HA   THR  49           HA       THR  49   8.586  -5.028 -12.913
  373    HB   THR  49           HB       THR  49   7.566  -3.016 -12.189
  374    HG1  THR  49           HG1      THR  49   9.219  -2.116 -10.728
  375   1HG2  THR  49          1HG2      THR  49   7.839  -2.972  -9.372
  376   2HG2  THR  49          2HG2      THR  49   7.125  -4.531  -9.781
  377   3HG2  THR  49          3HG2      THR  49   6.344  -3.040 -10.304
  378    H    ALA  50           H        ALA  50   9.869  -6.907 -12.486
  379    HA   ALA  50           HA       ALA  50  10.769  -8.006 -10.145
  380   1HB   ALA  50          1HB       ALA  50  11.785  -9.102 -11.868
  381   2HB   ALA  50          2HB       ALA  50  13.112  -7.989 -11.534
  382   3HB   ALA  50          3HB       ALA  50  11.966  -7.631 -12.825
  383    H    ALA  51           H        ALA  51  11.891  -4.975 -11.583
  384    HA   ALA  51           HA       ALA  51  14.127  -4.320 -10.133
  385   1HB   ALA  51          1HB       ALA  51  13.407  -1.981 -10.220
  386   2HB   ALA  51          2HB       ALA  51  11.739  -2.483 -10.491
  387   3HB   ALA  51          3HB       ALA  51  12.964  -2.792 -11.719
  388    H    ASN  52           H        ASN  52  10.867  -3.462  -8.900
  389    HA   ASN  52           HA       ASN  52  11.534  -2.791  -6.292
  390   1HB   ASN  52          2HB       ASN  52   9.175  -3.343  -7.669
  391   2HB   ASN  52          1HB       ASN  52   9.179  -4.516  -6.351
  392   1HD2  ASN  52          1HD2      ASN  52   7.874  -1.643  -6.958
  393   2HD2  ASN  52          2HD2      ASN  52   8.017  -0.882  -5.450
  394    H    LYS  53           H        LYS  53  10.757  -6.088  -7.445
  395    HA   LYS  53           HA       LYS  53  11.087  -7.489  -5.057
  396   1HB   LYS  53          2HB       LYS  53  10.482  -8.349  -7.432
  397   2HB   LYS  53          1HB       LYS  53  12.220  -8.570  -7.629
  398   1HG   LYS  53          2HG       LYS  53  11.888  -9.699  -5.191
  399   2HG   LYS  53          1HG       LYS  53  10.312 -10.046  -5.902
  400   1HD   LYS  53          2HD       LYS  53  11.393 -11.084  -7.845
  401   2HD   LYS  53          1HD       LYS  53  12.981 -10.700  -7.181
  402   1HE   LYS  53          2HE       LYS  53  12.480 -12.092  -5.196
  403   2HE   LYS  53          1HE       LYS  53  10.909 -12.495  -5.886
  404   1HZ   LYS  53          1HZ       LYS  53  12.974 -14.034  -6.248
  405   2HZ   LYS  53          2HZ       LYS  53  13.304 -12.947  -7.511
  406   3HZ   LYS  53          3HZ       LYS  53  11.836 -13.803  -7.483
  407    H    ASN  54           H        ASN  54  13.652  -6.437  -7.306
  408    HA   ASN  54           HA       ASN  54  15.765  -7.702  -5.823
  409   1HB   ASN  54          2HB       ASN  54  16.004  -5.333  -7.693
  410   2HB   ASN  54          1HB       ASN  54  17.273  -6.478  -7.258
  411   1HD2  ASN  54          1HD2      ASN  54  16.749  -6.217  -9.963
  412   2HD2  ASN  54          2HD2      ASN  54  15.918  -7.580 -10.542
  413    H    LYS  55           H        LYS  55  14.226  -4.532  -5.671
  414    HA   LYS  55           HA       LYS  55  16.156  -3.146  -4.156
  415   1HB   LYS  55          2HB       LYS  55  13.982  -2.215  -5.074
  416   2HB   LYS  55          1HB       LYS  55  13.170  -2.967  -3.700
  417   1HG   LYS  55          2HG       LYS  55  13.664  -1.115  -2.512
  418   2HG   LYS  55          1HG       LYS  55  15.354  -1.617  -2.579
  419   1HD   LYS  55          2HD       LYS  55  14.323  -0.263  -5.007
  420   2HD   LYS  55          1HD       LYS  55  14.472   0.749  -3.569
  421   1HE   LYS  55          2HE       LYS  55  16.724  -1.064  -4.417
  422   2HE   LYS  55          1HE       LYS  55  16.540   0.541  -5.124
  423   1HZ   LYS  55          1HZ       LYS  55  16.513   0.155  -2.199
  424   2HZ   LYS  55          2HZ       LYS  55  16.850   1.567  -3.084
  425   3HZ   LYS  55          3HZ       LYS  55  17.979   0.297  -3.043
  426    H    GLY  56           H        GLY  56  14.292  -5.903  -3.270
  427   1HA   GLY  56          1HA       GLY  56  14.212  -7.110  -1.256
  428   2HA   GLY  56          2HA       GLY  56  15.625  -6.179  -0.749
  429    H    ILE  57           H        ILE  57  12.248  -5.294  -1.527
  430    HA   ILE  57           HA       ILE  57  12.186  -3.803   1.067
  431    HB   ILE  57           HB       ILE  57  11.972  -2.533  -1.156
  432   1HG1  ILE  57          2HG1      ILE  57  11.270  -1.645   1.080
  433   2HG1  ILE  57          1HG1      ILE  57  10.287  -1.028  -0.249
  434   1HG2  ILE  57          1HG2      ILE  57  10.312  -4.413  -1.962
  435   2HG2  ILE  57          2HG2      ILE  57  10.037  -2.739  -2.439
  436   3HG2  ILE  57          3HG2      ILE  57   9.109  -3.441  -1.114
  437   1HD1  ILE  57          1HD1      ILE  57   8.888  -3.273   0.404
  438   2HD1  ILE  57          2HD1      ILE  57   8.545  -1.677   1.070
  439   3HD1  ILE  57          3HD1      ILE  57   9.532  -2.818   1.982
  440    H    ILE  58           H        ILE  58  10.649  -4.363   2.543
  441    HA   ILE  58           HA       ILE  58   8.743  -6.521   1.803
  442    HB   ILE  58           HB       ILE  58   9.921  -7.017   3.825
  443   1HG1  ILE  58          2HG1      ILE  58   8.153  -7.178   5.434
  444   2HG1  ILE  58          1HG1      ILE  58   7.341  -5.756   4.781
  445   1HG2  ILE  58          1HG2      ILE  58  10.915  -4.973   4.449
  446   2HG2  ILE  58          2HG2      ILE  58   9.758  -5.274   5.745
  447   3HG2  ILE  58          3HG2      ILE  58   9.370  -4.123   4.467
  448   1HD1  ILE  58          1HD1      ILE  58   7.828  -8.050   2.931
  449   2HD1  ILE  58          2HD1      ILE  58   6.492  -6.900   2.963
  450   3HD1  ILE  58          3HD1      ILE  58   6.549  -8.219   4.133
  451    H    TRP  59           H        TRP  59   7.104  -5.430   0.729
  452    HA   TRP  59           HA       TRP  59   6.064  -2.939   0.967
  453   1HB   TRP  59          2HB       TRP  59   4.615  -5.561   0.642
  454   2HB   TRP  59          1HB       TRP  59   3.763  -4.018   0.568
  455    HD1  TRP  59           HD1      TRP  59   4.949  -6.319  -1.776
  456    HE1  TRP  59           HE1      TRP  59   5.853  -5.227  -3.931
  457    HE3  TRP  59           HE3      TRP  59   5.565  -1.526  -0.138
  458    HZ2  TRP  59           HZ2      TRP  59   6.725  -2.653  -4.834
  459    HZ3  TRP  59           HZ3      TRP  59   6.432   0.223  -1.659
  460    HH2  TRP  59           HH2      TRP  59   7.012  -0.336  -4.002
  461    H    GLY  60           H        GLY  60   5.360  -1.704   2.576
  462   1HA   GLY  60          1HA       GLY  60   3.780  -2.906   4.784
  463   2HA   GLY  60          2HA       GLY  60   5.219  -1.976   5.209
  464    H    GLU  61           H        GLU  61   3.556  -0.556   6.317
  465    HA   GLU  61           HA       GLU  61   1.726   0.976   4.650
  466   1HB   GLU  61          2HB       GLU  61   1.409   0.504   7.123
  467   2HB   GLU  61          1HB       GLU  61   2.694   1.672   7.434
  468   1HG   GLU  61          2HG       GLU  61   0.769   2.771   5.574
  469   2HG   GLU  61          1HG       GLU  61  -0.040   2.228   7.044
  470    H    ASP  62           H        ASP  62   4.317   2.278   6.740
  471    HA   ASP  62           HA       ASP  62   4.634   4.660   5.226
  472   1HB   ASP  62          2HB       ASP  62   6.898   4.762   6.411
  473   2HB   ASP  62          1HB       ASP  62   5.482   4.637   7.457
  474    H    THR  63           H        THR  63   6.155   1.488   4.928
  475    HA   THR  63           HA       THR  63   8.266   2.204   3.168
  476    HB   THR  63           HB       THR  63   7.322  -0.314   2.316
  477    HG1  THR  63           HG1      THR  63   7.077  -1.288   4.432
  478   1HG2  THR  63          1HG2      THR  63   9.187  -0.985   4.095
  479   2HG2  THR  63          2HG2      THR  63   9.466   0.757   4.095
  480   3HG2  THR  63          3HG2      THR  63   9.605  -0.158   2.594
  481    H    LEU  64           H        LEU  64   4.923   1.191   2.480
  482    HA   LEU  64           HA       LEU  64   5.095   1.401  -0.361
  483   1HB   LEU  64          2HB       LEU  64   3.114   0.778   1.526
  484   2HB   LEU  64          1HB       LEU  64   2.498   2.193   0.674
  485    HG   LEU  64           HG       LEU  64   3.475  -0.383  -0.592
  486   1HD1  LEU  64          1HD1      LEU  64   1.329  -0.950  -0.068
  487   2HD1  LEU  64          2HD1      LEU  64   0.926   0.057  -1.457
  488   3HD1  LEU  64          3HD1      LEU  64   0.841   0.727   0.171
  489   1HD2  LEU  64          1HD2      LEU  64   2.575   2.261  -1.762
  490   2HD2  LEU  64          2HD2      LEU  64   2.577   0.764  -2.693
  491   3HD2  LEU  64          3HD2      LEU  64   4.091   1.409  -2.059
  492    H    MET  65           H        MET  65   4.434   3.781   2.169
  493    HA   MET  65           HA       MET  65   3.532   5.925   0.573
  494   1HB   MET  65          2HB       MET  65   3.533   6.031   3.022
  495   2HB   MET  65          1HB       MET  65   5.297   6.000   3.039
  496   1HG   MET  65          2HG       MET  65   5.395   8.132   1.873
  497   2HG   MET  65          1HG       MET  65   3.642   8.147   1.681
  498   1HE   MET  65          1HE       MET  65   5.974  10.211   4.556
  499   2HE   MET  65          2HE       MET  65   4.873  10.871   3.349
  500   3HE   MET  65          3HE       MET  65   6.120   9.726   2.861
  501    H    GLU  66           H        GLU  66   6.811   4.731   1.154
  502    HA   GLU  66           HA       GLU  66   8.121   6.947  -0.145
  503   1HB   GLU  66          2HB       GLU  66   9.186   5.292   1.479
  504   2HB   GLU  66          1HB       GLU  66   9.226   4.148   0.135
  505   1HG   GLU  66          2HG       GLU  66  10.237   6.694  -0.754
  506   2HG   GLU  66          1HG       GLU  66  11.097   6.202   0.706
  507    H    TYR  67           H        TYR  67   7.699   3.553  -1.225
  508    HA   TYR  67           HA       TYR  67   8.547   3.942  -3.887
  509   1HB   TYR  67          2HB       TYR  67   8.209   1.701  -3.122
  510   2HB   TYR  67          1HB       TYR  67   6.526   2.025  -2.705
  511    HD1  TYR  67           HD1      TYR  67   4.971   1.114  -4.174
  512    HD2  TYR  67           HD2      TYR  67   8.737   2.484  -5.715
  513    HE1  TYR  67           HE1      TYR  67   4.275   0.456  -6.459
  514    HE2  TYR  67           HE2      TYR  67   8.040   1.823  -7.998
  515    HH   TYR  67           HH       TYR  67   5.816  -0.223  -8.722
  516    H    LEU  68           H        LEU  68   5.622   4.966  -2.338
  517    HA   LEU  68           HA       LEU  68   4.212   5.355  -4.892
  518   1HB   LEU  68          2HB       LEU  68   3.415   5.051  -2.204
  519   2HB   LEU  68          1HB       LEU  68   2.982   6.702  -2.650
  520    HG   LEU  68           HG       LEU  68   1.933   5.750  -4.752
  521   1HD1  LEU  68          1HD1      LEU  68   1.620   3.433  -4.998
  522   2HD1  LEU  68          2HD1      LEU  68   1.948   3.113  -3.295
  523   3HD1  LEU  68          3HD1      LEU  68   3.270   3.533  -4.384
  524   1HD2  LEU  68          1HD2      LEU  68   0.086   6.062  -3.500
  525   2HD2  LEU  68          2HD2      LEU  68   0.996   5.737  -2.025
  526   3HD2  LEU  68          3HD2      LEU  68   0.247   4.409  -2.909
  527    H    GLU  69           H        GLU  69   5.970   7.256  -2.504
  528    HA   GLU  69           HA       GLU  69   5.228   9.844  -3.445
  529   1HB   GLU  69          2HB       GLU  69   6.693   9.000  -1.379
  530   2HB   GLU  69          1HB       GLU  69   8.010   9.310  -2.501
  531   1HG   GLU  69          2HG       GLU  69   6.729  11.589  -2.896
  532   2HG   GLU  69          1HG       GLU  69   6.054  11.240  -1.303
  533    H    ASN  70           H        ASN  70   7.288   7.353  -4.634
  534    HA   ASN  70           HA       ASN  70   7.567   8.511  -7.226
  535   1HB   ASN  70          2HB       ASN  70   9.116   9.970  -5.732
  536   2HB   ASN  70          1HB       ASN  70  10.173   8.558  -5.716
  537   1HD2  ASN  70          1HD2      ASN  70   9.294  11.330  -7.534
  538   2HD2  ASN  70          2HD2      ASN  70  10.093  10.922  -8.974
  539    HA   PRO  71           HA       PRO  71   8.397   4.061  -6.999
  540   1HB   PRO  71          2HB       PRO  71   7.121   3.521  -9.383
  541   2HB   PRO  71          1HB       PRO  71   6.292   3.620  -7.819
  542   1HG   PRO  71          2HG       PRO  71   6.320   5.596 -10.055
  543   2HG   PRO  71          1HG       PRO  71   5.077   5.304  -8.828
  544   1HD   PRO  71          2HD       PRO  71   6.931   7.427  -8.795
  545   2HD   PRO  71          1HD       PRO  71   5.960   6.879  -7.413
  546    H    LYS  72           H        LYS  72   8.902   6.360  -9.635
  547    HA   LYS  72           HA       LYS  72  10.758   4.668 -11.081
  548   1HB   LYS  72          2HB       LYS  72   9.489   6.523 -12.167
  549   2HB   LYS  72          1HB       LYS  72  10.413   7.678 -11.207
  550   1HG   LYS  72          2HG       LYS  72  12.369   7.308 -12.386
  551   2HG   LYS  72          1HG       LYS  72  11.925   5.652 -12.805
  552   1HD   LYS  72          2HD       LYS  72  11.291   6.425 -14.825
  553   2HD   LYS  72          1HD       LYS  72   9.961   7.249 -14.011
  554   1HE   LYS  72          2HE       LYS  72  12.620   8.585 -13.919
  555   2HE   LYS  72          1HE       LYS  72  11.789   8.574 -15.474
  556   1HZ   LYS  72          1HZ       LYS  72  11.168  10.033 -13.085
  557   2HZ   LYS  72          2HZ       LYS  72   9.826   9.204 -13.714
  558   3HZ   LYS  72          3HZ       LYS  72  10.673  10.313 -14.682
  559    H    LYS  73           H        LYS  73  10.910   6.516  -8.235
  560    HA   LYS  73           HA       LYS  73  13.840   6.949  -8.437
  561   1HB   LYS  73          2HB       LYS  73  12.761   8.842  -7.517
  562   2HB   LYS  73          1HB       LYS  73  11.691   7.857  -6.523
  563   1HG   LYS  73          2HG       LYS  73  13.154   7.922  -4.818
  564   2HG   LYS  73          1HG       LYS  73  14.429   7.267  -5.845
  565   1HD   LYS  73          2HD       LYS  73  15.385   9.307  -5.416
  566   2HD   LYS  73          1HD       LYS  73  14.385   9.786  -6.789
  567   1HE   LYS  73          2HE       LYS  73  12.810   9.854  -4.375
  568   2HE   LYS  73          1HE       LYS  73  14.278  10.805  -4.151
  569   1HZ   LYS  73          1HZ       LYS  73  11.988  11.399  -5.710
  570   2HZ   LYS  73          2HZ       LYS  73  13.377  11.385  -6.691
  571   3HZ   LYS  73          3HZ       LYS  73  13.308  12.393  -5.326
  572    H    TYR  74           H        TYR  74  11.463   5.279  -6.354
  573    HA   TYR  74           HA       TYR  74  13.487   3.981  -4.741
  574   1HB   TYR  74          2HB       TYR  74  11.011   4.381  -4.155
  575   2HB   TYR  74          1HB       TYR  74  10.668   2.983  -5.172
  576    HD1  TYR  74           HD1      TYR  74  10.279   1.077  -3.899
  577    HD2  TYR  74           HD2      TYR  74  13.365   3.810  -2.690
  578    HE1  TYR  74           HE1      TYR  74  10.886  -0.435  -2.028
  579    HE2  TYR  74           HE2      TYR  74  13.972   2.297  -0.819
  580    HH   TYR  74           HH       TYR  74  12.729  -0.911  -0.573
  581    H    ILE  75           H        ILE  75  11.169   2.559  -7.063
  582    HA   ILE  75           HA       ILE  75  12.821   0.206  -7.427
  583    HB   ILE  75           HB       ILE  75  10.531   1.021  -9.200
  584   1HG1  ILE  75          2HG1      ILE  75   9.684   1.536  -7.021
  585   2HG1  ILE  75          1HG1      ILE  75   9.048  -0.055  -7.432
  586   1HG2  ILE  75          1HG2      ILE  75  12.092  -1.290  -8.822
  587   2HG2  ILE  75          2HG2      ILE  75  10.644  -1.125  -9.814
  588   3HG2  ILE  75          3HG2      ILE  75  10.508  -1.649  -8.135
  589   1HD1  ILE  75          1HD1      ILE  75  11.321   0.625  -5.564
  590   2HD1  ILE  75          2HD1      ILE  75  11.111  -0.997  -6.218
  591   3HD1  ILE  75          3HD1      ILE  75   9.853  -0.286  -5.209
  592    HA   PRO  76           HA       PRO  76  15.173   2.205 -10.649
  593   1HB   PRO  76          2HB       PRO  76  16.710   0.005 -11.258
  594   2HB   PRO  76          1HB       PRO  76  17.019   1.071  -9.877
  595   1HG   PRO  76          2HG       PRO  76  15.824  -1.667  -9.909
  596   2HG   PRO  76          1HG       PRO  76  16.747  -0.859  -8.630
  597   1HD   PRO  76          2HD       PRO  76  13.949  -1.159  -8.668
  598   2HD   PRO  76          1HD       PRO  76  14.850  -0.020  -7.647
  599    H    GLY  77           H        GLY  77  12.994   2.108 -11.878
  600   1HA   GLY  77          2HA       GLY  77  12.650   1.754 -14.322
  601   2HA   GLY  77          1HA       GLY  77  13.228   0.106 -14.084
  602    H    THR  78           H        THR  78  10.979   1.749 -11.875
  603    HA   THR  78           HA       THR  78   9.170  -0.391 -11.715
  604    HB   THR  78           HB       THR  78   9.098   1.680 -10.266
  605    HG1  THR  78           HG1      THR  78   7.355   0.207 -10.342
  606   1HG2  THR  78          1HG2      THR  78   7.881   2.799 -12.800
  607   2HG2  THR  78          2HG2      THR  78   9.244   3.437 -11.882
  608   3HG2  THR  78          3HG2      THR  78   7.613   3.526 -11.217
  609    H    LYS  79           H        LYS  79   6.962  -0.545 -12.674
  610    HA   LYS  79           HA       LYS  79   7.066   0.257 -15.543
  611   1HB   LYS  79          2HB       LYS  79   5.554  -1.923 -14.082
  612   2HB   LYS  79          1HB       LYS  79   5.218  -1.489 -15.758
  613   1HG   LYS  79          2HG       LYS  79   7.931  -1.730 -15.841
  614   2HG   LYS  79          1HG       LYS  79   7.534  -2.933 -14.613
  615   1HD   LYS  79          2HD       LYS  79   6.907  -4.349 -16.244
  616   2HD   LYS  79          1HD       LYS  79   5.623  -3.227 -16.692
  617   1HE   LYS  79          2HE       LYS  79   6.775  -3.248 -18.687
  618   2HE   LYS  79          1HE       LYS  79   7.675  -1.969 -17.871
  619   1HZ   LYS  79          1HZ       LYS  79   9.173  -3.787 -17.034
  620   2HZ   LYS  79          2HZ       LYS  79   9.263  -3.469 -18.701
  621   3HZ   LYS  79          3HZ       LYS  79   8.410  -4.826 -18.137
  622    H    MET  80           H        MET  80   6.018   1.667 -12.884
  623    HA   MET  80           HA       MET  80   3.488   2.572 -14.193
  624   1HB   MET  80          2HB       MET  80   2.336   2.615 -12.085
  625   2HB   MET  80          1HB       MET  80   3.123   1.053 -12.222
  626   1HG   MET  80          2HG       MET  80   4.899   1.711 -10.781
  627   2HG   MET  80          1HG       MET  80   4.353   3.372 -10.771
  628   1HE   MET  80          1HE       MET  80   3.348   4.358  -9.448
  629   2HE   MET  80          2HE       MET  80   3.168   3.791  -7.790
  630   3HE   MET  80          3HE       MET  80   1.745   3.962  -8.814
  631    H    ILE  81           H        ILE  81   3.384   4.720 -14.479
  632    HA   ILE  81           HA       ILE  81   5.313   6.445 -12.983
  633    HB   ILE  81           HB       ILE  81   5.455   6.342 -15.533
  634   1HG1  ILE  81          2HG1      ILE  81   5.502   8.888 -15.729
  635   2HG1  ILE  81          1HG1      ILE  81   4.891   8.937 -14.075
  636   1HG2  ILE  81          1HG2      ILE  81   3.000   8.086 -15.483
  637   2HG2  ILE  81          2HG2      ILE  81   2.852   6.337 -15.648
  638   3HG2  ILE  81          3HG2      ILE  81   3.744   7.263 -16.854
  639   1HD1  ILE  81          1HD1      ILE  81   6.883   8.277 -13.182
  640   2HD1  ILE  81          2HD1      ILE  81   7.542   8.873 -14.706
  641   3HD1  ILE  81          3HD1      ILE  81   7.212   7.153 -14.501
  642    H    PHE  82           H        PHE  82   2.920   5.555 -11.837
  643    HA   PHE  82           HA       PHE  82   0.669   7.240 -12.134
  644   1HB   PHE  82          2HB       PHE  82   0.183   5.387 -10.860
  645   2HB   PHE  82          1HB       PHE  82   1.748   5.400 -10.057
  646    HD1  PHE  82           HD1      PHE  82   1.645   5.780  -7.775
  647    HD2  PHE  82           HD2      PHE  82  -1.153   7.755 -10.362
  648    HE1  PHE  82           HE1      PHE  82   0.609   6.890  -5.810
  649    HE2  PHE  82           HE2      PHE  82  -2.192   8.866  -8.401
  650    HZ   PHE  82           HZ       PHE  82  -1.312   8.429  -6.123
  651    H    VAL  83           H        VAL  83   3.548   7.602 -10.106
  652    HA   VAL  83           HA       VAL  83   3.216   9.498  -8.303
  653    HB   VAL  83           HB       VAL  83   5.147  10.808  -9.871
  654   1HG1  VAL  83          1HG1      VAL  83   5.245  10.309  -7.463
  655   2HG1  VAL  83          2HG1      VAL  83   6.692   9.729  -8.285
  656   3HG1  VAL  83          3HG1      VAL  83   5.425   8.593  -7.822
  657   1HG2  VAL  83          1HG2      VAL  83   6.481   9.103 -10.856
  658   2HG2  VAL  83          2HG2      VAL  83   4.841   8.741 -11.390
  659   3HG2  VAL  83          3HG2      VAL  83   5.562   7.818 -10.072
  660    H    GLY  84           H        GLY  84   1.827  11.139  -8.108
  661   1HA   GLY  84          2HA       GLY  84   1.911  13.519  -9.611
  662   2HA   GLY  84          1HA       GLY  84   0.636  12.527 -10.320
  663    H    ILE  85           H        ILE  85   1.528  12.535  -6.899
  664    HA   ILE  85           HA       ILE  85  -1.205  13.591  -6.299
  665    HB   ILE  85           HB       ILE  85   0.493  12.095  -4.317
  666   1HG1  ILE  85          2HG1      ILE  85  -1.277  10.239  -5.427
  667   2HG1  ILE  85          1HG1      ILE  85  -0.586  11.065  -6.824
  668   1HG2  ILE  85          1HG2      ILE  85  -2.147  11.337  -4.077
  669   2HG2  ILE  85          2HG2      ILE  85  -2.284  13.014  -4.605
  670   3HG2  ILE  85          3HG2      ILE  85  -1.377  12.621  -3.145
  671   1HD1  ILE  85          1HD1      ILE  85   1.601  10.672  -5.149
  672   2HD1  ILE  85          2HD1      ILE  85   1.206   9.712  -6.574
  673   3HD1  ILE  85          3HD1      ILE  85   0.672   9.182  -4.980
  674    H    LYS  86           H        LYS  86  -1.198  14.663  -3.984
  675    HA   LYS  86           HA       LYS  86   1.226  15.950  -3.097
  676   1HB   LYS  86          2HB       LYS  86  -0.153  17.184  -5.300
  677   2HB   LYS  86          1HB       LYS  86  -0.286  18.222  -3.879
  678   1HG   LYS  86          2HG       LYS  86   2.374  16.995  -4.482
  679   2HG   LYS  86          1HG       LYS  86   1.840  18.354  -5.474
  680   1HD   LYS  86          2HD       LYS  86   1.440  19.676  -3.409
  681   2HD   LYS  86          1HD       LYS  86   2.047  18.327  -2.448
  682   1HE   LYS  86          2HE       LYS  86   4.233  18.497  -3.464
  683   2HE   LYS  86          1HE       LYS  86   3.652  19.692  -4.625
  684   1HZ   LYS  86          1HZ       LYS  86   3.808  20.033  -1.678
  685   2HZ   LYS  86          2HZ       LYS  86   3.162  21.175  -2.757
  686   3HZ   LYS  86          3HZ       LYS  86   4.811  20.773  -2.828
  687    H    LYS  87           H        LYS  87  -0.881  14.533  -1.838
  688    HA   LYS  87           HA       LYS  87  -1.868  16.659  -0.005
  689   1HB   LYS  87          2HB       LYS  87  -3.515  15.216  -1.825
  690   2HB   LYS  87          1HB       LYS  87  -3.860  14.604  -0.207
  691   1HG   LYS  87          2HG       LYS  87  -5.083  16.444   0.202
  692   2HG   LYS  87          1HG       LYS  87  -3.627  17.424   0.018
  693   1HD   LYS  87          2HD       LYS  87  -4.879  16.506  -2.508
  694   2HD   LYS  87          1HD       LYS  87  -5.806  17.685  -1.581
  695   1HE   LYS  87          2HE       LYS  87  -3.483  18.921  -1.401
  696   2HE   LYS  87          1HE       LYS  87  -3.098  17.972  -2.836
  697   1HZ   LYS  87          1HZ       LYS  87  -4.102  20.200  -3.272
  698   2HZ   LYS  87          2HZ       LYS  87  -5.546  19.623  -2.590
  699   3HZ   LYS  87          3HZ       LYS  87  -4.919  18.900  -3.993
  700    H    LYS  88           H        LYS  88  -1.424  16.097   2.076
  701    HA   LYS  88           HA       LYS  88  -0.186  13.552   2.676
  702   1HB   LYS  88          2HB       LYS  88   0.257  15.757   3.861
  703   2HB   LYS  88          1HB       LYS  88  -1.293  15.538   4.673
  704   1HG   LYS  88          2HG       LYS  88  -0.457  13.264   5.429
  705   2HG   LYS  88          1HG       LYS  88   1.132  13.732   4.823
  706   1HD   LYS  88          2HD       LYS  88   0.992  15.785   6.289
  707   2HD   LYS  88          1HD       LYS  88  -0.468  15.097   7.002
  708   1HE   LYS  88          2HE       LYS  88   1.731  14.633   8.239
  709   2HE   LYS  88          1HE       LYS  88   0.716  13.233   7.889
  710   1HZ   LYS  88          1HZ       LYS  88   3.148  13.011   7.343
  711   2HZ   LYS  88          2HZ       LYS  88   2.887  14.118   6.081
  712   3HZ   LYS  88          3HZ       LYS  88   2.073  12.627   6.090
  713    H    GLU  89           H        GLU  89  -3.276  15.005   3.775
  714    HA   GLU  89           HA       GLU  89  -4.257  12.771   5.169
  715   1HB   GLU  89          2HB       GLU  89  -6.555  13.694   4.530
  716   2HB   GLU  89          1HB       GLU  89  -5.468  14.819   5.346
  717   1HG   GLU  89          2HG       GLU  89  -4.837  15.089   2.634
  718   2HG   GLU  89          1HG       GLU  89  -6.597  14.969   2.667
  719    H    GLU  90           H        GLU  90  -4.521  13.515   1.692
  720    HA   GLU  90           HA       GLU  90  -6.200  11.329   0.996
  721   1HB   GLU  90          2HB       GLU  90  -5.239  13.368  -0.415
  722   2HB   GLU  90          1HB       GLU  90  -4.025  12.175  -0.876
  723   1HG   GLU  90          2HG       GLU  90  -5.487  11.046  -2.184
  724   2HG   GLU  90          1HG       GLU  90  -6.749  11.101  -0.952
  725    H    ARG  91           H        ARG  91  -2.668  11.534   1.347
  726    HA   ARG  91           HA       ARG  91  -2.046   8.948   0.333
  727   1HB   ARG  91          2HB       ARG  91  -0.638  10.357   2.619
  728   2HB   ARG  91          1HB       ARG  91   0.047   9.154   1.527
  729   1HG   ARG  91          2HG       ARG  91  -1.147  11.443   0.129
  730   2HG   ARG  91          1HG       ARG  91   0.207  11.886   1.169
  731   1HD   ARG  91          2HD       ARG  91   1.166   9.615  -0.024
  732   2HD   ARG  91          1HD       ARG  91   0.188  10.304  -1.320
  733    HE   ARG  91           HE       ARG  91   1.566  12.354  -1.154
  734   1HH1  ARG  91          1HH2      ARG  91   3.041   9.415  -0.918
  735   2HH1  ARG  91          2HH2      ARG  91   4.490   9.973  -0.150
  736   1HH2  ARG  91          1HH1      ARG  91   3.250  13.151   0.475
  737   2HH2  ARG  91          2HH1      ARG  91   4.608  12.089   0.639
  738    H    ALA  92           H        ALA  92  -2.684   9.991   3.695
  739    HA   ALA  92           HA       ALA  92  -2.499   7.439   4.905
  740   1HB   ALA  92          1HB       ALA  92  -2.692   9.575   6.166
  741   2HB   ALA  92          2HB       ALA  92  -3.873   8.383   6.708
  742   3HB   ALA  92          3HB       ALA  92  -4.374   9.706   5.654
  743    H    ASP  93           H        ASP  93  -5.247   9.025   3.300
  744    HA   ASP  93           HA       ASP  93  -7.158   6.982   3.927
  745   1HB   ASP  93          2HB       ASP  93  -7.204   9.457   2.634
  746   2HB   ASP  93          1HB       ASP  93  -7.636   8.299   1.375
  747    H    LEU  94           H        LEU  94  -4.727   7.325   1.421
  748    HA   LEU  94           HA       LEU  94  -5.731   5.333  -0.377
  749   1HB   LEU  94          2HB       LEU  94  -3.015   6.522   0.150
  750   2HB   LEU  94          1HB       LEU  94  -3.184   5.157  -0.956
  751    HG   LEU  94           HG       LEU  94  -4.736   7.754  -1.170
  752   1HD1  LEU  94          1HD1      LEU  94  -3.149   8.551  -2.605
  753   2HD1  LEU  94          2HD1      LEU  94  -2.795   6.951  -3.259
  754   3HD1  LEU  94          3HD1      LEU  94  -2.087   7.453  -1.723
  755   1HD2  LEU  94          1HD2      LEU  94  -6.086   6.243  -2.278
  756   2HD2  LEU  94          2HD2      LEU  94  -4.752   5.139  -2.613
  757   3HD2  LEU  94          3HD2      LEU  94  -4.952   6.601  -3.581
  758    H    ILE  95           H        ILE  95  -3.384   5.134   2.303
  759    HA   ILE  95           HA       ILE  95  -3.034   2.271   2.059
  760    HB   ILE  95           HB       ILE  95  -2.606   3.813   4.614
  761   1HG1  ILE  95          2HG1      ILE  95  -1.660   5.317   3.034
  762   2HG1  ILE  95          1HG1      ILE  95  -0.300   4.341   3.589
  763   1HG2  ILE  95          1HG2      ILE  95  -0.978   2.195   5.042
  764   2HG2  ILE  95          2HG2      ILE  95  -0.729   1.848   3.332
  765   3HG2  ILE  95          3HG2      ILE  95  -2.173   1.255   4.150
  766   1HD1  ILE  95          1HD1      ILE  95   0.014   4.200   1.298
  767   2HD1  ILE  95          2HD1      ILE  95  -1.712   4.301   0.950
  768   3HD1  ILE  95          3HD1      ILE  95  -1.021   2.794   1.553
  769    H    ALA  96           H        ALA  96  -5.238   4.369   3.790
  770    HA   ALA  96           HA       ALA  96  -6.276   2.554   5.691
  771   1HB   ALA  96          1HB       ALA  96  -7.409   4.448   6.139
  772   2HB   ALA  96          2HB       ALA  96  -8.465   4.063   4.780
  773   3HB   ALA  96          3HB       ALA  96  -7.055   5.096   4.538
  774    H    TYR  97           H        TYR  97  -7.363   3.140   2.329
  775    HA   TYR  97           HA       TYR  97  -9.387   1.098   2.412
  776   1HB   TYR  97          2HB       TYR  97  -9.656   2.754   0.729
  777   2HB   TYR  97          1HB       TYR  97  -7.993   2.572   0.175
  778    HD1  TYR  97           HD1      TYR  97  -7.800   1.533  -1.891
  779    HD2  TYR  97           HD2      TYR  97 -10.892   0.258   0.798
  780    HE1  TYR  97           HE1      TYR  97  -8.527  -0.173  -3.538
  781    HE2  TYR  97           HE2      TYR  97 -11.621  -1.449  -0.847
  782    HH   TYR  97           HH       TYR  97 -10.187  -1.617  -4.076
  783    H    LEU  98           H        LEU  98  -5.975   1.171   1.559
  784    HA   LEU  98           HA       LEU  98  -5.997  -1.534   0.481
  785   1HB   LEU  98          2HB       LEU  98  -4.112   0.661   0.709
  786   2HB   LEU  98          1HB       LEU  98  -3.360  -0.854   1.204
  787    HG   LEU  98           HG       LEU  98  -3.017  -0.694  -1.157
  788   1HD1  LEU  98          1HD1      LEU  98  -5.443  -2.375  -1.331
  789   2HD1  LEU  98          2HD1      LEU  98  -4.339  -2.795  -0.021
  790   3HD1  LEU  98          3HD1      LEU  98  -3.763  -2.780  -1.689
  791   1HD2  LEU  98          1HD2      LEU  98  -5.772  -0.595  -2.074
  792   2HD2  LEU  98          2HD2      LEU  98  -4.417   0.442  -2.516
  793   3HD2  LEU  98          3HD2      LEU  98  -5.386   0.817  -1.092
  794    H    LYS  99           H        LYS  99  -6.098  -0.245   3.590
  795    HA   LYS  99           HA       LYS  99  -4.721  -2.569   4.786
  796   1HB   LYS  99          2HB       LYS  99  -4.746   0.103   5.496
  797   2HB   LYS  99          1HB       LYS  99  -5.886  -0.619   6.632
  798   1HG   LYS  99          2HG       LYS  99  -3.330  -2.078   6.156
  799   2HG   LYS  99          1HG       LYS  99  -3.249  -0.595   7.107
  800   1HD   LYS  99          2HD       LYS  99  -5.502  -2.287   7.882
  801   2HD   LYS  99          1HD       LYS  99  -3.951  -3.106   8.073
  802   1HE   LYS  99          2HE       LYS  99  -3.546  -0.478   9.011
  803   2HE   LYS  99          1HE       LYS  99  -5.093  -0.993   9.683
  804   1HZ   LYS  99          1HZ       LYS  99  -2.689  -2.715   9.771
  805   2HZ   LYS  99          2HZ       LYS  99  -4.117  -2.851  10.681
  806   3HZ   LYS  99          3HZ       LYS  99  -3.028  -1.585  10.989
  807    H    LYS 100           H        LYS 100  -7.849  -1.393   4.045
  808    HA   LYS 100           HA       LYS 100  -9.086  -3.289   5.999
  809   1HB   LYS 100          2HB       LYS 100  -9.855  -0.663   4.923
  810   2HB   LYS 100          1HB       LYS 100 -11.158  -1.851   4.882
  811   1HG   LYS 100          2HG       LYS 100 -10.711  -2.356   7.289
  812   2HG   LYS 100          1HG       LYS 100  -9.520  -1.055   7.303
  813   1HD   LYS 100          2HD       LYS 100 -11.632  -0.188   8.148
  814   2HD   LYS 100          1HD       LYS 100 -11.315   0.528   6.568
  815   1HE   LYS 100          2HE       LYS 100 -13.163  -0.411   5.674
  816   2HE   LYS 100          1HE       LYS 100 -12.752  -1.995   6.333
  817   1HZ   LYS 100          1HZ       LYS 100 -14.214  -1.722   7.957
  818   2HZ   LYS 100          2HZ       LYS 100 -14.748  -0.300   7.196
  819   3HZ   LYS 100          3HZ       LYS 100 -13.550  -0.225   8.398
  820    H    ALA 101           H        ALA 101  -8.525  -2.677   2.652
  821    HA   ALA 101           HA       ALA 101 -10.643  -4.515   1.784
  822   1HB   ALA 101          1HB       ALA 101  -8.569  -3.440  -0.084
  823   2HB   ALA 101          2HB       ALA 101  -9.760  -2.324   0.582
  824   3HB   ALA 101          3HB       ALA 101 -10.288  -3.717  -0.363
  825    H    THR 102           H        THR 102  -7.080  -4.360   1.796
  826    HA   THR 102           HA       THR 102  -7.036  -7.232   0.992
  827    HB   THR 102           HB       THR 102  -4.431  -6.528   0.966
  828    HG1  THR 102           HG1      THR 102  -5.644  -4.181   0.047
  829   1HG2  THR 102          1HG2      THR 102  -4.635  -6.373  -1.388
  830   2HG2  THR 102          2HG2      THR 102  -6.249  -5.668  -1.282
  831   3HG2  THR 102          3HG2      THR 102  -6.002  -7.371  -0.892
  832    H    ASN 103           H        ASN 103  -5.237  -5.079   3.227
  833    HA   ASN 103           HA       ASN 103  -4.109  -7.091   4.830
  834   1HB   ASN 103          2HB       ASN 103  -3.430  -4.793   5.125
  835   2HB   ASN 103          1HB       ASN 103  -5.065  -4.319   5.585
  836   1HD2  ASN 103          1HD2      ASN 103  -5.830  -4.938   7.733
  837   2HD2  ASN 103          2HD2      ASN 103  -4.756  -5.480   8.930
  838    H    GLU 104           HN       GLU 104  -7.402  -5.914   4.743
  839    HA   GLU 104           HA       GLU 104  -8.135  -7.137   7.298
  840   1HB   GLU 104          2HB       GLU 104  -9.302  -5.133   6.255
  841   2HB   GLU 104          1HB       GLU 104  -9.993  -6.251   5.078
  842   1HG   GLU 104          2HG       GLU 104 -11.642  -6.132   6.761
  843   2HG   GLU 104          1HG       GLU 104 -10.770  -7.619   7.135
  844    HHA  HEC 105           HHA      HEC 105   4.295  -2.936  -9.037
  845    HHB  HEC 105           HHB      HEC 105   1.304   0.622  -4.770
  846    HHC  HEC 105           HHC      HEC 105  -1.767   3.633  -9.412
  847    HHD  HEC 105           HHD      HEC 105   1.122  -0.030 -13.673
  848   1HMA  HEC 105          1HMA      HEC 105   2.179  -1.220  -3.761
  849   2HMA  HEC 105          2HMA      HEC 105   3.808  -0.558  -3.892
  850   3HMA  HEC 105          3HMA      HEC 105   3.557  -2.302  -3.962
  851   1HAA  HEC 105          1HAA      HEC 105   4.715  -3.241  -5.323
  852   2HAA  HEC 105          2HAA      HEC 105   5.596  -2.745  -6.754
  853   1HBA  HEC 105          1HBA      HEC 105   3.347  -4.265  -7.610
  854   2HBA  HEC 105          2HBA      HEC 105   4.137  -5.161  -6.314
  855   1HMB  HEC 105          1HMB      HEC 105  -1.401   1.966  -4.086
  856   2HMB  HEC 105          2HMB      HEC 105  -0.780   3.609  -4.230
  857   3HMB  HEC 105          3HMB      HEC 105   0.328   2.274  -3.921
  858    HAB  HEC 105           HAB      HEC 105  -2.165   4.663  -7.660
  859   1HBB  HEC 105          1HBB      HEC 105  -2.058   4.940  -4.746
  860   2HBB  HEC 105          2HBB      HEC 105  -1.997   6.153  -6.023
  861   3HBB  HEC 105          3HBB      HEC 105  -0.557   5.214  -5.630
  862   1HMC  HEC 105          1HMC      HEC 105  -2.694   3.940 -11.223
  863   2HMC  HEC 105          2HMC      HEC 105  -1.663   4.595 -12.496
  864   3HMC  HEC 105          3HMC      HEC 105  -2.848   3.345 -12.876
  865    HAC  HEC 105           HAC      HEC 105   0.177   1.615 -14.720
  866   1HBC  HEC 105          1HBC      HEC 105  -2.297   3.201 -14.800
  867   2HBC  HEC 105          2HBC      HEC 105  -0.835   3.297 -15.781
  868   3HBC  HEC 105          3HBC      HEC 105  -0.851   3.978 -14.154
  869   1HMD  HEC 105          1HMD      HEC 105   3.466  -2.926 -14.187
  870   2HMD  HEC 105          2HMD      HEC 105   2.051  -1.916 -14.480
  871   3HMD  HEC 105          3HMD      HEC 105   3.656  -1.190 -14.426
  872   1HAD  HEC 105          1HAD      HEC 105   5.442  -3.093 -12.139
  873   2HAD  HEC 105          2HAD      HEC 105   4.740  -3.894 -10.741
  874   1HBD  HEC 105          1HBD      HEC 105   3.046  -4.290 -13.013
  875   2HBD  HEC 105          2HBD      HEC 105   3.898  -5.497 -12.055
  Start of MODEL   11
    1   1H    GLY   1          1HT       GLY   1 -10.568   7.824  10.286
    2   2H    GLY   1          2HT       GLY   1  -9.107   7.295   9.601
    3   3H    GLY   1          3HT       GLY   1 -10.460   6.267   9.626
    4   1HA   GLY   1          1HA       GLY   1 -10.569   8.865   8.232
    5   2HA   GLY   1          2HA       GLY   1  -9.890   7.440   7.441
    6    H    ASP   2           H        ASP   2 -11.429   6.611   6.108
    7    HA   ASP   2           HA       ASP   2 -14.025   5.836   7.254
    8   1HB   ASP   2          2HB       ASP   2 -13.698   8.167   5.516
    9   2HB   ASP   2          1HB       ASP   2 -14.833   6.988   4.856
   10    H    VAL   3           H        VAL   3 -14.992   4.137   6.059
   11    HA   VAL   3           HA       VAL   3 -13.165   2.616   4.393
   12    HB   VAL   3           HB       VAL   3 -16.102   2.229   5.043
   13   1HG1  VAL   3          1HG1      VAL   3 -15.402   1.162   2.887
   14   2HG1  VAL   3          2HG1      VAL   3 -15.856  -0.010   4.125
   15   3HG1  VAL   3          3HG1      VAL   3 -14.153   0.285   3.770
   16   1HG2  VAL   3          1HG2      VAL   3 -15.406   0.880   6.794
   17   2HG2  VAL   3          2HG2      VAL   3 -14.089   2.053   6.782
   18   3HG2  VAL   3          3HG2      VAL   3 -13.876   0.478   6.014
   19    H    GLU   4           H        GLU   4 -16.304   4.211   3.748
   20    HA   GLU   4           HA       GLU   4 -16.289   3.693   0.935
   21   1HB   GLU   4          2HB       GLU   4 -17.858   5.281   2.821
   22   2HB   GLU   4          1HB       GLU   4 -17.693   6.074   1.253
   23   1HG   GLU   4          2HG       GLU   4 -18.473   3.163   1.505
   24   2HG   GLU   4          1HG       GLU   4 -19.668   4.461   1.504
   25    H    LYS   5           H        LYS   5 -14.442   5.878   2.829
   26    HA   LYS   5           HA       LYS   5 -14.013   7.813   0.671
   27   1HB   LYS   5          2HB       LYS   5 -13.676   7.865   3.428
   28   2HB   LYS   5          1HB       LYS   5 -12.023   7.811   2.816
   29   1HG   LYS   5          2HG       LYS   5 -12.459   9.733   1.369
   30   2HG   LYS   5          1HG       LYS   5 -14.146   9.761   1.878
   31   1HD   LYS   5          2HD       LYS   5 -13.156   9.958   4.290
   32   2HD   LYS   5          1HD       LYS   5 -11.687  10.473   3.460
   33   1HE   LYS   5          2HE       LYS   5 -14.369  11.723   2.856
   34   2HE   LYS   5          1HE       LYS   5 -13.339  12.322   4.156
   35   1HZ   LYS   5          1HZ       LYS   5 -13.163  12.937   1.472
   36   2HZ   LYS   5          2HZ       LYS   5 -11.832  11.928   1.790
   37   3HZ   LYS   5          3HZ       LYS   5 -12.059  13.351   2.691
   38    H    GLY   6           H        GLY   6 -11.584   5.928   2.492
   39   1HA   GLY   6          1HA       GLY   6  -9.579   6.033   0.522
   40   2HA   GLY   6          2HA       GLY   6  -9.701   4.754   1.732
   41    H    LYS   7           H        LYS   7 -12.401   3.957   0.710
   42    HA   LYS   7           HA       LYS   7 -11.530   1.966  -1.164
   43   1HB   LYS   7          2HB       LYS   7 -13.529   1.773   0.362
   44   2HB   LYS   7          1HB       LYS   7 -14.372   2.905  -0.696
   45   1HG   LYS   7          2HG       LYS   7 -14.381   1.403  -2.507
   46   2HG   LYS   7          1HG       LYS   7 -13.079   0.429  -1.823
   47   1HD   LYS   7          2HD       LYS   7 -14.760  -0.011   0.125
   48   2HD   LYS   7          1HD       LYS   7 -15.981   0.516  -1.034
   49   1HE   LYS   7          2HE       LYS   7 -14.820  -1.174  -2.652
   50   2HE   LYS   7          1HE       LYS   7 -14.156  -1.871  -1.174
   51   1HZ   LYS   7          1HZ       LYS   7 -16.160  -2.996  -1.586
   52   2HZ   LYS   7          2HZ       LYS   7 -17.003  -1.559  -1.922
   53   3HZ   LYS   7          3HZ       LYS   7 -16.509  -1.906  -0.333
   54    H    LYS   8           H        LYS   8 -13.158   5.094  -1.574
   55    HA   LYS   8           HA       LYS   8 -13.554   4.732  -4.430
   56   1HB   LYS   8          2HB       LYS   8 -14.815   6.324  -2.807
   57   2HB   LYS   8          1HB       LYS   8 -13.441   7.406  -3.044
   58   1HG   LYS   8          2HG       LYS   8 -13.832   7.042  -5.571
   59   2HG   LYS   8          1HG       LYS   8 -15.405   6.396  -5.103
   60   1HD   LYS   8          2HD       LYS   8 -14.991   8.825  -3.657
   61   2HD   LYS   8          1HD       LYS   8 -14.632   9.136  -5.356
   62   1HE   LYS   8          2HE       LYS   8 -17.087   9.399  -4.598
   63   2HE   LYS   8          1HE       LYS   8 -16.787   8.452  -6.055
   64   1HZ   LYS   8          1HZ       LYS   8 -17.287   6.512  -5.018
   65   2HZ   LYS   8          2HZ       LYS   8 -18.278   7.549  -4.106
   66   3HZ   LYS   8          3HZ       LYS   8 -16.776   7.048  -3.492
   67    H    ILE   9           H        ILE   9 -10.973   5.911  -2.399
   68    HA   ILE   9           HA       ILE   9  -9.559   7.443  -4.364
   69    HB   ILE   9           HB       ILE   9  -8.359   5.856  -2.077
   70   1HG1  ILE   9          2HG1      ILE   9 -10.175   7.214  -1.201
   71   2HG1  ILE   9          1HG1      ILE   9  -8.650   8.008  -0.802
   72   1HG2  ILE   9          1HG2      ILE   9  -6.913   6.980  -3.917
   73   2HG2  ILE   9          2HG2      ILE   9  -6.526   7.334  -2.231
   74   3HG2  ILE   9          3HG2      ILE   9  -7.436   8.501  -3.192
   75   1HD1  ILE   9          1HD1      ILE   9  -9.175   9.094  -3.254
   76   2HD1  ILE   9          2HD1      ILE   9  -9.632   9.843  -1.725
   77   3HD1  ILE   9          3HD1      ILE   9 -10.808   8.883  -2.620
   78    H    PHE  10           H        PHE  10  -8.847   4.119  -3.203
   79    HA   PHE  10           HA       PHE  10  -7.010   3.511  -5.303
   80   1HB   PHE  10          2HB       PHE  10  -7.391   2.220  -3.121
   81   2HB   PHE  10          1HB       PHE  10  -8.786   1.489  -3.915
   82    HD1  PHE  10           HD1      PHE  10  -5.100   1.800  -3.953
   83    HD2  PHE  10           HD2      PHE  10  -8.518  -0.113  -5.721
   84    HE1  PHE  10           HE1      PHE  10  -3.610   0.166  -5.076
   85    HE2  PHE  10           HE2      PHE  10  -7.014  -1.743  -6.842
   86    HZ   PHE  10           HZ       PHE  10  -4.582  -1.606  -6.521
   87    H    ILE  11           H        ILE  11 -10.523   3.112  -5.033
   88    HA   ILE  11           HA       ILE  11 -10.884   1.628  -7.455
   89    HB   ILE  11           HB       ILE  11 -12.717   3.475  -5.910
   90   1HG1  ILE  11          2HG1      ILE  11 -12.633   0.459  -6.267
   91   2HG1  ILE  11          1HG1      ILE  11 -12.075   1.331  -4.838
   92   1HG2  ILE  11          1HG2      ILE  11 -14.526   2.369  -7.327
   93   2HG2  ILE  11          2HG2      ILE  11 -13.233   1.830  -8.400
   94   3HG2  ILE  11          3HG2      ILE  11 -13.525   3.554  -8.165
   95   1HD1  ILE  11          1HD1      ILE  11 -14.428   2.332  -4.707
   96   2HD1  ILE  11          2HD1      ILE  11 -14.293   0.617  -4.319
   97   3HD1  ILE  11          3HD1      ILE  11 -14.899   1.119  -5.897
   98    H    MET  12           H        MET  12 -10.220   4.990  -6.847
   99    HA   MET  12           HA       MET  12 -10.651   5.529  -9.761
  100   1HB   MET  12          2HB       MET  12 -12.110   6.729  -7.898
  101   2HB   MET  12          1HB       MET  12 -10.683   7.755  -7.762
  102   1HG   MET  12          2HG       MET  12 -11.958   8.848  -9.407
  103   2HG   MET  12          1HG       MET  12 -10.817   7.896 -10.357
  104   1HE   MET  12          1HE       MET  12 -15.083   8.199 -10.693
  105   2HE   MET  12          2HE       MET  12 -13.919   9.074  -9.702
  106   3HE   MET  12          3HE       MET  12 -14.798   7.710  -9.017
  107    H    LYS  13           H        LYS  13  -8.223   4.767  -7.912
  108    HA   LYS  13           HA       LYS  13  -6.439   6.891  -9.035
  109   1HB   LYS  13          2HB       LYS  13  -6.834   6.806  -6.430
  110   2HB   LYS  13          1HB       LYS  13  -5.715   5.445  -6.505
  111   1HG   LYS  13          2HG       LYS  13  -4.330   7.341  -6.148
  112   2HG   LYS  13          1HG       LYS  13  -4.184   6.995  -7.872
  113   1HD   LYS  13          2HD       LYS  13  -4.606   9.274  -7.946
  114   2HD   LYS  13          1HD       LYS  13  -6.252   8.647  -8.041
  115   1HE   LYS  13          2HE       LYS  13  -6.479   8.892  -5.589
  116   2HE   LYS  13          1HE       LYS  13  -4.844   9.549  -5.510
  117   1HZ   LYS  13          1HZ       LYS  13  -7.220  10.903  -6.071
  118   2HZ   LYS  13          2HZ       LYS  13  -6.273  10.936  -7.480
  119   3HZ   LYS  13          3HZ       LYS  13  -5.647  11.530  -6.017
  120    H    CYS  14           H        CYS  14  -6.516   3.547  -7.762
  121    HA   CYS  14           HA       CYS  14  -4.602   2.829  -9.939
  122   1HB   CYS  14          2HB       CYS  14  -4.255   1.098  -7.641
  123   2HB   CYS  14          1HB       CYS  14  -3.047   2.062  -8.481
  124    H    SER  15           H        SER  15  -7.550   2.604  -9.649
  125    HA   SER  15           HA       SER  15  -8.033  -0.275  -9.265
  126   1HB   SER  15          2HB       SER  15  -9.603   1.821  -8.773
  127   2HB   SER  15          1HB       SER  15 -10.071   1.563 -10.449
  128    HG   SER  15           HG       SER  15 -11.253  -0.002  -9.716
  129    H    GLN  16           H        GLN  16  -6.845   1.609 -11.747
  130    HA   GLN  16           HA       GLN  16  -8.149   0.050 -13.906
  131   1HB   GLN  16          2HB       GLN  16  -6.383   2.492 -13.823
  132   2HB   GLN  16          1HB       GLN  16  -6.583   1.586 -15.324
  133   1HG   GLN  16          2HG       GLN  16  -8.996   2.414 -13.728
  134   2HG   GLN  16          1HG       GLN  16  -8.220   3.561 -14.820
  135   1HE2  GLN  16          1HE2      GLN  16  -9.559   3.591 -16.653
  136   2HE2  GLN  16          2HE2      GLN  16 -10.067   2.206 -17.493
  137    H    CYS  17           H        CYS  17  -4.928   0.701 -12.537
  138    HA   CYS  17           HA       CYS  17  -3.775  -1.439 -14.218
  139   1HB   CYS  17          2HB       CYS  17  -2.656   0.702 -12.429
  140   2HB   CYS  17          1HB       CYS  17  -1.666  -0.711 -12.800
  141    H    HIS  18           H        HIS  18  -4.310  -0.704 -10.759
  142    HA   HIS  18           HA       HIS  18  -3.623  -3.539 -10.115
  143   1HB   HIS  18          2HB       HIS  18  -4.135  -1.189  -8.273
  144   2HB   HIS  18          1HB       HIS  18  -3.665  -2.807  -7.759
  145    HD1  HIS  18           HD1      HIS  18  -1.209  -3.348  -7.782
  146    HD2  HIS  18           HD2      HIS  18  -2.086   0.172  -9.806
  147    HE1  HIS  18           HE1      HIS  18   1.013  -2.249  -8.296
  148    H    THR  19           H        THR  19  -5.719  -4.301 -11.042
  149    HA   THR  19           HA       THR  19  -8.164  -3.360  -9.745
  150    HB   THR  19           HB       THR  19  -9.168  -5.373 -10.990
  151    HG1  THR  19           HG1      THR  19  -7.440  -5.823 -12.766
  152   1HG2  THR  19          1HG2      THR  19  -8.773  -4.269 -13.251
  153   2HG2  THR  19          2HG2      THR  19  -7.667  -3.173 -12.422
  154   3HG2  THR  19          3HG2      THR  19  -9.373  -3.205 -11.979
  155    H    VAL  20           H        VAL  20  -7.969  -3.801  -7.536
  156    HA   VAL  20           HA       VAL  20  -7.140  -6.450  -6.610
  157    HB   VAL  20           HB       VAL  20  -7.317  -5.551  -4.414
  158   1HG1  VAL  20          1HG1      VAL  20  -5.455  -4.471  -5.287
  159   2HG1  VAL  20          2HG1      VAL  20  -6.440  -3.090  -4.804
  160   3HG1  VAL  20          3HG1      VAL  20  -6.401  -3.596  -6.493
  161   1HG2  VAL  20          1HG2      VAL  20  -9.189  -4.408  -3.890
  162   2HG2  VAL  20          2HG2      VAL  20  -9.531  -4.100  -5.593
  163   3HG2  VAL  20          3HG2      VAL  20  -8.483  -3.003  -4.691
  164    H    GLU  21           H        GLU  21  -9.808  -5.729  -8.178
  165    HA   GLU  21           HA       GLU  21 -11.497  -7.473  -6.443
  166   1HB   GLU  21          2HB       GLU  21 -12.175  -4.818  -7.675
  167   2HB   GLU  21          1HB       GLU  21 -13.443  -6.022  -7.445
  168   1HG   GLU  21          2HG       GLU  21 -11.972  -5.997  -5.039
  169   2HG   GLU  21          1HG       GLU  21 -12.199  -4.304  -5.480
  170    H    LYS  22           H        LYS  22  -9.850  -7.639  -9.106
  171    HA   LYS  22           HA       LYS  22 -12.009  -8.381 -10.983
  172   1HB   LYS  22          2HB       LYS  22  -9.756  -7.211 -11.589
  173   2HB   LYS  22          1HB       LYS  22  -9.076  -8.836 -11.484
  174   1HG   LYS  22          2HG       LYS  22  -9.711  -8.947 -13.679
  175   2HG   LYS  22          1HG       LYS  22 -11.280  -9.344 -12.981
  176   1HD   LYS  22          2HD       LYS  22 -12.167  -7.475 -13.856
  177   2HD   LYS  22          1HD       LYS  22 -10.980  -6.492 -12.997
  178   1HE   LYS  22          2HE       LYS  22  -9.840  -6.103 -14.898
  179   2HE   LYS  22          1HE       LYS  22  -9.734  -7.831 -15.237
  180   1HZ   LYS  22          1HZ       LYS  22 -11.531  -5.863 -16.308
  181   2HZ   LYS  22          2HZ       LYS  22 -12.324  -7.261 -15.758
  182   3HZ   LYS  22          3HZ       LYS  22 -11.095  -7.381 -16.924
  183    H    GLY  23           H        GLY  23  -9.814  -9.896  -8.744
  184   1HA   GLY  23          2HA       GLY  23 -10.390 -12.158  -7.949
  185   2HA   GLY  23          1HA       GLY  23 -10.906 -12.543  -9.592
  186    H    GLY  24           H        GLY  24  -7.945 -11.259  -8.023
  187   1HA   GLY  24          1HA       GLY  24  -5.711 -11.947  -8.248
  188   2HA   GLY  24          2HA       GLY  24  -6.328 -13.493  -8.831
  189    H    LYS  25           H        LYS  25  -7.608 -10.928 -10.621
  190    HA   LYS  25           HA       LYS  25  -5.847 -11.629 -12.892
  191   1HB   LYS  25          2HB       LYS  25  -8.432 -11.440 -12.992
  192   2HB   LYS  25          1HB       LYS  25  -8.158  -9.698 -12.998
  193   1HG   LYS  25          2HG       LYS  25  -7.161  -9.718 -15.084
  194   2HG   LYS  25          1HG       LYS  25  -6.568 -11.369 -14.899
  195   1HD   LYS  25          2HD       LYS  25  -8.398 -12.215 -15.902
  196   2HD   LYS  25          1HD       LYS  25  -9.468 -11.307 -14.833
  197   1HE   LYS  25          2HE       LYS  25 -10.011 -10.036 -16.615
  198   2HE   LYS  25          1HE       LYS  25  -8.378  -9.377 -16.545
  199   1HZ   LYS  25          1HZ       LYS  25  -7.664 -11.290 -17.929
  200   2HZ   LYS  25          2HZ       LYS  25  -8.743 -10.239 -18.718
  201   3HZ   LYS  25          3HZ       LYS  25  -9.294 -11.727 -18.107
  202    H    HIS  26           H        HIS  26  -4.258 -10.288 -13.610
  203    HA   HIS  26           HA       HIS  26  -4.326  -7.435 -12.777
  204   1HB   HIS  26          2HB       HIS  26  -1.697  -7.847 -12.584
  205   2HB   HIS  26          1HB       HIS  26  -2.770  -8.087 -11.211
  206    HD1  HIS  26           HD1      HIS  26  -2.486 -10.494 -14.123
  207    HD2  HIS  26           HD2      HIS  26  -1.392 -10.284 -10.106
  208    HE1  HIS  26           HE1      HIS  26  -1.645 -12.794 -13.487
  209    H    LYS  27           H        LYS  27  -4.564  -6.520 -14.785
  210    HA   LYS  27           HA       LYS  27  -3.229  -7.637 -17.119
  211   1HB   LYS  27          2HB       LYS  27  -4.937  -5.180 -16.689
  212   2HB   LYS  27          1HB       LYS  27  -4.227  -5.592 -18.252
  213   1HG   LYS  27          2HG       LYS  27  -5.859  -7.091 -18.643
  214   2HG   LYS  27          1HG       LYS  27  -5.498  -7.923 -17.130
  215   1HD   LYS  27          2HD       LYS  27  -7.275  -6.999 -16.088
  216   2HD   LYS  27          1HD       LYS  27  -6.872  -5.388 -16.681
  217   1HE   LYS  27          2HE       LYS  27  -8.225  -7.520 -18.357
  218   2HE   LYS  27          1HE       LYS  27  -9.083  -6.229 -17.514
  219   1HZ   LYS  27          1HZ       LYS  27  -8.428  -4.711 -19.002
  220   2HZ   LYS  27          2HZ       LYS  27  -8.137  -6.043 -20.016
  221   3HZ   LYS  27          3HZ       LYS  27  -6.861  -5.347 -19.135
  222    H    THR  28           H        THR  28  -3.260  -4.182 -16.302
  223    HA   THR  28           HA       THR  28  -0.418  -4.042 -17.087
  224    HB   THR  28           HB       THR  28  -2.519  -1.954 -16.480
  225    HG1  THR  28           HG1      THR  28  -1.859  -1.444 -18.716
  226   1HG2  THR  28          1HG2      THR  28  -0.266  -1.250 -15.626
  227   2HG2  THR  28          2HG2      THR  28  -0.862  -0.244 -16.945
  228   3HG2  THR  28          3HG2      THR  28   0.370  -1.467 -17.257
  229    H    GLY  29           H        GLY  29  -2.396  -3.734 -14.183
  230   1HA   GLY  29          2HA       GLY  29   0.077  -3.056 -12.660
  231   2HA   GLY  29          1HA       GLY  29  -1.552  -2.730 -12.090
  232    HA   PRO  30           HA       PRO  30   0.133  -7.064 -10.835
  233   1HB   PRO  30          2HB       PRO  30   1.252  -6.417  -8.419
  234   2HB   PRO  30          1HB       PRO  30   2.165  -6.538  -9.927
  235   1HG   PRO  30          2HG       PRO  30   1.216  -4.079  -8.494
  236   2HG   PRO  30          1HG       PRO  30   2.702  -4.331  -9.430
  237   1HD   PRO  30          2HD       PRO  30   0.496  -2.998 -10.430
  238   2HD   PRO  30          1HD       PRO  30   1.684  -3.848 -11.437
  239    H    ASN  31           H        ASN  31  -1.446  -8.211  -9.929
  240    HA   ASN  31           HA       ASN  31  -3.802  -7.194  -8.842
  241   1HB   ASN  31          2HB       ASN  31  -3.313  -9.592  -9.545
  242   2HB   ASN  31          1HB       ASN  31  -2.587  -9.817  -7.953
  243   1HD2  ASN  31          1HD2      ASN  31  -5.552  -8.031  -8.978
  244   2HD2  ASN  31          2HD2      ASN  31  -6.592  -8.862  -7.925
  245    H    LEU  32           H        LEU  32  -3.652  -5.652  -7.237
  246    HA   LEU  32           HA       LEU  32  -1.932  -6.053  -4.915
  247   1HB   LEU  32          2HB       LEU  32  -3.469  -3.861  -6.092
  248   2HB   LEU  32          1HB       LEU  32  -3.623  -3.924  -4.338
  249    HG   LEU  32           HG       LEU  32  -1.337  -3.580  -3.989
  250   1HD1  LEU  32          1HD1      LEU  32   0.069  -3.730  -6.352
  251   2HD1  LEU  32          2HD1      LEU  32  -1.102  -5.035  -6.533
  252   3HD1  LEU  32          3HD1      LEU  32  -0.013  -5.014  -5.146
  253   1HD2  LEU  32          1HD2      LEU  32  -0.681  -1.934  -6.016
  254   2HD2  LEU  32          2HD2      LEU  32  -1.840  -1.477  -4.767
  255   3HD2  LEU  32          3HD2      LEU  32  -2.411  -2.078  -6.324
  256    H    HIS  33           H        HIS  33  -3.347  -8.206  -4.661
  257    HA   HIS  33           HA       HIS  33  -5.784  -7.621  -3.053
  258   1HB   HIS  33          2HB       HIS  33  -6.326  -9.968  -3.317
  259   2HB   HIS  33          1HB       HIS  33  -5.875  -9.338  -4.902
  260    HD1  HIS  33           HD1      HIS  33  -5.044 -11.967  -2.519
  261    HD2  HIS  33           HD2      HIS  33  -3.023  -9.947  -5.556
  262    HE1  HIS  33           HE1      HIS  33  -3.001 -13.358  -3.070
  263    H    GLY  34           H        GLY  34  -3.593  -6.827  -1.689
  264   1HA   GLY  34          2HA       GLY  34  -3.318  -7.393   0.752
  265   2HA   GLY  34          1HA       GLY  34  -3.088  -9.064   0.237
  266    H    LEU  35           H        LEU  35  -1.731  -5.836  -0.496
  267    HA   LEU  35           HA       LEU  35   0.831  -6.964  -1.249
  268   1HB   LEU  35          2HB       LEU  35   0.121  -4.947  -2.348
  269   2HB   LEU  35          1HB       LEU  35  -0.132  -4.132  -0.806
  270    HG   LEU  35           HG       LEU  35   2.543  -5.074  -0.798
  271   1HD1  LEU  35          1HD1      LEU  35   2.902  -3.331  -2.945
  272   2HD1  LEU  35          2HD1      LEU  35   1.585  -4.384  -3.463
  273   3HD1  LEU  35          3HD1      LEU  35   3.131  -5.079  -2.975
  274   1HD2  LEU  35          1HD2      LEU  35   2.050  -3.108   0.386
  275   2HD2  LEU  35          2HD2      LEU  35   1.140  -2.415  -0.958
  276   3HD2  LEU  35          3HD2      LEU  35   2.901  -2.487  -1.030
  277    H    PHE  36           H        PHE  36  -0.576  -5.682   1.685
  278    HA   PHE  36           HA       PHE  36   1.917  -5.144   3.037
  279   1HB   PHE  36          2HB       PHE  36  -0.750  -5.805   4.302
  280   2HB   PHE  36          1HB       PHE  36   0.579  -4.904   5.026
  281    HD1  PHE  36           HD1      PHE  36  -2.243  -3.849   4.779
  282    HD2  PHE  36           HD2      PHE  36   1.144  -3.559   2.154
  283    HE1  PHE  36           HE1      PHE  36  -3.154  -1.747   3.835
  284    HE2  PHE  36           HE2      PHE  36   0.231  -1.458   1.209
  285    HZ   PHE  36           HZ       PHE  36  -1.918  -0.549   2.050
  286    H    GLY  37           H        GLY  37   3.314  -6.581   3.902
  287   1HA   GLY  37          2HA       GLY  37   3.875  -8.466   5.286
  288   2HA   GLY  37          1HA       GLY  37   2.279  -9.139   4.974
  289    H    ARG  38           H        ARG  38   3.216  -8.270   1.967
  290    HA   ARG  38           HA       ARG  38   4.639 -10.868   1.547
  291   1HB   ARG  38          2HB       ARG  38   3.499 -10.741  -0.764
  292   2HB   ARG  38          1HB       ARG  38   2.492 -11.185   0.613
  293   1HG   ARG  38          2HG       ARG  38   1.278  -9.271   0.490
  294   2HG   ARG  38          1HG       ARG  38   2.700  -8.285   0.150
  295   1HD   ARG  38          2HD       ARG  38   2.075 -10.092  -2.053
  296   2HD   ARG  38          1HD       ARG  38   0.736  -9.004  -1.693
  297    HE   ARG  38           HE       ARG  38   2.824  -7.265  -1.735
  298   1HH1  ARG  38          1HH1      ARG  38   1.478  -9.580  -3.877
  299   2HH1  ARG  38          2HH1      ARG  38   2.332  -9.001  -5.267
  300   1HH2  ARG  38          1HH2      ARG  38   4.123  -6.615  -3.503
  301   2HH2  ARG  38          2HH2      ARG  38   3.829  -7.321  -5.057
  302    H    LYS  39           H        LYS  39   6.507 -10.771   0.362
  303    HA   LYS  39           HA       LYS  39   7.634  -8.184  -0.301
  304   1HB   LYS  39          2HB       LYS  39   9.560  -9.408  -1.045
  305   2HB   LYS  39          1HB       LYS  39   8.935 -10.286   0.350
  306   1HG   LYS  39          2HG       LYS  39   7.696 -11.796  -1.210
  307   2HG   LYS  39          1HG       LYS  39   8.458 -10.966  -2.566
  308   1HD   LYS  39          2HD       LYS  39  10.098 -12.519  -2.353
  309   2HD   LYS  39          1HD       LYS  39  10.622 -11.562  -0.967
  310   1HE   LYS  39          2HE       LYS  39  10.406 -13.660   0.011
  311   2HE   LYS  39          1HE       LYS  39   8.804 -12.987   0.315
  312   1HZ   LYS  39          1HZ       LYS  39   8.000 -14.726  -0.774
  313   2HZ   LYS  39          2HZ       LYS  39   9.543 -15.221  -1.282
  314   3HZ   LYS  39          3HZ       LYS  39   8.667 -14.089  -2.197
  315    H    THR  40           H        THR  40   8.034  -7.368  -2.453
  316    HA   THR  40           HA       THR  40   5.917  -7.732  -4.319
  317    HB   THR  40           HB       THR  40   8.594  -6.799  -5.275
  318    HG1  THR  40           HG1      THR  40   7.664  -4.735  -4.178
  319   1HG2  THR  40          1HG2      THR  40   7.216  -6.068  -6.896
  320   2HG2  THR  40          2HG2      THR  40   6.540  -4.934  -5.725
  321   3HG2  THR  40          3HG2      THR  40   5.794  -6.515  -5.953
  322    H    GLY  41           H        GLY  41   6.174  -8.534  -6.588
  323   1HA   GLY  41          2HA       GLY  41   6.773 -10.160  -8.159
  324   2HA   GLY  41          1HA       GLY  41   8.292 -10.339  -7.290
  325    H    GLN  42           H        GLN  42   5.132 -11.676  -7.787
  326    HA   GLN  42           HA       GLN  42   5.944 -14.130  -6.437
  327   1HB   GLN  42          2HB       GLN  42   3.882 -14.138  -4.946
  328   2HB   GLN  42          1HB       GLN  42   5.165 -13.031  -4.461
  329   1HG   GLN  42          2HG       GLN  42   3.442 -11.685  -6.319
  330   2HG   GLN  42          1HG       GLN  42   2.456 -12.402  -5.043
  331   1HE2  GLN  42          1HE2      GLN  42   4.835  -9.926  -5.744
  332   2HE2  GLN  42          2HE2      GLN  42   4.877  -9.257  -4.185
  333    H    ALA  43           H        ALA  43   3.410 -12.279  -8.088
  334    HA   ALA  43           HA       ALA  43   1.821 -14.609  -8.750
  335   1HB   ALA  43          1HB       ALA  43   0.346 -13.079  -9.520
  336   2HB   ALA  43          2HB       ALA  43   1.548 -12.347 -10.582
  337   3HB   ALA  43          3HB       ALA  43   1.454 -11.860  -8.890
  338    HA   PRO  44           HA       PRO  44   4.434 -15.869 -12.142
  339   1HB   PRO  44          2HB       PRO  44   2.903 -18.042 -12.846
  340   2HB   PRO  44          1HB       PRO  44   4.029 -18.042 -11.476
  341   1HG   PRO  44          2HG       PRO  44   1.053 -17.925 -11.456
  342   2HG   PRO  44          1HG       PRO  44   2.160 -18.514 -10.206
  343   1HD   PRO  44          2HD       PRO  44   0.839 -16.000 -10.222
  344   2HD   PRO  44          1HD       PRO  44   2.157 -16.491  -9.135
  345    H    GLY  45           H        GLY  45   4.289 -15.725 -14.457
  346   1HA   GLY  45          2HA       GLY  45   3.198 -15.390 -16.553
  347   2HA   GLY  45          1HA       GLY  45   1.652 -15.305 -15.708
  348    H    TYR  46           H        TYR  46   3.249 -13.377 -13.814
  349    HA   TYR  46           HA       TYR  46   3.033 -10.960 -15.562
  350   1HB   TYR  46          2HB       TYR  46   1.101 -11.197 -13.981
  351   2HB   TYR  46          1HB       TYR  46   2.235 -11.201 -12.640
  352    HD1  TYR  46           HD1      TYR  46   3.939  -8.962 -14.492
  353    HD2  TYR  46           HD2      TYR  46   0.067  -9.266 -12.700
  354    HE1  TYR  46           HE1      TYR  46   3.819  -6.520 -14.372
  355    HE2  TYR  46           HE2      TYR  46  -0.023  -6.803 -12.574
  356    HH   TYR  46           HH       TYR  46   1.989  -4.777 -14.272
  357    H    SER  47           H        SER  47   5.104 -10.251 -15.770
  358    HA   SER  47           HA       SER  47   7.146 -10.777 -13.760
  359   1HB   SER  47          2HB       SER  47   8.375  -8.983 -15.250
  360   2HB   SER  47          1HB       SER  47   8.065 -10.586 -15.910
  361    HG   SER  47           HG       SER  47   6.561  -9.781 -17.190
  362    H    TYR  48           H        TYR  48   5.914  -9.807 -11.951
  363    HA   TYR  48           HA       TYR  48   4.975  -7.203 -11.680
  364   1HB   TYR  48          2HB       TYR  48   6.182  -9.222  -9.888
  365   2HB   TYR  48          1HB       TYR  48   6.188  -7.578  -9.276
  366    HD1  TYR  48           HD1      TYR  48   3.625  -9.079 -11.519
  367    HD2  TYR  48           HD2      TYR  48   4.613  -7.772  -7.564
  368    HE1  TYR  48           HE1      TYR  48   1.263  -9.364 -10.828
  369    HE2  TYR  48           HE2      TYR  48   2.245  -8.053  -6.867
  370    HH   TYR  48           HH       TYR  48   0.224  -8.741  -7.479
  371    H    THR  49           H        THR  49   6.298  -5.525 -10.168
  372    HA   THR  49           HA       THR  49   8.425  -4.475 -11.746
  373    HB   THR  49           HB       THR  49   8.900  -3.497  -9.194
  374    HG1  THR  49           HG1      THR  49   7.220  -4.479  -8.227
  375   1HG2  THR  49          1HG2      THR  49   7.483  -2.677 -11.630
  376   2HG2  THR  49          2HG2      THR  49   8.618  -1.771 -10.629
  377   3HG2  THR  49          3HG2      THR  49   6.916  -1.856 -10.175
  378    H    ALA  50           H        ALA  50   9.847  -6.258 -12.119
  379    HA   ALA  50           HA       ALA  50  11.009  -7.992 -10.299
  380   1HB   ALA  50          1HB       ALA  50  12.458  -6.596 -12.570
  381   2HB   ALA  50          2HB       ALA  50  11.449  -8.031 -12.745
  382   3HB   ALA  50          3HB       ALA  50  12.942  -8.110 -11.808
  383    H    ALA  51           H        ALA  51  11.960  -4.619 -10.937
  384    HA   ALA  51           HA       ALA  51  14.279  -4.552  -9.333
  385   1HB   ALA  51          1HB       ALA  51  12.183  -2.495 -10.003
  386   2HB   ALA  51          2HB       ALA  51  13.863  -2.576 -10.534
  387   3HB   ALA  51          3HB       ALA  51  13.485  -2.105  -8.879
  388    H    ASN  52           H        ASN  52  11.067  -3.371  -8.242
  389    HA   ASN  52           HA       ASN  52  11.407  -3.151  -5.555
  390   1HB   ASN  52          2HB       ASN  52   9.154  -4.109  -7.219
  391   2HB   ASN  52          1HB       ASN  52   9.047  -4.485  -5.499
  392   1HD2  ASN  52          1HD2      ASN  52   9.448  -2.522  -3.994
  393   2HD2  ASN  52          2HD2      ASN  52   8.872  -1.015  -4.518
  394    H    LYS  53           H        LYS  53  10.646  -6.333  -7.053
  395    HA   LYS  53           HA       LYS  53  10.819  -7.849  -4.683
  396   1HB   LYS  53          2HB       LYS  53   9.991  -8.883  -6.690
  397   2HB   LYS  53          1HB       LYS  53  11.511  -8.588  -7.536
  398   1HG   LYS  53          2HG       LYS  53  12.542 -10.373  -6.571
  399   2HG   LYS  53          1HG       LYS  53  11.775 -10.093  -5.007
  400   1HD   LYS  53          2HD       LYS  53   9.706 -11.103  -5.777
  401   2HD   LYS  53          1HD       LYS  53  10.343 -11.250  -7.415
  402   1HE   LYS  53          2HE       LYS  53  11.450 -12.639  -4.957
  403   2HE   LYS  53          1HE       LYS  53  10.501 -13.403  -6.232
  404   1HZ   LYS  53          1HZ       LYS  53  13.249 -12.364  -6.333
  405   2HZ   LYS  53          2HZ       LYS  53  12.323 -12.417  -7.756
  406   3HZ   LYS  53          3HZ       LYS  53  12.641 -13.845  -6.891
  407    H    ASN  54           H        ASN  54  13.430  -7.476  -7.105
  408    HA   ASN  54           HA       ASN  54  15.446  -8.683  -5.524
  409   1HB   ASN  54          2HB       ASN  54  15.737  -8.346  -7.916
  410   2HB   ASN  54          1HB       ASN  54  15.676  -6.596  -7.706
  411   1HD2  ASN  54          1HD2      ASN  54  17.884  -6.367  -8.546
  412   2HD2  ASN  54          2HD2      ASN  54  19.226  -6.825  -7.611
  413    H    LYS  55           H        LYS  55  13.921  -5.645  -5.089
  414    HA   LYS  55           HA       LYS  55  16.219  -4.317  -3.909
  415   1HB   LYS  55          2HB       LYS  55  13.992  -3.332  -4.970
  416   2HB   LYS  55          1HB       LYS  55  13.424  -3.463  -3.307
  417   1HG   LYS  55          2HG       LYS  55  16.116  -2.331  -3.482
  418   2HG   LYS  55          1HG       LYS  55  14.922  -1.365  -4.346
  419   1HD   LYS  55          2HD       LYS  55  13.666  -0.949  -2.421
  420   2HD   LYS  55          1HD       LYS  55  14.299  -2.366  -1.583
  421   1HE   LYS  55          2HE       LYS  55  16.276  -1.307  -0.993
  422   2HE   LYS  55          1HE       LYS  55  16.214  -0.202  -2.367
  423   1HZ   LYS  55          1HZ       LYS  55  14.312  -0.104  -0.093
  424   2HZ   LYS  55          2HZ       LYS  55  14.495   1.040  -1.336
  425   3HZ   LYS  55          3HZ       LYS  55  15.721   0.836  -0.176
  426    H    GLY  56           H        GLY  56  14.611  -6.939  -2.875
  427   1HA   GLY  56          1HA       GLY  56  14.096  -7.845  -0.758
  428   2HA   GLY  56          2HA       GLY  56  15.572  -7.011  -0.276
  429    H    ILE  57           H        ILE  57  12.425  -5.699  -1.330
  430    HA   ILE  57           HA       ILE  57  12.376  -4.124   1.208
  431    HB   ILE  57           HB       ILE  57  12.426  -2.912  -1.030
  432   1HG1  ILE  57          2HG1      ILE  57  11.570  -1.894   1.094
  433   2HG1  ILE  57          1HG1      ILE  57  10.780  -1.255  -0.348
  434   1HG2  ILE  57          1HG2      ILE  57  10.606  -4.739  -1.827
  435   2HG2  ILE  57          2HG2      ILE  57  10.743  -3.142  -2.561
  436   3HG2  ILE  57          3HG2      ILE  57   9.519  -3.443  -1.329
  437   1HD1  ILE  57          1HD1      ILE  57   9.045  -3.184   0.101
  438   2HD1  ILE  57          2HD1      ILE  57   8.944  -1.683   1.020
  439   3HD1  ILE  57          3HD1      ILE  57   9.685  -3.110   1.742
  440    H    ILE  58           H        ILE  58  11.020  -5.016   2.695
  441    HA   ILE  58           HA       ILE  58   8.831  -6.786   1.895
  442    HB   ILE  58           HB       ILE  58   9.846  -7.333   3.986
  443   1HG1  ILE  58          2HG1      ILE  58   8.014  -7.292   5.500
  444   2HG1  ILE  58          1HG1      ILE  58   7.422  -5.756   4.868
  445   1HG2  ILE  58          1HG2      ILE  58   9.957  -4.413   4.240
  446   2HG2  ILE  58          2HG2      ILE  58  11.008  -5.642   4.946
  447   3HG2  ILE  58          3HG2      ILE  58   9.489  -5.218   5.738
  448   1HD1  ILE  58          1HD1      ILE  58   7.613  -7.928   2.871
  449   2HD1  ILE  58          2HD1      ILE  58   6.332  -6.743   3.129
  450   3HD1  ILE  58          3HD1      ILE  58   6.415  -8.186   4.139
  451    H    TRP  59           H        TRP  59   7.107  -5.811   0.933
  452    HA   TRP  59           HA       TRP  59   6.379  -3.145   0.978
  453   1HB   TRP  59          2HB       TRP  59   4.809  -5.664   0.610
  454   2HB   TRP  59          1HB       TRP  59   3.946  -4.126   0.699
  455    HD1  TRP  59           HD1      TRP  59   4.955  -6.204  -1.890
  456    HE1  TRP  59           HE1      TRP  59   5.798  -4.948  -3.980
  457    HE3  TRP  59           HE3      TRP  59   5.816  -1.597   0.137
  458    HZ2  TRP  59           HZ2      TRP  59   6.722  -2.332  -4.690
  459    HZ3  TRP  59           HZ3      TRP  59   6.677   0.254  -1.263
  460    HH2  TRP  59           HH2      TRP  59   7.129  -0.108  -3.674
  461    H    GLY  60           H        GLY  60   6.052  -1.857   2.670
  462   1HA   GLY  60          1HA       GLY  60   4.287  -2.829   4.875
  463   2HA   GLY  60          2HA       GLY  60   5.780  -1.960   5.240
  464    H    GLU  61           H        GLU  61   3.709  -0.679   6.253
  465    HA   GLU  61           HA       GLU  61   2.202   0.992   4.474
  466   1HB   GLU  61          2HB       GLU  61   2.992   1.603   7.337
  467   2HB   GLU  61          1HB       GLU  61   1.626   2.279   6.448
  468   1HG   GLU  61          2HG       GLU  61   0.693  -0.030   6.216
  469   2HG   GLU  61          1HG       GLU  61   2.007  -0.626   7.232
  470    H    ASP  62           H        ASP  62   4.961   1.902   6.580
  471    HA   ASP  62           HA       ASP  62   5.375   4.435   5.346
  472   1HB   ASP  62          2HB       ASP  62   7.527   4.445   6.488
  473   2HB   ASP  62          1HB       ASP  62   6.312   3.756   7.565
  474    H    THR  63           H        THR  63   6.822   1.247   4.720
  475    HA   THR  63           HA       THR  63   8.732   2.072   2.792
  476    HB   THR  63           HB       THR  63   7.901  -0.421   1.912
  477    HG1  THR  63           HG1      THR  63   7.814  -0.647   4.677
  478   1HG2  THR  63          1HG2      THR  63   9.726  -0.127   4.280
  479   2HG2  THR  63          2HG2      THR  63  10.181   0.570   2.726
  480   3HG2  THR  63          3HG2      THR  63   9.902  -1.166   2.866
  481    H    LEU  64           H        LEU  64   5.272   1.467   2.511
  482    HA   LEU  64           HA       LEU  64   5.294   1.586  -0.407
  483   1HB   LEU  64          2HB       LEU  64   3.456   0.777   1.554
  484   2HB   LEU  64          1HB       LEU  64   2.722   2.189   0.794
  485    HG   LEU  64           HG       LEU  64   3.670  -0.351  -0.548
  486   1HD1  LEU  64          1HD1      LEU  64   1.008   1.074  -0.724
  487   2HD1  LEU  64          2HD1      LEU  64   1.348  -0.150   0.498
  488   3HD1  LEU  64          3HD1      LEU  64   1.386  -0.577  -1.213
  489   1HD2  LEU  64          1HD2      LEU  64   3.266   2.407  -1.621
  490   2HD2  LEU  64          2HD2      LEU  64   2.665   1.063  -2.593
  491   3HD2  LEU  64          3HD2      LEU  64   4.372   1.144  -2.161
  492    H    MET  65           H        MET  65   4.773   3.855   2.242
  493    HA   MET  65           HA       MET  65   3.627   5.977   0.743
  494   1HB   MET  65          2HB       MET  65   3.827   5.882   3.253
  495   2HB   MET  65          1HB       MET  65   5.541   6.261   3.076
  496   1HG   MET  65          2HG       MET  65   4.735   8.407   3.302
  497   2HG   MET  65          1HG       MET  65   4.543   8.232   1.557
  498   1HE   MET  65          1HE       MET  65   1.302   7.437   4.702
  499   2HE   MET  65          2HE       MET  65   2.656   8.511   5.045
  500   3HE   MET  65          3HE       MET  65   2.959   6.819   4.659
  501    H    GLU  66           H        GLU  66   6.998   4.987   1.182
  502    HA   GLU  66           HA       GLU  66   8.077   7.314  -0.156
  503   1HB   GLU  66          2HB       GLU  66   9.210   5.599   1.500
  504   2HB   GLU  66          1HB       GLU  66   9.559   4.718   0.013
  505   1HG   GLU  66          2HG       GLU  66  10.405   7.530   0.740
  506   2HG   GLU  66          1HG       GLU  66  11.441   6.148   0.382
  507    H    TYR  67           H        TYR  67   7.778   3.876  -1.125
  508    HA   TYR  67           HA       TYR  67   8.672   4.184  -3.786
  509   1HB   TYR  67          2HB       TYR  67   8.355   1.972  -2.882
  510   2HB   TYR  67          1HB       TYR  67   6.638   2.272  -2.610
  511    HD1  TYR  67           HD1      TYR  67   9.123   2.492  -5.419
  512    HD2  TYR  67           HD2      TYR  67   5.158   1.412  -4.182
  513    HE1  TYR  67           HE1      TYR  67   8.625   1.697  -7.715
  514    HE2  TYR  67           HE2      TYR  67   4.657   0.618  -6.477
  515    HH   TYR  67           HH       TYR  67   6.094   1.424  -9.054
  516    H    LEU  68           H        LEU  68   5.599   5.044  -2.341
  517    HA   LEU  68           HA       LEU  68   4.275   5.345  -4.938
  518   1HB   LEU  68          2HB       LEU  68   3.439   5.229  -2.218
  519   2HB   LEU  68          1HB       LEU  68   2.915   6.784  -2.864
  520    HG   LEU  68           HG       LEU  68   1.879   5.640  -4.789
  521   1HD1  LEU  68          1HD1      LEU  68   3.389   3.701  -4.891
  522   2HD1  LEU  68          2HD1      LEU  68   1.713   3.166  -4.765
  523   3HD1  LEU  68          3HD1      LEU  68   2.763   3.119  -3.349
  524   1HD2  LEU  68          1HD2      LEU  68   0.994   5.632  -2.124
  525   2HD2  LEU  68          2HD2      LEU  68   0.644   4.010  -2.723
  526   3HD2  LEU  68          3HD2      LEU  68  -0.004   5.421  -3.563
  527    H    GLU  69           H        GLU  69   5.763   7.472  -2.520
  528    HA   GLU  69           HA       GLU  69   5.065   9.951  -3.731
  529   1HB   GLU  69          2HB       GLU  69   6.328   9.351  -1.481
  530   2HB   GLU  69          1HB       GLU  69   7.757   9.544  -2.485
  531   1HG   GLU  69          2HG       GLU  69   7.539  11.796  -2.540
  532   2HG   GLU  69          1HG       GLU  69   5.817  11.688  -2.908
  533    H    ASN  70           H        ASN  70   7.265   7.445  -4.547
  534    HA   ASN  70           HA       ASN  70   7.816   8.567  -7.158
  535   1HB   ASN  70          2HB       ASN  70   9.903   8.740  -4.992
  536   2HB   ASN  70          1HB       ASN  70  10.386   8.507  -6.672
  537   1HD2  ASN  70          1HD2      ASN  70   8.879  10.109  -8.186
  538   2HD2  ASN  70          2HD2      ASN  70   8.903  11.723  -7.662
  539    HA   PRO  71           HA       PRO  71   8.115   4.052  -6.916
  540   1HB   PRO  71          2HB       PRO  71   6.917   3.654  -9.366
  541   2HB   PRO  71          1HB       PRO  71   6.021   3.845  -7.850
  542   1HG   PRO  71          2HG       PRO  71   6.355   5.783 -10.085
  543   2HG   PRO  71          1HG       PRO  71   5.063   5.673  -8.881
  544   1HD   PRO  71          2HD       PRO  71   7.216   7.522  -8.851
  545   2HD   PRO  71          1HD       PRO  71   6.088   7.204  -7.518
  546    H    LYS  72           H        LYS  72   9.034   6.270  -9.506
  547    HA   LYS  72           HA       LYS  72  10.806   4.307 -10.756
  548   1HB   LYS  72          2HB       LYS  72   9.621   6.026 -12.116
  549   2HB   LYS  72          1HB       LYS  72  10.541   7.279 -11.281
  550   1HG   LYS  72          2HG       LYS  72  12.477   5.442 -12.117
  551   2HG   LYS  72          1HG       LYS  72  11.362   5.556 -13.480
  552   1HD   LYS  72          2HD       LYS  72  12.333   8.048 -12.094
  553   2HD   LYS  72          1HD       LYS  72  13.318   7.273 -13.335
  554   1HE   LYS  72          2HE       LYS  72  10.499   8.337 -13.639
  555   2HE   LYS  72          1HE       LYS  72  11.956   8.934 -14.432
  556   1HZ   LYS  72          1HZ       LYS  72  12.091   6.483 -15.260
  557   2HZ   LYS  72          2HZ       LYS  72  11.090   7.603 -16.053
  558   3HZ   LYS  72          3HZ       LYS  72  10.424   6.489 -14.957
  559    H    LYS  73           H        LYS  73  11.024   7.030  -8.538
  560    HA   LYS  73           HA       LYS  73  13.945   7.125  -8.636
  561   1HB   LYS  73          2HB       LYS  73  12.205   8.250  -6.436
  562   2HB   LYS  73          1HB       LYS  73  13.786   8.816  -6.972
  563   1HG   LYS  73          2HG       LYS  73  11.541   8.773  -8.955
  564   2HG   LYS  73          1HG       LYS  73  11.581  10.062  -7.752
  565   1HD   LYS  73          2HD       LYS  73  14.089   9.405  -9.258
  566   2HD   LYS  73          1HD       LYS  73  12.840  10.365 -10.053
  567   1HE   LYS  73          2HE       LYS  73  13.188  12.175  -8.707
  568   2HE   LYS  73          1HE       LYS  73  13.492  11.181  -7.283
  569   1HZ   LYS  73          1HZ       LYS  73  15.404  11.462  -9.533
  570   2HZ   LYS  73          2HZ       LYS  73  15.686  10.727  -8.026
  571   3HZ   LYS  73          3HZ       LYS  73  15.463  12.409  -8.127
  572    H    TYR  74           H        TYR  74  11.476   5.633  -6.601
  573    HA   TYR  74           HA       TYR  74  13.380   4.669  -4.617
  574   1HB   TYR  74          2HB       TYR  74  10.893   5.035  -4.216
  575   2HB   TYR  74          1HB       TYR  74  10.603   3.600  -5.200
  576    HD1  TYR  74           HD1      TYR  74  13.139   4.476  -2.569
  577    HD2  TYR  74           HD2      TYR  74  10.070   1.764  -3.868
  578    HE1  TYR  74           HE1      TYR  74  13.573   3.038  -0.595
  579    HE2  TYR  74           HE2      TYR  74  10.506   0.326  -1.894
  580    HH   TYR  74           HH       TYR  74  12.385  -0.116  -0.320
  581    H    ILE  75           H        ILE  75  11.250   2.809  -6.814
  582    HA   ILE  75           HA       ILE  75  13.369   0.762  -7.002
  583    HB   ILE  75           HB       ILE  75  10.560   0.544  -8.057
  584   1HG1  ILE  75          2HG1      ILE  75  10.605   1.389  -5.645
  585   2HG1  ILE  75          1HG1      ILE  75   9.780  -0.148  -5.895
  586   1HG2  ILE  75          1HG2      ILE  75  11.602  -1.399  -8.630
  587   2HG2  ILE  75          2HG2      ILE  75  11.236  -1.813  -6.959
  588   3HG2  ILE  75          3HG2      ILE  75  12.839  -1.220  -7.384
  589   1HD1  ILE  75          1HD1      ILE  75  11.710  -1.386  -5.132
  590   2HD1  ILE  75          2HD1      ILE  75  11.356  -0.147  -3.930
  591   3HD1  ILE  75          3HD1      ILE  75  12.683   0.082  -5.069
  592    HA   PRO  76           HA       PRO  76  13.980   2.464 -11.122
  593   1HB   PRO  76          2HB       PRO  76  16.309   1.083 -11.584
  594   2HB   PRO  76          1HB       PRO  76  16.236   2.578 -10.637
  595   1HG   PRO  76          2HG       PRO  76  16.603  -0.221  -9.692
  596   2HG   PRO  76          1HG       PRO  76  17.097   1.296  -8.922
  597   1HD   PRO  76          2HD       PRO  76  14.833  -0.280  -8.234
  598   2HD   PRO  76          1HD       PRO  76  15.189   1.361  -7.657
  599    H    GLY  77           H        GLY  77  11.979   0.706 -11.228
  600   1HA   GLY  77          2HA       GLY  77  12.675  -1.033 -13.477
  601   2HA   GLY  77          1HA       GLY  77  12.172  -1.897 -12.025
  602    H    THR  78           H        THR  78  10.126  -0.300 -11.043
  603    HA   THR  78           HA       THR  78   7.901  -1.081 -12.558
  604    HB   THR  78           HB       THR  78   7.894  -0.102 -10.188
  605    HG1  THR  78           HG1      THR  78   6.027  -0.532 -11.581
  606   1HG2  THR  78          1HG2      THR  78   7.220   2.545 -11.272
  607   2HG2  THR  78          2HG2      THR  78   8.924   2.124 -11.446
  608   3HG2  THR  78          3HG2      THR  78   8.173   2.125  -9.850
  609    H    LYS  79           H        LYS  79   6.326   0.407 -13.671
  610    HA   LYS  79           HA       LYS  79   7.692   2.564 -15.200
  611   1HB   LYS  79          2HB       LYS  79   6.500   1.745 -17.258
  612   2HB   LYS  79          1HB       LYS  79   7.728   0.624 -16.668
  613   1HG   LYS  79          2HG       LYS  79   5.910  -0.598 -15.425
  614   2HG   LYS  79          1HG       LYS  79   4.735   0.437 -16.238
  615   1HD   LYS  79          2HD       LYS  79   6.697  -1.456 -17.564
  616   2HD   LYS  79          1HD       LYS  79   4.944  -1.636 -17.494
  617   1HE   LYS  79          2HE       LYS  79   4.855   0.672 -18.656
  618   2HE   LYS  79          1HE       LYS  79   6.557   0.400 -19.028
  619   1HZ   LYS  79          1HZ       LYS  79   4.484  -0.488 -20.508
  620   2HZ   LYS  79          2HZ       LYS  79   4.866  -1.861 -19.584
  621   3HZ   LYS  79          3HZ       LYS  79   6.054  -1.129 -20.553
  622    H    MET  80           H        MET  80   5.403   1.954 -13.042
  623    HA   MET  80           HA       MET  80   3.086   3.156 -14.337
  624   1HB   MET  80          2HB       MET  80   2.073   3.133 -12.094
  625   2HB   MET  80          1HB       MET  80   2.836   1.594 -12.457
  626   1HG   MET  80          2HG       MET  80   4.706   2.072 -11.108
  627   2HG   MET  80          1HG       MET  80   4.251   3.748 -10.929
  628   1HE   MET  80          1HE       MET  80   3.254   4.072  -7.919
  629   2HE   MET  80          2HE       MET  80   1.701   4.235  -8.737
  630   3HE   MET  80          3HE       MET  80   3.181   4.708  -9.569
  631    H    ILE  81           H        ILE  81   2.801   5.239 -14.689
  632    HA   ILE  81           HA       ILE  81   4.569   7.214 -13.340
  633    HB   ILE  81           HB       ILE  81   2.663   7.650 -15.661
  634   1HG1  ILE  81          2HG1      ILE  81   5.659   7.314 -15.862
  635   2HG1  ILE  81          1HG1      ILE  81   4.574   5.928 -15.986
  636   1HG2  ILE  81          1HG2      ILE  81   4.358   9.567 -16.025
  637   2HG2  ILE  81          2HG2      ILE  81   4.869   9.253 -14.367
  638   3HG2  ILE  81          3HG2      ILE  81   3.207   9.743 -14.700
  639   1HD1  ILE  81          1HD1      ILE  81   3.319   7.536 -17.709
  640   2HD1  ILE  81          2HD1      ILE  81   4.669   6.520 -18.215
  641   3HD1  ILE  81          3HD1      ILE  81   4.935   8.226 -17.859
  642    H    PHE  82           H        PHE  82   2.419   5.949 -11.935
  643    HA   PHE  82           HA       PHE  82   0.027   7.462 -11.814
  644   1HB   PHE  82          2HB       PHE  82  -0.088   5.455 -10.654
  645   2HB   PHE  82          1HB       PHE  82   1.516   5.646  -9.958
  646    HD1  PHE  82           HD1      PHE  82  -1.806   7.366  -9.943
  647    HD2  PHE  82           HD2      PHE  82   1.665   6.197  -7.705
  648    HE1  PHE  82           HE1      PHE  82  -2.817   8.319  -7.888
  649    HE2  PHE  82           HE2      PHE  82   0.656   7.149  -5.645
  650    HZ   PHE  82           HZ       PHE  82  -1.586   8.206  -5.739
  651    H    VAL  83           H        VAL  83   3.171   7.971 -10.282
  652    HA   VAL  83           HA       VAL  83   2.717   9.794  -8.301
  653    HB   VAL  83           HB       VAL  83   4.754  11.098  -9.401
  654   1HG1  VAL  83          1HG1      VAL  83   5.109   9.847  -7.429
  655   2HG1  VAL  83          2HG1      VAL  83   6.208   9.113  -8.596
  656   3HG1  VAL  83          3HG1      VAL  83   4.677   8.327  -8.212
  657   1HG2  VAL  83          1HG2      VAL  83   5.744  10.112 -11.215
  658   2HG2  VAL  83          2HG2      VAL  83   4.116   9.504 -11.515
  659   3HG2  VAL  83          3HG2      VAL  83   5.301   8.486 -10.697
  660    H    GLY  84           H        GLY  84   0.883  11.083  -8.507
  661   1HA   GLY  84          2HA       GLY  84   1.208  13.489 -10.158
  662   2HA   GLY  84          1HA       GLY  84  -0.178  12.485 -10.586
  663    H    ILE  85           H        ILE  85   0.819  12.492  -7.269
  664    HA   ILE  85           HA       ILE  85  -1.622  14.077  -6.606
  665    HB   ILE  85           HB       ILE  85  -0.205  12.618  -4.448
  666   1HG1  ILE  85          2HG1      ILE  85  -1.716  10.575  -5.444
  667   2HG1  ILE  85          1HG1      ILE  85  -1.121  11.296  -6.939
  668   1HG2  ILE  85          1HG2      ILE  85  -2.368  13.806  -4.162
  669   2HG2  ILE  85          2HG2      ILE  85  -2.512  12.083  -3.815
  670   3HG2  ILE  85          3HG2      ILE  85  -3.100  12.726  -5.348
  671   1HD1  ILE  85          1HD1      ILE  85   0.284   9.503  -5.383
  672   2HD1  ILE  85          2HD1      ILE  85   0.942  11.054  -4.862
  673   3HD1  ILE  85          3HD1      ILE  85   1.003  10.597  -6.565
  674    H    LYS  86           H        LYS  86  -1.413  15.496  -4.645
  675    HA   LYS  86           HA       LYS  86   1.357  16.432  -4.122
  676   1HB   LYS  86          2HB       LYS  86  -0.695  17.879  -5.646
  677   2HB   LYS  86          1HB       LYS  86  -0.044  18.809  -4.296
  678   1HG   LYS  86          2HG       LYS  86   2.270  17.910  -5.209
  679   2HG   LYS  86          1HG       LYS  86   1.364  17.742  -6.714
  680   1HD   LYS  86          2HD       LYS  86   0.841  20.294  -5.396
  681   2HD   LYS  86          1HD       LYS  86   2.550  20.081  -5.779
  682   1HE   LYS  86          2HE       LYS  86   2.090  19.740  -8.095
  683   2HE   LYS  86          1HE       LYS  86   0.365  19.535  -7.795
  684   1HZ   LYS  86          1HZ       LYS  86   1.021  21.756  -8.679
  685   2HZ   LYS  86          2HZ       LYS  86   1.836  22.044  -7.217
  686   3HZ   LYS  86          3HZ       LYS  86   0.154  21.808  -7.223
  687    H    LYS  87           H        LYS  87  -1.149  15.156  -2.751
  688    HA   LYS  87           HA       LYS  87  -1.088  16.999  -0.399
  689   1HB   LYS  87          2HB       LYS  87  -3.346  16.190  -1.952
  690   2HB   LYS  87          1HB       LYS  87  -3.480  15.437  -0.363
  691   1HG   LYS  87          2HG       LYS  87  -4.346  17.444   0.269
  692   2HG   LYS  87          1HG       LYS  87  -2.659  17.958   0.313
  693   1HD   LYS  87          2HD       LYS  87  -2.889  19.267  -1.524
  694   2HD   LYS  87          1HD       LYS  87  -3.851  18.057  -2.374
  695   1HE   LYS  87          2HE       LYS  87  -5.859  18.745  -1.299
  696   2HE   LYS  87          1HE       LYS  87  -4.980  19.680  -0.090
  697   1HZ   LYS  87          1HZ       LYS  87  -6.006  21.017  -1.904
  698   2HZ   LYS  87          2HZ       LYS  87  -4.917  20.293  -2.990
  699   3HZ   LYS  87          3HZ       LYS  87  -4.337  21.255  -1.716
  700    H    LYS  88           H        LYS  88  -0.223  16.007   1.349
  701    HA   LYS  88           HA       LYS  88   0.499  13.234   1.370
  702   1HB   LYS  88          2HB       LYS  88   0.911  15.522   3.026
  703   2HB   LYS  88          1HB       LYS  88   0.288  14.228   4.049
  704   1HG   LYS  88          2HG       LYS  88   2.031  12.720   3.312
  705   2HG   LYS  88          1HG       LYS  88   2.589  13.885   2.108
  706   1HD   LYS  88          2HD       LYS  88   3.654  15.190   3.662
  707   2HD   LYS  88          1HD       LYS  88   2.463  14.847   4.918
  708   1HE   LYS  88          2HE       LYS  88   3.751  12.389   4.308
  709   2HE   LYS  88          1HE       LYS  88   5.017  13.604   4.493
  710   1HZ   LYS  88          1HZ       LYS  88   3.949  14.269   6.597
  711   2HZ   LYS  88          2HZ       LYS  88   4.518  12.669   6.620
  712   3HZ   LYS  88          3HZ       LYS  88   2.859  12.980   6.433
  713    H    GLU  89           H        GLU  89  -2.258  15.006   2.720
  714    HA   GLU  89           HA       GLU  89  -3.366  12.948   4.309
  715   1HB   GLU  89          2HB       GLU  89  -4.282  15.450   3.116
  716   2HB   GLU  89          1HB       GLU  89  -5.563  14.238   3.182
  717   1HG   GLU  89          2HG       GLU  89  -3.997  14.271   5.638
  718   2HG   GLU  89          1HG       GLU  89  -4.704  15.851   5.298
  719    H    GLU  90           H        GLU  90  -3.682  13.559   0.821
  720    HA   GLU  90           HA       GLU  90  -5.639  11.528   0.325
  721   1HB   GLU  90          2HB       GLU  90  -3.920  13.280  -1.251
  722   2HB   GLU  90          1HB       GLU  90  -4.083  11.684  -1.985
  723   1HG   GLU  90          2HG       GLU  90  -6.663  12.207  -1.188
  724   2HG   GLU  90          1HG       GLU  90  -6.092  13.808  -1.659
  725    H    ARG  91           H        ARG  91  -2.066  11.452   0.040
  726    HA   ARG  91           HA       ARG  91  -1.791   8.781  -0.803
  727   1HB   ARG  91          2HB       ARG  91  -0.088  10.809   0.264
  728   2HB   ARG  91          1HB       ARG  91   0.227   9.321   1.158
  729   1HG   ARG  91          2HG       ARG  91   1.600   8.880  -0.618
  730   2HG   ARG  91          1HG       ARG  91   0.096   8.324  -1.356
  731   1HD   ARG  91          2HD       ARG  91   0.519   9.831  -2.991
  732   2HD   ARG  91          1HD       ARG  91   0.045  11.059  -1.816
  733    HE   ARG  91           HE       ARG  91   2.893  10.185  -1.956
  734   1HH1  ARG  91          1HH2      ARG  91   1.756  12.468  -0.245
  735   2HH1  ARG  91          2HH2      ARG  91   2.247  13.844  -1.175
  736   1HH2  ARG  91          1HH1      ARG  91   2.956  11.999  -4.023
  737   2HH2  ARG  91          2HH1      ARG  91   2.928  13.578  -3.312
  738    H    ALA  92           H        ALA  92  -2.095  10.056   2.508
  739    HA   ALA  92           HA       ALA  92  -1.861   7.605   3.898
  740   1HB   ALA  92          1HB       ALA  92  -2.806   8.721   5.751
  741   2HB   ALA  92          2HB       ALA  92  -3.814   9.747   4.730
  742   3HB   ALA  92          3HB       ALA  92  -2.075  10.027   4.818
  743    H    ASP  93           H        ASP  93  -4.717   9.147   2.432
  744    HA   ASP  93           HA       ASP  93  -6.649   7.263   3.308
  745   1HB   ASP  93          2HB       ASP  93  -6.512   8.937   0.787
  746   2HB   ASP  93          1HB       ASP  93  -7.929   7.997   1.254
  747    H    LEU  94           H        LEU  94  -4.406   7.185   0.569
  748    HA   LEU  94           HA       LEU  94  -5.502   4.962  -0.813
  749   1HB   LEU  94          2HB       LEU  94  -2.617   5.844  -0.503
  750   2HB   LEU  94          1HB       LEU  94  -3.160   4.620  -1.650
  751    HG   LEU  94           HG       LEU  94  -4.423   7.356  -1.596
  752   1HD1  LEU  94          1HD1      LEU  94  -1.716   6.969  -2.056
  753   2HD1  LEU  94          2HD1      LEU  94  -2.671   8.326  -2.653
  754   3HD1  LEU  94          3HD1      LEU  94  -2.407   6.915  -3.677
  755   1HD2  LEU  94          1HD2      LEU  94  -4.693   6.696  -4.065
  756   2HD2  LEU  94          2HD2      LEU  94  -5.642   5.772  -2.899
  757   3HD2  LEU  94          3HD2      LEU  94  -4.167   5.085  -3.579
  758    H    ILE  95           H        ILE  95  -3.080   5.067   1.805
  759    HA   ILE  95           HA       ILE  95  -2.742   2.210   1.950
  760    HB   ILE  95           HB       ILE  95  -2.372   4.049   4.308
  761   1HG1  ILE  95          2HG1      ILE  95  -1.406   5.370   2.590
  762   2HG1  ILE  95          1HG1      ILE  95  -0.049   4.462   3.258
  763   1HG2  ILE  95          1HG2      ILE  95  -1.874   1.683   4.632
  764   2HG2  ILE  95          2HG2      ILE  95  -0.363   2.591   4.605
  765   3HG2  ILE  95          3HG2      ILE  95  -0.863   1.667   3.188
  766   1HD1  ILE  95          1HD1      ILE  95  -1.253   4.322   0.582
  767   2HD1  ILE  95          2HD1      ILE  95  -1.008   2.744   1.329
  768   3HD1  ILE  95          3HD1      ILE  95   0.357   3.840   1.118
  769    H    ALA  96           H        ALA  96  -4.667   4.467   3.922
  770    HA   ALA  96           HA       ALA  96  -5.785   2.741   5.773
  771   1HB   ALA  96          1HB       ALA  96  -7.391   4.827   4.279
  772   2HB   ALA  96          2HB       ALA  96  -6.231   5.219   5.548
  773   3HB   ALA  96          3HB       ALA  96  -7.656   4.249   5.925
  774    H    TYR  97           H        TYR  97  -6.782   3.125   2.375
  775    HA   TYR  97           HA       TYR  97  -9.051   1.374   2.613
  776   1HB   TYR  97          2HB       TYR  97  -8.935   2.948   0.767
  777   2HB   TYR  97          1HB       TYR  97  -7.442   2.206   0.186
  778    HD1  TYR  97           HD1      TYR  97  -7.734   0.856  -1.683
  779    HD2  TYR  97           HD2      TYR  97 -10.805   0.964   1.317
  780    HE1  TYR  97           HE1      TYR  97  -9.046  -0.810  -2.966
  781    HE2  TYR  97           HE2      TYR  97 -12.119  -0.701   0.031
  782    HH   TYR  97           HH       TYR  97 -10.801  -2.229  -2.876
  783    H    LEU  98           H        LEU  98  -5.768   0.855   1.280
  784    HA   LEU  98           HA       LEU  98  -6.227  -1.971   0.864
  785   1HB   LEU  98          2HB       LEU  98  -3.920  -0.104   0.664
  786   2HB   LEU  98          1HB       LEU  98  -3.526  -1.801   0.936
  787    HG   LEU  98           HG       LEU  98  -3.607  -1.441  -1.452
  788   1HD1  LEU  98          1HD1      LEU  98  -6.304  -2.643  -0.954
  789   2HD1  LEU  98          2HD1      LEU  98  -4.886  -3.434  -0.266
  790   3HD1  LEU  98          3HD1      LEU  98  -5.008  -3.203  -2.011
  791   1HD2  LEU  98          1HD2      LEU  98  -6.480  -0.617  -1.379
  792   2HD2  LEU  98          2HD2      LEU  98  -5.229  -0.215  -2.555
  793   3HD2  LEU  98          3HD2      LEU  98  -5.266   0.602  -0.993
  794    H    LYS  99           H        LYS  99  -5.859  -0.218   3.679
  795    HA   LYS  99           HA       LYS  99  -4.435  -2.388   5.085
  796   1HB   LYS  99          2HB       LYS  99  -4.041   0.223   5.359
  797   2HB   LYS  99          1HB       LYS  99  -5.384   0.070   6.491
  798   1HG   LYS  99          2HG       LYS  99  -3.644  -2.109   7.001
  799   2HG   LYS  99          1HG       LYS  99  -2.631  -0.671   6.870
  800   1HD   LYS  99          2HD       LYS  99  -4.423   0.443   8.400
  801   2HD   LYS  99          1HD       LYS  99  -4.892  -1.214   8.781
  802   1HE   LYS  99          2HE       LYS  99  -1.998  -0.849   8.872
  803   2HE   LYS  99          1HE       LYS  99  -2.837   0.220   9.997
  804   1HZ   LYS  99          1HZ       LYS  99  -2.236  -2.147  10.749
  805   2HZ   LYS  99          2HZ       LYS  99  -3.569  -2.630   9.812
  806   3HZ   LYS  99          3HZ       LYS  99  -3.783  -1.552  11.108
  807    H    LYS 100           H        LYS 100  -7.605  -1.104   4.600
  808    HA   LYS 100           HA       LYS 100  -8.627  -2.694   6.913
  809   1HB   LYS 100          2HB       LYS 100  -9.441  -0.183   5.626
  810   2HB   LYS 100          1HB       LYS 100 -10.781  -1.296   5.907
  811   1HG   LYS 100          2HG       LYS 100 -10.731  -0.921   8.129
  812   2HG   LYS 100          1HG       LYS 100  -8.992  -1.211   8.196
  813   1HD   LYS 100          2HD       LYS 100  -9.705   1.125   8.879
  814   2HD   LYS 100          1HD       LYS 100  -8.508   1.065   7.584
  815   1HE   LYS 100          2HE       LYS 100  -9.971   1.851   6.011
  816   2HE   LYS 100          1HE       LYS 100 -11.347   1.007   6.721
  817   1HZ   LYS 100          1HZ       LYS 100 -11.304   2.650   8.541
  818   2HZ   LYS 100          2HZ       LYS 100 -11.623   3.350   7.027
  819   3HZ   LYS 100          3HZ       LYS 100 -10.081   3.498   7.726
  820    H    ALA 101           H        ALA 101  -8.516  -2.544   3.472
  821    HA   ALA 101           HA       ALA 101 -10.775  -4.400   3.165
  822   1HB   ALA 101          1HB       ALA 101  -9.419  -4.009   0.699
  823   2HB   ALA 101          2HB       ALA 101  -9.496  -2.442   1.506
  824   3HB   ALA 101          3HB       ALA 101 -10.979  -3.344   1.189
  825    H    THR 102           H        THR 102  -7.252  -4.326   2.826
  826    HA   THR 102           HA       THR 102  -7.328  -7.306   2.605
  827    HB   THR 102           HB       THR 102  -5.000  -6.599   1.306
  828    HG1  THR 102           HG1      THR 102  -5.544  -4.455   1.175
  829   1HG2  THR 102          1HG2      THR 102  -6.444  -7.051  -0.794
  830   2HG2  THR 102          2HG2      THR 102  -7.774  -7.274   0.342
  831   3HG2  THR 102          3HG2      THR 102  -6.356  -8.318   0.430
  832    H    ASN 103           H        ASN 103  -7.065  -6.058   5.052
  833    HA   ASN 103           HA       ASN 103  -4.556  -7.097   5.975
  834   1HB   ASN 103          2HB       ASN 103  -3.935  -4.847   4.858
  835   2HB   ASN 103          1HB       ASN 103  -4.744  -4.098   6.234
  836   1HD2  ASN 103          1HD2      ASN 103  -2.118  -6.423   5.441
  837   2HD2  ASN 103          2HD2      ASN 103  -1.221  -6.122   6.851
  838    H    GLU 104           HN       GLU 104  -7.350  -5.013   6.566
  839    HA   GLU 104           HA       GLU 104  -7.389  -6.069   9.363
  840   1HB   GLU 104          2HB       GLU 104  -7.624  -3.263   8.378
  841   2HB   GLU 104          1HB       GLU 104  -8.688  -3.741   9.700
  842   1HG   GLU 104          2HG       GLU 104  -6.212  -4.811  10.411
  843   2HG   GLU 104          1HG       GLU 104  -5.817  -3.229   9.735
  844    HHA  HEC 105           HHA      HEC 105   4.386  -2.521  -9.133
  845    HHB  HEC 105           HHB      HEC 105   1.289   0.996  -4.908
  846    HHC  HEC 105           HHC      HEC 105  -2.026   3.694  -9.575
  847    HHD  HEC 105           HHD      HEC 105   1.083   0.180 -13.804
  848   1HMA  HEC 105          1HMA      HEC 105   3.864  -1.701  -4.083
  849   2HMA  HEC 105          2HMA      HEC 105   2.242  -1.040  -3.881
  850   3HMA  HEC 105          3HMA      HEC 105   3.626   0.045  -4.004
  851   1HAA  HEC 105          1HAA      HEC 105   4.841  -2.756  -5.423
  852   2HAA  HEC 105          2HAA      HEC 105   5.613  -2.414  -6.959
  853   1HBA  HEC 105          1HBA      HEC 105   5.038  -4.718  -7.061
  854   2HBA  HEC 105          2HBA      HEC 105   3.799  -3.898  -8.007
  855   1HMB  HEC 105          1HMB      HEC 105  -1.607   2.388  -4.248
  856   2HMB  HEC 105          2HMB      HEC 105  -0.735   3.913  -4.405
  857   3HMB  HEC 105          3HMB      HEC 105   0.146   2.424  -4.066
  858    HAB  HEC 105           HAB      HEC 105  -2.589   4.649  -7.807
  859   1HBB  HEC 105          1HBB      HEC 105  -2.535   4.871  -4.884
  860   2HBB  HEC 105          2HBB      HEC 105  -2.658   6.110  -6.131
  861   3HBB  HEC 105          3HBB      HEC 105  -1.093   5.389  -5.754
  862   1HMC  HEC 105          1HMC      HEC 105  -2.126   4.361 -13.093
  863   2HMC  HEC 105          2HMC      HEC 105  -3.322   3.175 -12.570
  864   3HMC  HEC 105          3HMC      HEC 105  -2.625   4.299 -11.403
  865    HAC  HEC 105           HAC      HEC 105  -0.014   1.586 -14.862
  866   1HBC  HEC 105          1HBC      HEC 105  -0.795   4.056 -14.386
  867   2HBC  HEC 105          2HBC      HEC 105  -2.310   3.403 -15.010
  868   3HBC  HEC 105          3HBC      HEC 105  -0.843   3.314 -15.985
  869   1HMD  HEC 105          1HMD      HEC 105   4.113  -1.848 -14.340
  870   2HMD  HEC 105          2HMD      HEC 105   2.478  -2.505 -14.407
  871   3HMD  HEC 105          3HMD      HEC 105   2.748  -0.780 -14.659
  872   1HAD  HEC 105          1HAD      HEC 105   5.593  -2.577 -12.128
  873   2HAD  HEC 105          2HAD      HEC 105   4.838  -3.507 -10.845
  874   1HBD  HEC 105          1HBD      HEC 105   3.413  -3.825 -13.353
  875   2HBD  HEC 105          2HBD      HEC 105   4.109  -5.055 -12.300
  Start of MODEL   12
    1   1H    GLY   1          1HT       GLY   1  -9.915   8.457   8.876
    2   2H    GLY   1          2HT       GLY   1  -9.174   9.929   8.466
    3   3H    GLY   1          3HT       GLY   1  -8.633   8.478   7.766
    4   1HA   GLY   1          1HA       GLY   1 -10.760  10.206   6.961
    5   2HA   GLY   1          2HA       GLY   1  -9.961   8.919   6.058
    6    H    ASP   2           H        ASP   2 -11.574   7.590   5.351
    7    HA   ASP   2           HA       ASP   2 -13.356   6.392   7.404
    8   1HB   ASP   2          2HB       ASP   2 -14.203   8.000   5.023
    9   2HB   ASP   2          1HB       ASP   2 -15.182   6.608   5.486
   10    H    VAL   3           H        VAL   3 -14.597   4.481   6.326
   11    HA   VAL   3           HA       VAL   3 -12.618   2.993   4.687
   12    HB   VAL   3           HB       VAL   3 -13.547   1.957   6.771
   13   1HG1  VAL   3          1HG1      VAL   3 -16.130   1.726   5.217
   14   2HG1  VAL   3          2HG1      VAL   3 -15.849   3.014   6.388
   15   3HG1  VAL   3          3HG1      VAL   3 -15.844   1.330   6.911
   16   1HG2  VAL   3          1HG2      VAL   3 -14.286   0.594   4.161
   17   2HG2  VAL   3          2HG2      VAL   3 -14.098  -0.219   5.714
   18   3HG2  VAL   3          3HG2      VAL   3 -12.706   0.540   4.944
   19    H    GLU   4           H        GLU   4 -16.098   3.806   4.687
   20    HA   GLU   4           HA       GLU   4 -16.656   2.620   2.138
   21   1HB   GLU   4          2HB       GLU   4 -18.025   4.386   4.038
   22   2HB   GLU   4          1HB       GLU   4 -18.434   4.729   2.357
   23   1HG   GLU   4          2HG       GLU   4 -18.886   2.282   2.029
   24   2HG   GLU   4          1HG       GLU   4 -18.641   2.052   3.761
   25    H    LYS   5           H        LYS   5 -15.035   5.531   3.037
   26    HA   LYS   5           HA       LYS   5 -15.412   6.750   0.368
   27   1HB   LYS   5          2HB       LYS   5 -14.201   7.627   2.969
   28   2HB   LYS   5          1HB       LYS   5 -13.712   8.439   1.480
   29   1HG   LYS   5          2HG       LYS   5 -15.760   9.411   1.176
   30   2HG   LYS   5          1HG       LYS   5 -16.630   8.021   1.828
   31   1HD   LYS   5          2HD       LYS   5 -16.133   8.667   4.091
   32   2HD   LYS   5          1HD       LYS   5 -15.006   9.910   3.548
   33   1HE   LYS   5          2HE       LYS   5 -17.334  10.575   2.210
   34   2HE   LYS   5          1HE       LYS   5 -17.928  10.017   3.774
   35   1HZ   LYS   5          1HZ       LYS   5 -15.660  11.604   4.195
   36   2HZ   LYS   5          2HZ       LYS   5 -17.263  11.910   4.669
   37   3HZ   LYS   5          3HZ       LYS   5 -16.702  12.452   3.160
   38    H    GLY   6           H        GLY   6 -12.952   5.097   2.278
   39   1HA   GLY   6          1HA       GLY   6 -10.764   5.630   0.473
   40   2HA   GLY   6          2HA       GLY   6 -10.798   4.357   1.694
   41    H    LYS   7           H        LYS   7 -13.449   3.453   0.405
   42    HA   LYS   7           HA       LYS   7 -12.280   1.448  -1.319
   43   1HB   LYS   7          2HB       LYS   7 -14.302   0.970  -0.021
   44   2HB   LYS   7          1HB       LYS   7 -15.176   2.240  -0.878
   45   1HG   LYS   7          2HG       LYS   7 -15.173   1.043  -2.909
   46   2HG   LYS   7          1HG       LYS   7 -13.865  -0.018  -2.385
   47   1HD   LYS   7          2HD       LYS   7 -16.022  -1.207  -2.328
   48   2HD   LYS   7          1HD       LYS   7 -15.368  -1.028  -0.700
   49   1HE   LYS   7          2HE       LYS   7 -16.951   0.554  -0.088
   50   2HE   LYS   7          1HE       LYS   7 -17.195   1.100  -1.747
   51   1HZ   LYS   7          1HZ       LYS   7 -19.002  -0.176  -1.714
   52   2HZ   LYS   7          2HZ       LYS   7 -18.527  -0.981  -0.295
   53   3HZ   LYS   7          3HZ       LYS   7 -17.955  -1.507  -1.806
   54    H    LYS   8           H        LYS   8 -13.917   4.525  -1.856
   55    HA   LYS   8           HA       LYS   8 -14.023   4.101  -4.765
   56   1HB   LYS   8          2HB       LYS   8 -14.971   6.177  -2.849
   57   2HB   LYS   8          1HB       LYS   8 -14.610   6.717  -4.489
   58   1HG   LYS   8          2HG       LYS   8 -16.306   5.468  -5.425
   59   2HG   LYS   8          1HG       LYS   8 -16.207   4.213  -4.189
   60   1HD   LYS   8          2HD       LYS   8 -17.458   5.464  -2.640
   61   2HD   LYS   8          1HD       LYS   8 -17.152   6.983  -3.481
   62   1HE   LYS   8          2HE       LYS   8 -19.276   6.624  -4.264
   63   2HE   LYS   8          1HE       LYS   8 -18.419   5.642  -5.450
   64   1HZ   LYS   8          1HZ       LYS   8 -18.835   3.693  -4.185
   65   2HZ   LYS   8          2HZ       LYS   8 -20.317   4.509  -4.347
   66   3HZ   LYS   8          3HZ       LYS   8 -19.458   4.583  -2.883
   67    H    ILE   9           H        ILE   9 -12.024   5.762  -2.392
   68    HA   ILE   9           HA       ILE   9 -10.561   7.454  -4.138
   69    HB   ILE   9           HB       ILE   9  -9.667   5.996  -1.633
   70   1HG1  ILE   9          2HG1      ILE   9 -11.562   7.641  -1.438
   71   2HG1  ILE   9          1HG1      ILE   9 -10.122   8.116  -0.534
   72   1HG2  ILE   9          1HG2      ILE   9  -7.740   6.650  -3.030
   73   2HG2  ILE   9          2HG2      ILE   9  -7.833   7.651  -1.580
   74   3HG2  ILE   9          3HG2      ILE   9  -8.371   8.294  -3.133
   75   1HD1  ILE   9          1HD1      ILE   9 -10.852  10.075  -1.708
   76   2HD1  ILE   9          2HD1      ILE   9 -11.056   9.175  -3.211
   77   3HD1  ILE   9          3HD1      ILE   9  -9.439   9.476  -2.576
   78    H    PHE  10           H        PHE  10  -9.652   4.172  -2.995
   79    HA   PHE  10           HA       PHE  10  -7.495   3.916  -4.888
   80   1HB   PHE  10          2HB       PHE  10  -7.678   2.542  -2.813
   81   2HB   PHE  10          1HB       PHE  10  -9.071   1.717  -3.514
   82    HD1  PHE  10           HD1      PHE  10  -8.750   0.548  -5.791
   83    HD2  PHE  10           HD2      PHE  10  -5.489   1.817  -3.301
   84    HE1  PHE  10           HE1      PHE  10  -7.229  -0.997  -6.996
   85    HE2  PHE  10           HE2      PHE  10  -3.968   0.272  -4.504
   86    HZ   PHE  10           HZ       PHE  10  -4.838  -1.134  -6.354
   87    H    ILE  11           H        ILE  11 -10.896   2.865  -4.898
   88    HA   ILE  11           HA       ILE  11 -10.863   1.374  -7.300
   89    HB   ILE  11           HB       ILE  11 -12.993   3.051  -5.966
   90   1HG1  ILE  11          2HG1      ILE  11 -12.207   0.815  -5.035
   91   2HG1  ILE  11          1HG1      ILE  11 -13.933   0.915  -5.389
   92   1HG2  ILE  11          1HG2      ILE  11 -13.589   3.204  -8.278
   93   2HG2  ILE  11          2HG2      ILE  11 -14.573   1.901  -7.612
   94   3HG2  ILE  11          3HG2      ILE  11 -13.145   1.524  -8.575
   95   1HD1  ILE  11          1HD1      ILE  11 -11.807  -0.328  -7.157
   96   2HD1  ILE  11          2HD1      ILE  11 -13.503  -0.144  -7.605
   97   3HD1  ILE  11          3HD1      ILE  11 -13.056  -1.190  -6.257
   98    H    MET  12           H        MET  12 -10.436   4.758  -6.780
   99    HA   MET  12           HA       MET  12 -10.746   5.220  -9.723
  100   1HB   MET  12          2HB       MET  12 -12.384   6.509  -8.451
  101   2HB   MET  12          1HB       MET  12 -11.106   7.171  -7.430
  102   1HG   MET  12          2HG       MET  12 -10.139   8.369  -9.265
  103   2HG   MET  12          1HG       MET  12 -11.151   7.521 -10.435
  104   1HE   MET  12          1HE       MET  12 -12.812   8.186 -11.379
  105   2HE   MET  12          2HE       MET  12 -12.462   9.907 -11.534
  106   3HE   MET  12          3HE       MET  12 -14.046   9.384 -10.966
  107    H    LYS  13           H        LYS  13  -8.484   4.972  -7.242
  108    HA   LYS  13           HA       LYS  13  -6.648   6.953  -8.493
  109   1HB   LYS  13          2HB       LYS  13  -7.068   6.378  -5.857
  110   2HB   LYS  13          1HB       LYS  13  -5.683   5.343  -6.206
  111   1HG   LYS  13          2HG       LYS  13  -4.554   7.284  -5.701
  112   2HG   LYS  13          1HG       LYS  13  -4.818   7.564  -7.422
  113   1HD   LYS  13          2HD       LYS  13  -7.138   8.399  -5.913
  114   2HD   LYS  13          1HD       LYS  13  -5.690   9.185  -5.284
  115   1HE   LYS  13          2HE       LYS  13  -5.099   9.957  -7.532
  116   2HE   LYS  13          1HE       LYS  13  -6.495   9.118  -8.207
  117   1HZ   LYS  13          1HZ       LYS  13  -6.373  11.588  -6.679
  118   2HZ   LYS  13          2HZ       LYS  13  -7.678  10.558  -6.332
  119   3HZ   LYS  13          3HZ       LYS  13  -7.439  11.128  -7.914
  120    H    CYS  14           H        CYS  14  -6.360   3.596  -7.269
  121    HA   CYS  14           HA       CYS  14  -4.680   3.021  -9.674
  122   1HB   CYS  14          2HB       CYS  14  -4.007   1.290  -7.448
  123   2HB   CYS  14          1HB       CYS  14  -2.949   2.339  -8.384
  124    H    SER  15           H        SER  15  -7.451   2.585  -9.561
  125    HA   SER  15           HA       SER  15  -7.797  -0.300  -8.971
  126   1HB   SER  15          2HB       SER  15  -9.468   1.690  -8.455
  127   2HB   SER  15          1HB       SER  15  -9.958   1.423 -10.124
  128    HG   SER  15           HG       SER  15  -9.645  -0.825  -8.514
  129    H    GLN  16           H        GLN  16  -6.709   1.509 -11.520
  130    HA   GLN  16           HA       GLN  16  -8.001  -0.204 -13.585
  131   1HB   GLN  16          2HB       GLN  16  -6.805   2.491 -13.549
  132   2HB   GLN  16          1HB       GLN  16  -6.336   1.518 -14.943
  133   1HG   GLN  16          2HG       GLN  16  -8.840   0.965 -15.181
  134   2HG   GLN  16          1HG       GLN  16  -9.116   2.303 -14.066
  135   1HE2  GLN  16          1HE2      GLN  16 -10.172   2.673 -16.573
  136   2HE2  GLN  16          2HE2      GLN  16  -9.236   3.765 -17.474
  137    H    CYS  17           H        CYS  17  -4.890   0.622 -12.148
  138    HA   CYS  17           HA       CYS  17  -3.569  -1.420 -13.860
  139   1HB   CYS  17          2HB       CYS  17  -2.595   0.888 -12.204
  140   2HB   CYS  17          1HB       CYS  17  -1.503  -0.459 -12.520
  141    H    HIS  18           H        HIS  18  -4.751  -0.856 -10.644
  142    HA   HIS  18           HA       HIS  18  -3.561  -3.475  -9.807
  143   1HB   HIS  18          2HB       HIS  18  -4.060  -1.022  -8.101
  144   2HB   HIS  18          1HB       HIS  18  -3.609  -2.601  -7.464
  145    HD1  HIS  18           HD1      HIS  18  -1.161  -3.289  -7.633
  146    HD2  HIS  18           HD2      HIS  18  -1.988   0.264  -9.633
  147    HE1  HIS  18           HE1      HIS  18   1.078  -2.246  -8.193
  148    H    THR  19           H        THR  19  -5.649  -4.372 -10.638
  149    HA   THR  19           HA       THR  19  -8.110  -3.563  -9.272
  150    HB   THR  19           HB       THR  19  -8.842  -5.864 -10.398
  151    HG1  THR  19           HG1      THR  19  -6.895  -6.601 -11.052
  152   1HG2  THR  19          1HG2      THR  19  -9.468  -4.624 -12.342
  153   2HG2  THR  19          2HG2      THR  19  -8.113  -3.510 -12.150
  154   3HG2  THR  19          3HG2      THR  19  -9.459  -3.468 -11.011
  155    H    VAL  20           H        VAL  20  -7.613  -3.888  -7.057
  156    HA   VAL  20           HA       VAL  20  -6.635  -6.464  -6.106
  157    HB   VAL  20           HB       VAL  20  -6.645  -5.481  -3.952
  158   1HG1  VAL  20          1HG1      VAL  20  -6.302  -2.846  -5.001
  159   2HG1  VAL  20          2HG1      VAL  20  -5.688  -3.994  -6.190
  160   3HG1  VAL  20          3HG1      VAL  20  -5.057  -4.009  -4.544
  161   1HG2  VAL  20          1HG2      VAL  20  -8.638  -4.553  -3.359
  162   2HG2  VAL  20          2HG2      VAL  20  -9.011  -4.086  -5.018
  163   3HG2  VAL  20          3HG2      VAL  20  -7.972  -3.063  -4.026
  164    H    GLU  21           H        GLU  21  -9.517  -5.815  -7.406
  165    HA   GLU  21           HA       GLU  21 -10.821  -7.992  -5.981
  166   1HB   GLU  21          2HB       GLU  21 -12.719  -6.702  -5.119
  167   2HB   GLU  21          1HB       GLU  21 -11.216  -6.105  -4.414
  168   1HG   GLU  21          2HG       GLU  21 -11.151  -4.262  -6.013
  169   2HG   GLU  21          1HG       GLU  21 -12.587  -4.883  -6.826
  170    H    LYS  22           H        LYS  22 -10.118  -6.942  -8.760
  171    HA   LYS  22           HA       LYS  22 -12.842  -6.833  -9.944
  172   1HB   LYS  22          2HB       LYS  22 -10.730  -5.281 -10.496
  173   2HB   LYS  22          1HB       LYS  22 -10.376  -6.604 -11.605
  174   1HG   LYS  22          2HG       LYS  22 -12.990  -5.069 -11.469
  175   2HG   LYS  22          1HG       LYS  22 -11.751  -4.868 -12.706
  176   1HD   LYS  22          2HD       LYS  22 -12.035  -7.221 -13.384
  177   2HD   LYS  22          1HD       LYS  22 -13.267  -7.434 -12.140
  178   1HE   LYS  22          2HE       LYS  22 -14.425  -7.021 -14.209
  179   2HE   LYS  22          1HE       LYS  22 -14.562  -5.552 -13.243
  180   1HZ   LYS  22          1HZ       LYS  22 -13.946  -5.020 -15.499
  181   2HZ   LYS  22          2HZ       LYS  22 -12.595  -6.048 -15.413
  182   3HZ   LYS  22          3HZ       LYS  22 -12.662  -4.646 -14.455
  183    H    GLY  23           H        GLY  23 -11.876  -9.314  -8.830
  184   1HA   GLY  23          2HA       GLY  23 -12.472 -11.487  -9.849
  185   2HA   GLY  23          1HA       GLY  23 -11.720 -10.926 -11.342
  186    H    GLY  24           H        GLY  24  -9.424  -9.738  -9.887
  187   1HA   GLY  24          1HA       GLY  24  -7.553 -10.542  -8.536
  188   2HA   GLY  24          2HA       GLY  24  -8.109 -12.192  -8.819
  189    H    LYS  25           H        LYS  25  -8.349 -10.363 -11.642
  190    HA   LYS  25           HA       LYS  25  -5.933 -11.702 -12.729
  191   1HB   LYS  25          2HB       LYS  25  -8.109 -11.924 -13.936
  192   2HB   LYS  25          1HB       LYS  25  -8.120 -10.177 -14.180
  193   1HG   LYS  25          2HG       LYS  25  -5.661 -10.704 -15.125
  194   2HG   LYS  25          1HG       LYS  25  -6.420 -12.259 -15.468
  195   1HD   LYS  25          2HD       LYS  25  -8.285 -11.031 -16.610
  196   2HD   LYS  25          1HD       LYS  25  -7.380  -9.534 -16.383
  197   1HE   LYS  25          2HE       LYS  25  -6.372 -11.971 -17.881
  198   2HE   LYS  25          1HE       LYS  25  -6.989 -10.500 -18.632
  199   1HZ   LYS  25          1HZ       LYS  25  -5.122  -9.630 -16.832
  200   2HZ   LYS  25          2HZ       LYS  25  -4.921  -9.742 -18.516
  201   3HZ   LYS  25          3HZ       LYS  25  -4.416 -11.015 -17.509
  202    H    HIS  26           H        HIS  26  -4.080 -10.521 -12.752
  203    HA   HIS  26           HA       HIS  26  -4.252  -7.577 -12.595
  204   1HB   HIS  26          2HB       HIS  26  -1.671  -7.854 -12.490
  205   2HB   HIS  26          1HB       HIS  26  -2.626  -8.398 -11.114
  206    HD1  HIS  26           HD1      HIS  26  -2.501 -10.416 -14.284
  207    HD2  HIS  26           HD2      HIS  26  -0.791 -10.482 -10.483
  208    HE1  HIS  26           HE1      HIS  26  -1.382 -12.673 -14.043
  209    H    LYS  27           H        LYS  27  -2.550  -6.377 -13.990
  210    HA   LYS  27           HA       LYS  27  -1.952  -7.545 -16.583
  211   1HB   LYS  27          2HB       LYS  27  -4.260  -6.990 -17.025
  212   2HB   LYS  27          1HB       LYS  27  -4.065  -5.394 -16.299
  213   1HG   LYS  27          2HG       LYS  27  -2.971  -4.540 -18.131
  214   2HG   LYS  27          1HG       LYS  27  -2.228  -6.087 -18.540
  215   1HD   LYS  27          2HD       LYS  27  -4.755  -6.776 -19.012
  216   2HD   LYS  27          1HD       LYS  27  -4.938  -5.039 -19.251
  217   1HE   LYS  27          2HE       LYS  27  -3.778  -5.071 -21.200
  218   2HE   LYS  27          1HE       LYS  27  -2.553  -6.161 -20.553
  219   1HZ   LYS  27          1HZ       LYS  27  -4.460  -7.887 -20.702
  220   2HZ   LYS  27          2HZ       LYS  27  -3.586  -7.478 -22.099
  221   3HZ   LYS  27          3HZ       LYS  27  -5.122  -6.803 -21.827
  222    H    THR  28           H        THR  28  -2.635  -4.125 -16.176
  223    HA   THR  28           HA       THR  28   0.060  -3.379 -16.844
  224    HB   THR  28           HB       THR  28  -1.937  -1.636 -15.382
  225    HG1  THR  28           HG1      THR  28  -1.728  -2.085 -18.171
  226   1HG2  THR  28          1HG2      THR  28  -0.793   0.015 -17.072
  227   2HG2  THR  28          2HG2      THR  28   0.474  -1.211 -17.118
  228   3HG2  THR  28          3HG2      THR  28   0.052  -0.437 -15.591
  229    H    GLY  29           H        GLY  29  -1.711  -2.979 -13.757
  230   1HA   GLY  29          2HA       GLY  29   0.891  -2.861 -12.339
  231   2HA   GLY  29          1HA       GLY  29  -0.667  -2.439 -11.649
  232    HA   PRO  30           HA       PRO  30   0.545  -7.021 -10.961
  233   1HB   PRO  30          2HB       PRO  30   1.729  -6.831  -8.496
  234   2HB   PRO  30          1HB       PRO  30   2.619  -6.822 -10.019
  235   1HG   PRO  30          2HG       PRO  30   1.936  -4.514  -8.239
  236   2HG   PRO  30          1HG       PRO  30   3.374  -4.771  -9.243
  237   1HD   PRO  30          2HD       PRO  30   1.268  -3.110  -9.963
  238   2HD   PRO  30          1HD       PRO  30   2.385  -3.871 -11.115
  239    H    ASN  31           H        ASN  31  -1.040  -8.196 -10.049
  240    HA   ASN  31           HA       ASN  31  -3.326  -7.133  -8.883
  241   1HB   ASN  31          2HB       ASN  31  -3.022  -9.515  -9.648
  242   2HB   ASN  31          1HB       ASN  31  -2.167  -9.831  -8.138
  243   1HD2  ASN  31          1HD2      ASN  31  -5.065  -7.763  -8.635
  244   2HD2  ASN  31          2HD2      ASN  31  -6.068  -8.659  -7.600
  245    H    LEU  32           H        LEU  32  -3.110  -5.650  -7.243
  246    HA   LEU  32           HA       LEU  32  -1.333  -6.108  -4.979
  247   1HB   LEU  32          2HB       LEU  32  -2.865  -3.904  -6.089
  248   2HB   LEU  32          1HB       LEU  32  -3.097  -4.019  -4.346
  249    HG   LEU  32           HG       LEU  32  -0.800  -3.732  -3.897
  250   1HD1  LEU  32          1HD1      LEU  32  -0.510  -4.981  -6.527
  251   2HD1  LEU  32          2HD1      LEU  32   0.603  -4.979  -5.159
  252   3HD1  LEU  32          3HD1      LEU  32   0.597  -3.629  -6.293
  253   1HD2  LEU  32          1HD2      LEU  32  -1.956  -2.008  -5.995
  254   2HD2  LEU  32          2HD2      LEU  32  -0.199  -1.919  -5.865
  255   3HD2  LEU  32          3HD2      LEU  32  -1.207  -1.564  -4.461
  256    H    HIS  33           H        HIS  33  -3.262  -8.199  -5.227
  257    HA   HIS  33           HA       HIS  33  -5.342  -7.636  -3.209
  258   1HB   HIS  33          2HB       HIS  33  -5.486  -9.124  -5.424
  259   2HB   HIS  33          1HB       HIS  33  -4.895 -10.373  -4.327
  260    HD1  HIS  33           HD1      HIS  33  -7.874 -10.103  -5.571
  261    HD2  HIS  33           HD2      HIS  33  -6.698  -9.177  -1.680
  262    HE1  HIS  33           HE1      HIS  33  -9.963 -10.230  -4.141
  263    H    GLY  34           H        GLY  34  -3.458  -7.290  -1.609
  264   1HA   GLY  34          2HA       GLY  34  -3.094  -8.521   0.549
  265   2HA   GLY  34          1HA       GLY  34  -2.700  -9.934  -0.429
  266    H    LEU  35           H        LEU  35  -1.594  -6.886  -1.609
  267    HA   LEU  35           HA       LEU  35   1.120  -7.619  -1.730
  268   1HB   LEU  35          2HB       LEU  35  -0.005  -5.647  -2.879
  269   2HB   LEU  35          1HB       LEU  35   0.151  -4.779  -1.350
  270    HG   LEU  35           HG       LEU  35   2.636  -5.355  -1.429
  271   1HD1  LEU  35          1HD1      LEU  35   1.837  -6.080  -4.264
  272   2HD1  LEU  35          2HD1      LEU  35   2.554  -7.154  -3.063
  273   3HD1  LEU  35          3HD1      LEU  35   3.501  -5.827  -3.736
  274   1HD2  LEU  35          1HD2      LEU  35   1.180  -3.485  -3.256
  275   2HD2  LEU  35          2HD2      LEU  35   2.923  -3.653  -3.465
  276   3HD2  LEU  35          3HD2      LEU  35   2.267  -3.121  -1.916
  277    H    PHE  36           H        PHE  36  -0.722  -6.248   0.925
  278    HA   PHE  36           HA       PHE  36   1.548  -5.469   2.530
  279   1HB   PHE  36          2HB       PHE  36  -1.351  -6.046   3.150
  280   2HB   PHE  36          1HB       PHE  36  -0.197  -5.643   4.420
  281    HD1  PHE  36           HD1      PHE  36  -0.029  -3.404   5.013
  282    HD2  PHE  36           HD2      PHE  36  -1.144  -4.422   0.992
  283    HE1  PHE  36           HE1      PHE  36  -0.273  -0.996   4.471
  284    HE2  PHE  36           HE2      PHE  36  -1.387  -2.015   0.449
  285    HZ   PHE  36           HZ       PHE  36  -0.953  -0.302   2.189
  286    H    GLY  37           H        GLY  37   2.778  -6.697   3.918
  287   1HA   GLY  37          2HA       GLY  37   3.440  -8.559   5.211
  288   2HA   GLY  37          1HA       GLY  37   1.857  -9.277   4.913
  289    H    ARG  38           H        ARG  38   3.409  -8.235   2.056
  290    HA   ARG  38           HA       ARG  38   4.863 -10.756   1.619
  291   1HB   ARG  38          2HB       ARG  38   2.668 -11.540   1.054
  292   2HB   ARG  38          1HB       ARG  38   2.309 -10.071   0.145
  293   1HG   ARG  38          2HG       ARG  38   4.129 -10.651  -1.454
  294   2HG   ARG  38          1HG       ARG  38   4.387 -12.159  -0.576
  295   1HD   ARG  38          2HD       ARG  38   2.946 -12.805  -2.318
  296   2HD   ARG  38          1HD       ARG  38   1.844 -12.556  -0.964
  297    HE   ARG  38           HE       ARG  38   0.850 -10.870  -2.258
  298   1HH1  ARG  38          1HH1      ARG  38   3.180  -9.020  -2.044
  299   2HH1  ARG  38          2HH1      ARG  38   3.608  -8.770  -3.703
  300   1HH2  ARG  38          1HH2      ARG  38   1.827 -11.511  -4.854
  301   2HH2  ARG  38          2HH2      ARG  38   2.844 -10.179  -5.292
  302    H    LYS  39           H        LYS  39   6.650 -10.195   0.468
  303    HA   LYS  39           HA       LYS  39   7.022  -7.589  -0.643
  304   1HB   LYS  39          2HB       LYS  39   8.488 -10.187  -1.165
  305   2HB   LYS  39          1HB       LYS  39   9.018  -8.624  -1.777
  306   1HG   LYS  39          2HG       LYS  39  10.111  -8.355   0.174
  307   2HG   LYS  39          1HG       LYS  39   8.527  -8.149   0.922
  308   1HD   LYS  39          2HD       LYS  39   8.401 -10.440   1.544
  309   2HD   LYS  39          1HD       LYS  39   9.732 -10.884   0.473
  310   1HE   LYS  39          2HE       LYS  39  11.132 -10.625   2.217
  311   2HE   LYS  39          1HE       LYS  39  10.773  -8.899   2.177
  312   1HZ   LYS  39          1HZ       LYS  39   8.678  -9.628   3.491
  313   2HZ   LYS  39          2HZ       LYS  39  10.161  -9.460   4.300
  314   3HZ   LYS  39          3HZ       LYS  39   9.600 -11.002   3.863
  315    H    THR  40           H        THR  40   7.456  -7.179  -3.003
  316    HA   THR  40           HA       THR  40   5.344  -8.537  -4.609
  317    HB   THR  40           HB       THR  40   5.413  -5.989  -4.311
  318    HG1  THR  40           HG1      THR  40   4.483  -7.388  -6.115
  319   1HG2  THR  40          1HG2      THR  40   6.971  -4.743  -5.626
  320   2HG2  THR  40          2HG2      THR  40   7.564  -6.199  -6.424
  321   3HG2  THR  40          3HG2      THR  40   7.925  -5.918  -4.721
  322    H    GLY  41           H        GLY  41   5.891  -8.722  -7.022
  323   1HA   GLY  41          1HA       GLY  41   7.421  -9.250  -8.774
  324   2HA   GLY  41          2HA       GLY  41   8.746  -9.157  -7.613
  325    H    GLN  42           H        GLN  42   5.843 -11.167  -8.272
  326    HA   GLN  42           HA       GLN  42   7.486 -13.582  -8.194
  327   1HB   GLN  42          2HB       GLN  42   6.171 -14.606  -6.293
  328   2HB   GLN  42          1HB       GLN  42   7.282 -13.323  -5.815
  329   1HG   GLN  42          2HG       GLN  42   4.470 -12.581  -6.526
  330   2HG   GLN  42          1HG       GLN  42   4.775 -13.323  -4.954
  331   1HE2  GLN  42          1HE2      GLN  42   7.073 -12.259  -4.031
  332   2HE2  GLN  42          2HE2      GLN  42   7.026 -10.563  -3.996
  333    H    ALA  43           H        ALA  43   4.280 -12.108  -8.345
  334    HA   ALA  43           HA       ALA  43   2.532 -14.106  -8.895
  335   1HB   ALA  43          1HB       ALA  43   2.961 -11.485 -10.291
  336   2HB   ALA  43          2HB       ALA  43   1.640 -11.979  -9.231
  337   3HB   ALA  43          3HB       ALA  43   1.723 -12.592 -10.883
  338    HA   PRO  44           HA       PRO  44   4.239 -16.488 -12.193
  339   1HB   PRO  44          2HB       PRO  44   1.979 -17.958 -12.739
  340   2HB   PRO  44          1HB       PRO  44   3.033 -18.259 -11.345
  341   1HG   PRO  44          2HG       PRO  44   0.339 -16.986 -11.419
  342   2HG   PRO  44          1HG       PRO  44   1.133 -17.857 -10.096
  343   1HD   PRO  44          2HD       PRO  44   0.906 -15.044 -10.328
  344   2HD   PRO  44          1HD       PRO  44   1.970 -15.918  -9.204
  345    H    GLY  45           H        GLY  45   4.491 -15.913 -14.315
  346   1HA   GLY  45          2HA       GLY  45   3.790 -15.418 -16.542
  347   2HA   GLY  45          1HA       GLY  45   2.144 -15.192 -15.948
  348    H    TYR  46           H        TYR  46   2.502 -13.308 -13.956
  349    HA   TYR  46           HA       TYR  46   3.353 -10.951 -15.562
  350   1HB   TYR  46          2HB       TYR  46   1.054 -10.906 -14.685
  351   2HB   TYR  46          1HB       TYR  46   1.665 -11.121 -13.047
  352    HD1  TYR  46           HD1      TYR  46   3.997  -9.133 -14.821
  353    HD2  TYR  46           HD2      TYR  46   0.156  -8.920 -12.922
  354    HE1  TYR  46           HE1      TYR  46   4.237  -6.682 -14.580
  355    HE2  TYR  46           HE2      TYR  46   0.426  -6.472 -12.704
  356    HH   TYR  46           HH       TYR  46   2.903  -4.726 -14.304
  357    H    SER  47           H        SER  47   5.624 -11.943 -14.871
  358    HA   SER  47           HA       SER  47   6.528 -11.555 -12.176
  359   1HB   SER  47          2HB       SER  47   7.865 -11.781 -14.857
  360   2HB   SER  47          1HB       SER  47   8.814 -11.231 -13.478
  361    HG   SER  47           HG       SER  47   8.562 -13.144 -12.525
  362    H    TYR  48           H        TYR  48   5.852  -9.524 -11.399
  363    HA   TYR  48           HA       TYR  48   5.835  -7.087 -12.764
  364   1HB   TYR  48          2HB       TYR  48   6.747  -7.210  -9.902
  365   2HB   TYR  48          1HB       TYR  48   5.742  -5.994 -10.685
  366    HD1  TYR  48           HD1      TYR  48   4.113  -8.281 -12.213
  367    HD2  TYR  48           HD2      TYR  48   5.099  -7.454  -8.132
  368    HE1  TYR  48           HE1      TYR  48   2.073  -9.486 -11.478
  369    HE2  TYR  48           HE2      TYR  48   3.063  -8.658  -7.382
  370    HH   TYR  48           HH       TYR  48   0.759  -9.215  -8.470
  371    H    THR  49           H        THR  49   7.432  -5.201 -11.949
  372    HA   THR  49           HA       THR  49   9.929  -5.675 -13.244
  373    HB   THR  49           HB       THR  49  10.631  -3.551 -11.923
  374    HG1  THR  49           HG1      THR  49   8.757  -2.466 -11.098
  375   1HG2  THR  49          1HG2      THR  49   8.634  -2.322 -13.281
  376   2HG2  THR  49          2HG2      THR  49   8.578  -3.919 -14.025
  377   3HG2  THR  49          3HG2      THR  49  10.071  -2.983 -14.059
  378    H    ALA  50           H        ALA  50  10.822  -7.550 -12.361
  379    HA   ALA  50           HA       ALA  50  11.231  -8.550  -9.908
  380   1HB   ALA  50          1HB       ALA  50  13.852  -8.561 -10.847
  381   2HB   ALA  50          2HB       ALA  50  12.877  -8.425 -12.309
  382   3HB   ALA  50          3HB       ALA  50  12.618  -9.771 -11.199
  383    H    ALA  51           H        ALA  51  12.807  -5.595 -11.064
  384    HA   ALA  51           HA       ALA  51  14.739  -5.071  -9.176
  385   1HB   ALA  51          1HB       ALA  51  13.009  -2.753  -9.299
  386   2HB   ALA  51          2HB       ALA  51  13.149  -3.490 -10.895
  387   3HB   ALA  51          3HB       ALA  51  14.598  -2.984 -10.027
  388    H    ASN  52           H        ASN  52  11.342  -4.099  -8.662
  389    HA   ASN  52           HA       ASN  52  11.315  -3.384  -6.026
  390   1HB   ASN  52          2HB       ASN  52   9.392  -4.100  -7.841
  391   2HB   ASN  52          1HB       ASN  52   9.221  -5.367  -6.625
  392   1HD2  ASN  52          1HD2      ASN  52  10.150  -3.622  -4.402
  393   2HD2  ASN  52          2HD2      ASN  52   8.879  -2.541  -4.095
  394    H    LYS  53           H        LYS  53  10.515  -6.775  -6.841
  395    HA   LYS  53           HA       LYS  53  10.720  -7.907  -4.339
  396   1HB   LYS  53          2HB       LYS  53  10.420  -8.945  -6.806
  397   2HB   LYS  53          1HB       LYS  53  12.085  -9.439  -6.496
  398   1HG   LYS  53          2HG       LYS  53  10.313  -9.868  -4.198
  399   2HG   LYS  53          1HG       LYS  53   9.831 -10.787  -5.624
  400   1HD   LYS  53          2HD       LYS  53  12.424 -11.320  -5.753
  401   2HD   LYS  53          1HD       LYS  53  12.361 -10.953  -4.030
  402   1HE   LYS  53          2HE       LYS  53  10.346 -12.565  -3.950
  403   2HE   LYS  53          1HE       LYS  53  10.885 -13.110  -5.538
  404   1HZ   LYS  53          1HZ       LYS  53  12.021 -14.519  -4.159
  405   2HZ   LYS  53          2HZ       LYS  53  12.222 -13.358  -2.934
  406   3HZ   LYS  53          3HZ       LYS  53  13.167 -13.282  -4.345
  407    H    ASN  54           H        ASN  54  13.450  -7.104  -6.466
  408    HA   ASN  54           HA       ASN  54  15.452  -8.316  -4.833
  409   1HB   ASN  54          2HB       ASN  54  15.583  -6.082  -6.865
  410   2HB   ASN  54          1HB       ASN  54  17.014  -6.749  -6.077
  411   1HD2  ASN  54          1HD2      ASN  54  16.356  -6.956  -8.964
  412   2HD2  ASN  54          2HD2      ASN  54  16.222  -8.614  -9.304
  413    H    LYS  55           H        LYS  55  14.155  -4.995  -4.892
  414    HA   LYS  55           HA       LYS  55  15.931  -3.786  -3.091
  415   1HB   LYS  55          2HB       LYS  55  14.004  -2.653  -4.249
  416   2HB   LYS  55          1HB       LYS  55  12.920  -3.417  -3.087
  417   1HG   LYS  55          2HG       LYS  55  13.363  -1.255  -2.197
  418   2HG   LYS  55          1HG       LYS  55  14.375  -2.355  -1.262
  419   1HD   LYS  55          2HD       LYS  55  16.254  -1.849  -2.885
  420   2HD   LYS  55          1HD       LYS  55  15.231  -0.581  -3.561
  421   1HE   LYS  55          2HE       LYS  55  15.141   0.573  -1.438
  422   2HE   LYS  55          1HE       LYS  55  15.967  -0.758  -0.628
  423   1HZ   LYS  55          1HZ       LYS  55  17.960  -0.155  -1.459
  424   2HZ   LYS  55          2HZ       LYS  55  17.231   1.378  -1.527
  425   3HZ   LYS  55          3HZ       LYS  55  17.320   0.414  -2.923
  426    H    GLY  56           H        GLY  56  13.661  -6.341  -2.519
  427   1HA   GLY  56          1HA       GLY  56  13.203  -7.575  -0.579
  428   2HA   GLY  56          2HA       GLY  56  14.678  -6.880   0.099
  429    H    ILE  57           H        ILE  57  11.834  -5.147  -1.076
  430    HA   ILE  57           HA       ILE  57  11.595  -3.914   1.629
  431    HB   ILE  57           HB       ILE  57  11.945  -2.454  -0.398
  432   1HG1  ILE  57          2HG1      ILE  57  10.833  -1.687   1.738
  433   2HG1  ILE  57          1HG1      ILE  57  10.346  -0.783   0.304
  434   1HG2  ILE  57          1HG2      ILE  57   9.102  -2.690  -1.161
  435   2HG2  ILE  57          2HG2      ILE  57  10.088  -4.092  -1.571
  436   3HG2  ILE  57          3HG2      ILE  57  10.530  -2.496  -2.176
  437   1HD1  ILE  57          1HD1      ILE  57   8.466  -2.723   0.253
  438   2HD1  ILE  57          2HD1      ILE  57   8.247  -1.211   1.130
  439   3HD1  ILE  57          3HD1      ILE  57   8.768  -2.660   1.988
  440    H    ILE  58           H        ILE  58   9.988  -4.679   2.889
  441    HA   ILE  58           HA       ILE  58   7.765  -6.207   1.715
  442    HB   ILE  58           HB       ILE  58   8.568  -7.039   3.822
  443   1HG1  ILE  58          2HG1      ILE  58   6.579  -7.020   5.147
  444   2HG1  ILE  58          1HG1      ILE  58   6.117  -5.422   4.562
  445   1HG2  ILE  58          1HG2      ILE  58   8.906  -4.213   4.366
  446   2HG2  ILE  58          2HG2      ILE  58   9.628  -5.596   5.190
  447   3HG2  ILE  58          3HG2      ILE  58   8.046  -4.998   5.691
  448   1HD1  ILE  58          1HD1      ILE  58   5.836  -6.361   2.279
  449   2HD1  ILE  58          2HD1      ILE  58   4.770  -7.142   3.447
  450   3HD1  ILE  58          3HD1      ILE  58   6.235  -7.961   2.905
  451    H    TRP  59           H        TRP  59   6.426  -4.816   0.599
  452    HA   TRP  59           HA       TRP  59   5.889  -2.171   0.904
  453   1HB   TRP  59          2HB       TRP  59   4.010  -4.423   0.233
  454   2HB   TRP  59          1HB       TRP  59   3.464  -2.745   0.231
  455    HD1  TRP  59           HD1      TRP  59   4.375  -5.019  -2.221
  456    HE1  TRP  59           HE1      TRP  59   5.697  -3.988  -4.176
  457    HE3  TRP  59           HE3      TRP  59   5.852  -0.621  -0.072
  458    HZ2  TRP  59           HZ2      TRP  59   7.180  -1.606  -4.749
  459    HZ3  TRP  59           HZ3      TRP  59   7.222   1.001  -1.345
  460    HH2  TRP  59           HH2      TRP  59   7.888   0.509  -3.683
  461    H    GLY  60           H        GLY  60   5.399  -0.945   2.591
  462   1HA   GLY  60          1HA       GLY  60   3.428  -1.975   4.585
  463   2HA   GLY  60          2HA       GLY  60   4.909  -1.178   5.118
  464    H    GLU  61           H        GLU  61   3.449   0.434   6.125
  465    HA   GLU  61           HA       GLU  61   1.775   2.099   4.417
  466   1HB   GLU  61          2HB       GLU  61   1.569   1.628   6.987
  467   2HB   GLU  61          1HB       GLU  61   2.738   2.941   7.139
  468   1HG   GLU  61          2HG       GLU  61   0.786   3.805   5.270
  469   2HG   GLU  61          1HG       GLU  61  -0.090   3.111   6.636
  470    H    ASP  62           H        ASP  62   4.655   2.925   6.395
  471    HA   ASP  62           HA       ASP  62   5.128   5.350   4.914
  472   1HB   ASP  62          2HB       ASP  62   7.125   3.853   6.625
  473   2HB   ASP  62          1HB       ASP  62   7.109   5.578   6.253
  474    H    THR  63           H        THR  63   6.406   2.059   4.738
  475    HA   THR  63           HA       THR  63   8.571   2.561   2.970
  476    HB   THR  63           HB       THR  63   7.308   0.063   2.296
  477    HG1  THR  63           HG1      THR  63   6.186   0.116   4.173
  478   1HG2  THR  63          1HG2      THR  63   9.361  -0.839   3.339
  479   2HG2  THR  63          2HG2      THR  63   9.710   0.753   4.011
  480   3HG2  THR  63          3HG2      THR  63   9.724   0.512   2.264
  481    H    LEU  64           H        LEU  64   5.164   1.769   2.282
  482    HA   LEU  64           HA       LEU  64   5.470   1.925  -0.588
  483   1HB   LEU  64          2HB       LEU  64   3.499   1.058   1.111
  484   2HB   LEU  64          1HB       LEU  64   2.817   2.571   0.519
  485    HG   LEU  64           HG       LEU  64   3.855   0.290  -1.186
  486   1HD1  LEU  64          1HD1      LEU  64   1.764  -0.422  -0.458
  487   2HD1  LEU  64          2HD1      LEU  64   1.315   0.500  -1.894
  488   3HD1  LEU  64          3HD1      LEU  64   1.148   1.222  -0.293
  489   1HD2  LEU  64          1HD2      LEU  64   4.199   2.007  -2.655
  490   2HD2  LEU  64          2HD2      LEU  64   3.181   3.121  -1.742
  491   3HD2  LEU  64          3HD2      LEU  64   2.446   1.950  -2.838
  492    H    MET  65           H        MET  65   4.590   4.232   1.945
  493    HA   MET  65           HA       MET  65   3.606   6.366   0.432
  494   1HB   MET  65          2HB       MET  65   3.651   6.649   2.789
  495   2HB   MET  65          1HB       MET  65   5.374   6.289   2.881
  496   1HG   MET  65          2HG       MET  65   5.965   8.426   2.396
  497   2HG   MET  65          1HG       MET  65   4.733   8.576   1.144
  498   1HE   MET  65          1HE       MET  65   3.125  11.370   2.599
  499   2HE   MET  65          2HE       MET  65   2.385  10.086   1.646
  500   3HE   MET  65          3HE       MET  65   4.050  10.562   1.326
  501    H    GLU  66           H        GLU  66   6.985   5.444   1.012
  502    HA   GLU  66           HA       GLU  66   8.128   7.608  -0.488
  503   1HB   GLU  66          2HB       GLU  66   9.281   6.028   1.198
  504   2HB   GLU  66          1HB       GLU  66   9.406   4.896  -0.148
  505   1HG   GLU  66          2HG       GLU  66  10.705   6.450  -1.443
  506   2HG   GLU  66          1HG       GLU  66  10.399   7.751  -0.292
  507    H    TYR  67           H        TYR  67   7.509   4.184  -1.331
  508    HA   TYR  67           HA       TYR  67   8.424   4.278  -3.997
  509   1HB   TYR  67          2HB       TYR  67   7.777   2.180  -2.911
  510   2HB   TYR  67          1HB       TYR  67   6.094   2.705  -2.856
  511    HD1  TYR  67           HD1      TYR  67   8.858   2.488  -5.407
  512    HD2  TYR  67           HD2      TYR  67   4.706   1.849  -4.513
  513    HE1  TYR  67           HE1      TYR  67   8.495   1.618  -7.698
  514    HE2  TYR  67           HE2      TYR  67   4.345   0.980  -6.804
  515    HH   TYR  67           HH       TYR  67   5.338   1.064  -8.979
  516    H    LEU  68           H        LEU  68   5.592   5.719  -2.588
  517    HA   LEU  68           HA       LEU  68   4.280   6.057  -5.201
  518   1HB   LEU  68          2HB       LEU  68   3.490   6.284  -2.425
  519   2HB   LEU  68          1HB       LEU  68   3.034   7.736  -3.317
  520    HG   LEU  68           HG       LEU  68   1.875   6.402  -4.992
  521   1HD1  LEU  68          1HD1      LEU  68   2.468   4.263  -5.363
  522   2HD1  LEU  68          2HD1      LEU  68   1.893   3.817  -3.757
  523   3HD1  LEU  68          3HD1      LEU  68   3.564   4.332  -3.982
  524   1HD2  LEU  68          1HD2      LEU  68   1.072   5.265  -2.307
  525   2HD2  LEU  68          2HD2      LEU  68   0.033   5.683  -3.669
  526   3HD2  LEU  68          3HD2      LEU  68   0.796   6.957  -2.719
  527    H    GLU  69           H        GLU  69   6.085   8.017  -2.862
  528    HA   GLU  69           HA       GLU  69   5.722  10.547  -4.109
  529   1HB   GLU  69          2HB       GLU  69   6.956   9.801  -1.884
  530   2HB   GLU  69          1HB       GLU  69   8.364   9.768  -2.934
  531   1HG   GLU  69          2HG       GLU  69   7.630  12.128  -3.689
  532   2HG   GLU  69          1HG       GLU  69   6.592  12.118  -2.261
  533    H    ASN  70           H        ASN  70   7.524   7.739  -4.928
  534    HA   ASN  70           HA       ASN  70   8.070   8.587  -7.600
  535   1HB   ASN  70          2HB       ASN  70  10.691   8.482  -7.142
  536   2HB   ASN  70          1HB       ASN  70   9.807  10.001  -6.993
  537   1HD2  ASN  70          1HD2      ASN  70  10.893  10.992  -5.244
  538   2HD2  ASN  70          2HD2      ASN  70  11.056  10.287  -3.709
  539    HA   PRO  71           HA       PRO  71   8.297   4.117  -6.868
  540   1HB   PRO  71          2HB       PRO  71   7.042   3.485  -9.243
  541   2HB   PRO  71          1HB       PRO  71   6.180   3.834  -7.735
  542   1HG   PRO  71          2HG       PRO  71   6.515   5.554 -10.148
  543   2HG   PRO  71          1HG       PRO  71   5.215   5.548  -8.945
  544   1HD   PRO  71          2HD       PRO  71   7.322   7.420  -9.061
  545   2HD   PRO  71          1HD       PRO  71   6.252   7.147  -7.669
  546    H    LYS  72           H        LYS  72   9.063   5.941  -9.814
  547    HA   LYS  72           HA       LYS  72  10.786   3.918 -10.928
  548   1HB   LYS  72          2HB       LYS  72   9.771   5.755 -12.273
  549   2HB   LYS  72          1HB       LYS  72  10.789   6.912 -11.415
  550   1HG   LYS  72          2HG       LYS  72  12.359   6.532 -12.988
  551   2HG   LYS  72          1HG       LYS  72  12.567   4.934 -12.271
  552   1HD   LYS  72          2HD       LYS  72  10.312   4.583 -13.810
  553   2HD   LYS  72          1HD       LYS  72  11.261   5.698 -14.794
  554   1HE   LYS  72          2HE       LYS  72  13.077   4.207 -14.955
  555   2HE   LYS  72          1HE       LYS  72  12.541   3.262 -13.566
  556   1HZ   LYS  72          1HZ       LYS  72  10.774   2.350 -14.797
  557   2HZ   LYS  72          2HZ       LYS  72  12.131   2.251 -15.815
  558   3HZ   LYS  72          3HZ       LYS  72  10.965   3.460 -16.066
  559    H    LYS  73           H        LYS  73  11.074   5.936  -8.245
  560    HA   LYS  73           HA       LYS  73  14.014   6.201  -8.417
  561   1HB   LYS  73          2HB       LYS  73  12.830   8.116  -7.536
  562   2HB   LYS  73          1HB       LYS  73  11.970   7.111  -6.371
  563   1HG   LYS  73          2HG       LYS  73  13.690   8.055  -5.081
  564   2HG   LYS  73          1HG       LYS  73  14.349   6.478  -5.513
  565   1HD   LYS  73          2HD       LYS  73  15.714   7.410  -7.237
  566   2HD   LYS  73          1HD       LYS  73  14.865   8.955  -7.168
  567   1HE   LYS  73          2HE       LYS  73  15.833   9.528  -5.089
  568   2HE   LYS  73          1HE       LYS  73  16.324   7.867  -4.762
  569   1HZ   LYS  73          1HZ       LYS  73  18.288   8.689  -5.489
  570   2HZ   LYS  73          2HZ       LYS  73  17.572   9.877  -6.469
  571   3HZ   LYS  73          3HZ       LYS  73  17.641   8.264  -6.998
  572    H    TYR  74           H        TYR  74  11.603   4.714  -6.221
  573    HA   TYR  74           HA       TYR  74  13.609   3.307  -4.675
  574   1HB   TYR  74          2HB       TYR  74  11.117   3.930  -4.090
  575   2HB   TYR  74          1HB       TYR  74  10.752   2.395  -4.878
  576    HD1  TYR  74           HD1      TYR  74  10.532   0.604  -3.420
  577    HD2  TYR  74           HD2      TYR  74  13.390   3.684  -2.528
  578    HE1  TYR  74           HE1      TYR  74  11.198  -0.612  -1.364
  579    HE2  TYR  74           HE2      TYR  74  14.056   2.470  -0.471
  580    HH   TYR  74           HH       TYR  74  13.927   0.453   0.596
  581    H    ILE  75           H        ILE  75  11.056   1.985  -6.792
  582    HA   ILE  75           HA       ILE  75  12.659  -0.420  -7.280
  583    HB   ILE  75           HB       ILE  75   9.978   0.183  -8.504
  584   1HG1  ILE  75          2HG1      ILE  75   9.717   0.880  -6.185
  585   2HG1  ILE  75          1HG1      ILE  75   8.939  -0.687  -6.393
  586   1HG2  ILE  75          1HG2      ILE  75  10.818  -1.916  -9.133
  587   2HG2  ILE  75          2HG2      ILE  75   9.737  -2.274  -7.787
  588   3HG2  ILE  75          3HG2      ILE  75  11.482  -2.224  -7.528
  589   1HD1  ILE  75          1HD1      ILE  75  10.172  -1.132  -4.493
  590   2HD1  ILE  75          2HD1      ILE  75  11.446   0.008  -4.929
  591   3HD1  ILE  75          3HD1      ILE  75  11.363  -1.564  -5.718
  592    HA   PRO  76           HA       PRO  76  13.966   1.772 -11.011
  593   1HB   PRO  76          2HB       PRO  76  16.099   0.107 -11.500
  594   2HB   PRO  76          1HB       PRO  76  16.157   1.463 -10.360
  595   1HG   PRO  76          2HG       PRO  76  15.998  -1.461  -9.794
  596   2HG   PRO  76          1HG       PRO  76  16.667  -0.159  -8.796
  597   1HD   PRO  76          2HD       PRO  76  14.143  -1.392  -8.440
  598   2HD   PRO  76          1HD       PRO  76  14.691   0.113  -7.674
  599    H    GLY  77           H        GLY  77  11.831   0.690 -11.806
  600   1HA   GLY  77          2HA       GLY  77  12.250  -0.661 -14.225
  601   2HA   GLY  77          1HA       GLY  77  11.965  -1.919 -13.022
  602    H    THR  78           H        THR  78  10.131  -0.122 -11.460
  603    HA   THR  78           HA       THR  78   7.673  -0.955 -12.508
  604    HB   THR  78           HB       THR  78   8.061   0.128 -10.229
  605    HG1  THR  78           HG1      THR  78   5.943   0.268 -11.917
  606   1HG2  THR  78          1HG2      THR  78   8.335   2.392 -10.020
  607   2HG2  THR  78          2HG2      THR  78   7.342   2.744 -11.433
  608   3HG2  THR  78          3HG2      THR  78   9.016   2.232 -11.639
  609    H    LYS  79           H        LYS  79   6.367  -0.265 -14.127
  610    HA   LYS  79           HA       LYS  79   7.338   2.031 -15.747
  611   1HB   LYS  79          2HB       LYS  79   5.166   0.062 -16.506
  612   2HB   LYS  79          1HB       LYS  79   6.110   1.101 -17.574
  613   1HG   LYS  79          2HG       LYS  79   8.116  -0.283 -16.396
  614   2HG   LYS  79          1HG       LYS  79   6.837  -1.497 -16.333
  615   1HD   LYS  79          2HD       LYS  79   7.228  -1.955 -18.501
  616   2HD   LYS  79          1HD       LYS  79   6.678  -0.328 -18.902
  617   1HE   LYS  79          2HE       LYS  79   8.823   0.511 -19.059
  618   2HE   LYS  79          1HE       LYS  79   9.471  -0.636 -17.886
  619   1HZ   LYS  79          1HZ       LYS  79   8.436  -1.801 -20.329
  620   2HZ   LYS  79          2HZ       LYS  79   9.847  -2.170 -19.458
  621   3HZ   LYS  79          3HZ       LYS  79   9.822  -0.844 -20.520
  622    H    MET  80           H        MET  80   5.487   1.796 -13.158
  623    HA   MET  80           HA       MET  80   3.086   3.129 -14.228
  624   1HB   MET  80          2HB       MET  80   2.158   2.938 -12.036
  625   2HB   MET  80          1HB       MET  80   3.053   1.458 -12.322
  626   1HG   MET  80          2HG       MET  80   4.849   2.143 -10.963
  627   2HG   MET  80          1HG       MET  80   4.276   3.785 -10.886
  628   1HE   MET  80          1HE       MET  80   3.591   4.229  -8.028
  629   2HE   MET  80          2HE       MET  80   1.867   4.181  -8.388
  630   3HE   MET  80          3HE       MET  80   3.001   4.743  -9.614
  631    H    ILE  81           H        ILE  81   2.945   5.241 -14.484
  632    HA   ILE  81           HA       ILE  81   4.871   7.011 -13.038
  633    HB   ILE  81           HB       ILE  81   3.303   7.631 -15.564
  634   1HG1  ILE  81          2HG1      ILE  81   4.925   5.764 -15.897
  635   2HG1  ILE  81          1HG1      ILE  81   5.395   7.220 -16.775
  636   1HG2  ILE  81          1HG2      ILE  81   5.827   9.021 -14.905
  637   2HG2  ILE  81          2HG2      ILE  81   4.493   9.346 -13.800
  638   3HG2  ILE  81          3HG2      ILE  81   4.311   9.674 -15.524
  639   1HD1  ILE  81          1HD1      ILE  81   6.835   7.819 -14.757
  640   2HD1  ILE  81          2HD1      ILE  81   7.381   6.433 -15.699
  641   3HD1  ILE  81          3HD1      ILE  81   6.536   6.183 -14.172
  642    H    PHE  82           H        PHE  82   2.515   5.935 -11.904
  643    HA   PHE  82           HA       PHE  82   0.211   7.565 -12.016
  644   1HB   PHE  82          2HB       PHE  82  -0.159   5.608 -10.862
  645   2HB   PHE  82          1HB       PHE  82   1.426   5.626 -10.104
  646    HD1  PHE  82           HD1      PHE  82   1.818   6.781  -8.013
  647    HD2  PHE  82           HD2      PHE  82  -2.004   6.941  -9.960
  648    HE1  PHE  82           HE1      PHE  82   0.806   7.727  -5.951
  649    HE2  PHE  82           HE2      PHE  82  -3.020   7.885  -7.901
  650    HZ   PHE  82           HZ       PHE  82  -1.615   8.276  -5.898
  651    H    VAL  83           H        VAL  83   3.232   7.971 -10.283
  652    HA   VAL  83           HA       VAL  83   2.820   9.743  -8.284
  653    HB   VAL  83           HB       VAL  83   4.854  11.040  -9.205
  654   1HG1  VAL  83          1HG1      VAL  83   4.823   8.048  -8.752
  655   2HG1  VAL  83          2HG1      VAL  83   5.160   9.310  -7.568
  656   3HG1  VAL  83          3HG1      VAL  83   6.314   8.984  -8.861
  657   1HG2  VAL  83          1HG2      VAL  83   6.003   9.820 -11.064
  658   2HG2  VAL  83          2HG2      VAL  83   4.488  10.561 -11.575
  659   3HG2  VAL  83          3HG2      VAL  83   4.561   8.828 -11.262
  660    H    GLY  84           H        GLY  84   1.145  11.187  -8.254
  661   1HA   GLY  84          2HA       GLY  84   1.352  13.551  -9.980
  662   2HA   GLY  84          1HA       GLY  84  -0.117  12.601 -10.213
  663    H    ILE  85           H        ILE  85  -0.501  11.778  -7.515
  664    HA   ILE  85           HA       ILE  85  -1.919  14.014  -6.456
  665    HB   ILE  85           HB       ILE  85  -0.905  11.604  -4.917
  666   1HG1  ILE  85          2HG1      ILE  85  -3.460  11.965  -6.517
  667   2HG1  ILE  85          1HG1      ILE  85  -2.103  10.940  -6.980
  668   1HG2  ILE  85          1HG2      ILE  85  -3.077  12.053  -3.654
  669   2HG2  ILE  85          2HG2      ILE  85  -3.142  13.599  -4.500
  670   3HG2  ILE  85          3HG2      ILE  85  -1.797  13.242  -3.416
  671   1HD1  ILE  85          1HD1      ILE  85  -4.219  10.460  -4.989
  672   2HD1  ILE  85          2HD1      ILE  85  -2.593  10.086  -4.417
  673   3HD1  ILE  85          3HD1      ILE  85  -3.219   9.305  -5.869
  674    H    LYS  86           H        LYS  86  -1.364  15.510  -4.847
  675    HA   LYS  86           HA       LYS  86   1.449  15.406  -3.845
  676   1HB   LYS  86          2HB       LYS  86   1.646  17.829  -4.192
  677   2HB   LYS  86          1HB       LYS  86   1.277  17.032  -5.721
  678   1HG   LYS  86          2HG       LYS  86  -1.236  17.512  -4.772
  679   2HG   LYS  86          1HG       LYS  86  -0.364  18.904  -4.131
  680   1HD   LYS  86          2HD       LYS  86   0.089  19.760  -6.217
  681   2HD   LYS  86          1HD       LYS  86   0.161  18.166  -6.970
  682   1HE   LYS  86          2HE       LYS  86  -2.488  18.466  -6.039
  683   2HE   LYS  86          1HE       LYS  86  -2.068  19.993  -6.817
  684   1HZ   LYS  86          1HZ       LYS  86  -2.412  18.983  -8.743
  685   2HZ   LYS  86          2HZ       LYS  86  -2.591  17.467  -7.998
  686   3HZ   LYS  86          3HZ       LYS  86  -1.048  18.020  -8.442
  687    H    LYS  87           H        LYS  87  -0.730  14.500  -2.350
  688    HA   LYS  87           HA       LYS  87  -0.839  16.604  -0.241
  689   1HB   LYS  87          2HB       LYS  87  -3.009  16.130  -1.809
  690   2HB   LYS  87          1HB       LYS  87  -3.273  14.938  -0.535
  691   1HG   LYS  87          2HG       LYS  87  -4.034  16.579   0.799
  692   2HG   LYS  87          1HG       LYS  87  -2.434  17.321   0.750
  693   1HD   LYS  87          2HD       LYS  87  -3.135  18.964  -0.632
  694   2HD   LYS  87          1HD       LYS  87  -3.951  17.818  -1.695
  695   1HE   LYS  87          2HE       LYS  87  -5.487  17.849   0.655
  696   2HE   LYS  87          1HE       LYS  87  -5.081  19.538   0.351
  697   1HZ   LYS  87          1HZ       LYS  87  -6.903  19.325  -0.968
  698   2HZ   LYS  87          2HZ       LYS  87  -6.643  17.675  -1.278
  699   3HZ   LYS  87          3HZ       LYS  87  -5.719  18.849  -2.085
  700    H    LYS  88           H        LYS  88   0.274  15.649   1.396
  701    HA   LYS  88           HA       LYS  88   0.748  12.909   1.782
  702   1HB   LYS  88          2HB       LYS  88   0.793  15.320   3.531
  703   2HB   LYS  88          1HB       LYS  88   0.790  13.752   4.338
  704   1HG   LYS  88          2HG       LYS  88   2.843  13.136   3.454
  705   2HG   LYS  88          1HG       LYS  88   2.660  14.170   2.037
  706   1HD   LYS  88          2HD       LYS  88   2.782  15.528   4.686
  707   2HD   LYS  88          1HD       LYS  88   4.280  14.823   4.080
  708   1HE   LYS  88          2HE       LYS  88   3.505  16.033   1.828
  709   2HE   LYS  88          1HE       LYS  88   2.663  17.078   2.973
  710   1HZ   LYS  88          1HZ       LYS  88   5.522  16.707   2.548
  711   2HZ   LYS  88          2HZ       LYS  88   5.014  16.934   4.154
  712   3HZ   LYS  88          3HZ       LYS  88   4.659  18.104   2.974
  713    H    GLU  89           H        GLU  89  -2.090  14.802   2.589
  714    HA   GLU  89           HA       GLU  89  -3.260  12.930   4.420
  715   1HB   GLU  89          2HB       GLU  89  -3.933  15.368   4.061
  716   2HB   GLU  89          1HB       GLU  89  -4.787  14.817   2.618
  717   1HG   GLU  89          2HG       GLU  89  -6.492  14.640   4.172
  718   2HG   GLU  89          1HG       GLU  89  -5.784  13.030   4.316
  719    H    GLU  90           H        GLU  90  -3.711  13.444   0.910
  720    HA   GLU  90           HA       GLU  90  -5.650  11.388   0.541
  721   1HB   GLU  90          2HB       GLU  90  -4.201  13.191  -1.102
  722   2HB   GLU  90          1HB       GLU  90  -3.925  11.574  -1.754
  723   1HG   GLU  90          2HG       GLU  90  -5.935  12.493  -2.772
  724   2HG   GLU  90          1HG       GLU  90  -6.397  11.181  -1.687
  725    H    ARG  91           H        ARG  91  -2.098  11.287   0.110
  726    HA   ARG  91           HA       ARG  91  -1.854   8.591  -0.636
  727   1HB   ARG  91          2HB       ARG  91  -0.050  10.355   1.033
  728   2HB   ARG  91          1HB       ARG  91   0.412   8.726   0.533
  729   1HG   ARG  91          2HG       ARG  91  -0.025   9.394  -1.845
  730   2HG   ARG  91          1HG       ARG  91  -0.303  11.044  -1.285
  731   1HD   ARG  91          2HD       ARG  91   1.986  11.051  -0.291
  732   2HD   ARG  91          1HD       ARG  91   2.257   9.449  -0.978
  733    HE   ARG  91           HE       ARG  91   2.047  10.486  -3.228
  734   1HH1  ARG  91          1HH1      ARG  91   1.000  12.940  -1.335
  735   2HH1  ARG  91          2HH1      ARG  91   2.158  14.121  -1.848
  736   1HH2  ARG  91          1HH2      ARG  91   4.144  11.829  -3.531
  737   2HH2  ARG  91          2HH2      ARG  91   3.939  13.493  -3.093
  738    H    ALA  92           H        ALA  92  -2.090   9.986   2.628
  739    HA   ALA  92           HA       ALA  92  -1.741   7.562   4.077
  740   1HB   ALA  92          1HB       ALA  92  -2.616   8.729   5.950
  741   2HB   ALA  92          2HB       ALA  92  -3.613   9.773   4.937
  742   3HB   ALA  92          3HB       ALA  92  -1.862   9.985   4.969
  743    H    ASP  93           H        ASP  93  -4.631   9.044   2.642
  744    HA   ASP  93           HA       ASP  93  -6.504   7.152   3.696
  745   1HB   ASP  93          2HB       ASP  93  -6.502   9.303   1.707
  746   2HB   ASP  93          1HB       ASP  93  -7.559   7.963   1.263
  747    H    LEU  94           H        LEU  94  -4.347   7.119   0.926
  748    HA   LEU  94           HA       LEU  94  -5.558   4.944  -0.495
  749   1HB   LEU  94          2HB       LEU  94  -2.669   5.864  -0.370
  750   2HB   LEU  94          1HB       LEU  94  -3.288   4.682  -1.522
  751    HG   LEU  94           HG       LEU  94  -4.140   7.578  -1.260
  752   1HD1  LEU  94          1HD1      LEU  94  -1.993   6.588  -2.575
  753   2HD1  LEU  94          2HD1      LEU  94  -2.918   7.971  -3.160
  754   3HD1  LEU  94          3HD1      LEU  94  -3.227   6.362  -3.815
  755   1HD2  LEU  94          1HD2      LEU  94  -5.465   5.214  -2.428
  756   2HD2  LEU  94          2HD2      LEU  94  -5.330   6.587  -3.528
  757   3HD2  LEU  94          3HD2      LEU  94  -6.144   6.776  -1.976
  758    H    ILE  95           H        ILE  95  -3.063   5.054   2.041
  759    HA   ILE  95           HA       ILE  95  -2.666   2.174   2.036
  760    HB   ILE  95           HB       ILE  95  -2.013   3.934   4.386
  761   1HG1  ILE  95          2HG1      ILE  95  -1.260   5.351   2.641
  762   2HG1  ILE  95          1HG1      ILE  95   0.168   4.418   3.086
  763   1HG2  ILE  95          1HG2      ILE  95  -1.358   1.304   3.453
  764   2HG2  ILE  95          2HG2      ILE  95  -0.840   2.095   4.943
  765   3HG2  ILE  95          3HG2      ILE  95   0.117   2.271   3.471
  766   1HD1  ILE  95          1HD1      ILE  95   0.321   3.859   0.903
  767   2HD1  ILE  95          2HD1      ILE  95  -1.300   4.462   0.562
  768   3HD1  ILE  95          3HD1      ILE  95  -1.081   2.825   1.179
  769    H    ALA  96           H        ALA  96  -4.661   4.442   3.847
  770    HA   ALA  96           HA       ALA  96  -5.495   2.758   5.953
  771   1HB   ALA  96          1HB       ALA  96  -6.700   5.100   4.532
  772   2HB   ALA  96          2HB       ALA  96  -6.231   4.939   6.225
  773   3HB   ALA  96          3HB       ALA  96  -7.712   4.178   5.644
  774    H    TYR  97           H        TYR  97  -6.945   3.171   2.705
  775    HA   TYR  97           HA       TYR  97  -9.004   1.219   3.168
  776   1HB   TYR  97          2HB       TYR  97  -9.341   2.855   1.427
  777   2HB   TYR  97          1HB       TYR  97  -7.854   2.362   0.613
  778    HD1  TYR  97           HD1      TYR  97  -8.358   1.264  -1.380
  779    HD2  TYR  97           HD2      TYR  97 -10.702   0.439   2.122
  780    HE1  TYR  97           HE1      TYR  97  -9.604  -0.482  -2.627
  781    HE2  TYR  97           HE2      TYR  97 -11.948  -1.307   0.879
  782    HH   TYR  97           HH       TYR  97 -11.253  -1.961  -2.560
  783    H    LEU  98           H        LEU  98  -5.834   1.081   1.543
  784    HA   LEU  98           HA       LEU  98  -6.107  -1.710   0.840
  785   1HB   LEU  98          2HB       LEU  98  -4.008   0.364   0.697
  786   2HB   LEU  98          1HB       LEU  98  -3.400  -1.278   0.907
  787    HG   LEU  98           HG       LEU  98  -3.581  -0.868  -1.466
  788   1HD1  LEU  98          1HD1      LEU  98  -4.501  -2.892  -1.871
  789   2HD1  LEU  98          2HD1      LEU  98  -6.084  -2.373  -1.290
  790   3HD1  LEU  98          3HD1      LEU  98  -4.868  -2.944  -0.147
  791   1HD2  LEU  98          1HD2      LEU  98  -6.299   0.181  -0.698
  792   2HD2  LEU  98          2HD2      LEU  98  -6.000  -0.400  -2.336
  793   3HD2  LEU  98          3HD2      LEU  98  -5.059   0.946  -1.691
  794    H    LYS  99           H        LYS  99  -5.659  -0.181   3.796
  795    HA   LYS  99           HA       LYS  99  -4.120  -2.431   4.935
  796   1HB   LYS  99          2HB       LYS  99  -3.534   0.004   5.434
  797   2HB   LYS  99          1HB       LYS  99  -5.024   0.064   6.376
  798   1HG   LYS  99          2HG       LYS  99  -3.365  -2.283   6.980
  799   2HG   LYS  99          1HG       LYS  99  -2.569  -0.750   7.345
  800   1HD   LYS  99          2HD       LYS  99  -5.245  -0.481   8.225
  801   2HD   LYS  99          1HD       LYS  99  -4.697  -2.062   8.784
  802   1HE   LYS  99          2HE       LYS  99  -2.704   0.085   9.108
  803   2HE   LYS  99          1HE       LYS  99  -4.168   0.309  10.066
  804   1HZ   LYS  99          1HZ       LYS  99  -3.841  -2.134  10.686
  805   2HZ   LYS  99          2HZ       LYS  99  -2.820  -0.986  11.410
  806   3HZ   LYS  99          3HZ       LYS  99  -2.255  -1.935  10.120
  807    H    LYS 100           H        LYS 100  -7.328  -1.246   4.647
  808    HA   LYS 100           HA       LYS 100  -8.228  -2.891   6.968
  809   1HB   LYS 100          2HB       LYS 100  -8.951  -0.418   6.546
  810   2HB   LYS 100          1HB       LYS 100 -10.022  -1.116   5.330
  811   1HG   LYS 100          2HG       LYS 100 -11.477  -1.688   6.943
  812   2HG   LYS 100          1HG       LYS 100 -10.243  -2.704   7.690
  813   1HD   LYS 100          2HD       LYS 100 -10.816  -1.161   9.386
  814   2HD   LYS 100          1HD       LYS 100  -9.324  -0.513   8.703
  815   1HE   LYS 100          2HE       LYS 100 -10.594   1.039   7.307
  816   2HE   LYS 100          1HE       LYS 100 -12.112   0.350   7.884
  817   1HZ   LYS 100          1HZ       LYS 100 -10.341   2.223   9.169
  818   2HZ   LYS 100          2HZ       LYS 100 -10.836   0.951  10.179
  819   3HZ   LYS 100          3HZ       LYS 100 -11.993   1.942   9.427
  820    H    ALA 101           H        ALA 101  -8.356  -2.687   3.481
  821    HA   ALA 101           HA       ALA 101 -10.457  -4.718   3.296
  822   1HB   ALA 101          1HB       ALA 101  -9.859  -2.661   1.672
  823   2HB   ALA 101          2HB       ALA 101 -10.638  -4.130   1.084
  824   3HB   ALA 101          3HB       ALA 101  -8.898  -3.919   0.894
  825    H    THR 102           H        THR 102  -6.989  -4.450   2.488
  826    HA   THR 102           HA       THR 102  -6.938  -7.435   2.301
  827    HB   THR 102           HB       THR 102  -4.548  -6.384   1.226
  828    HG1  THR 102           HG1      THR 102  -5.394  -4.952  -0.324
  829   1HG2  THR 102          1HG2      THR 102  -6.747  -8.071   0.499
  830   2HG2  THR 102          2HG2      THR 102  -5.124  -8.028  -0.192
  831   3HG2  THR 102          3HG2      THR 102  -6.391  -6.996  -0.853
  832    H    ASN 103           H        ASN 103  -6.803  -6.058   4.811
  833    HA   ASN 103           HA       ASN 103  -4.494  -7.293   5.942
  834   1HB   ASN 103          2HB       ASN 103  -3.635  -5.131   4.668
  835   2HB   ASN 103          1HB       ASN 103  -4.217  -4.317   6.120
  836   1HD2  ASN 103          1HD2      ASN 103  -3.301  -5.130   8.241
  837   2HD2  ASN 103          2HD2      ASN 103  -1.746  -5.810   8.253
  838    H    GLU 104           HN       GLU 104  -6.885  -7.656   6.861
  839    HA   GLU 104           HA       GLU 104  -7.067  -5.930   9.291
  840   1HB   GLU 104          2HB       GLU 104  -8.882  -5.626   7.377
  841   2HB   GLU 104          1HB       GLU 104  -9.561  -7.085   8.100
  842   1HG   GLU 104          2HG       GLU 104  -8.743  -4.930   9.981
  843   2HG   GLU 104          1HG       GLU 104 -10.171  -4.618   8.994
  844    HHA  HEC 105           HHA      HEC 105   4.463  -2.511  -8.997
  845    HHB  HEC 105           HHB      HEC 105   1.431   1.042  -4.763
  846    HHC  HEC 105           HHC      HEC 105  -1.814   3.841  -9.413
  847    HHD  HEC 105           HHD      HEC 105   1.147   0.216 -13.654
  848   1HMA  HEC 105          1HMA      HEC 105   3.937   0.013  -3.895
  849   2HMA  HEC 105          2HMA      HEC 105   3.863  -1.749  -3.938
  850   3HMA  HEC 105          3HMA      HEC 105   2.386  -0.809  -3.728
  851   1HAA  HEC 105          1HAA      HEC 105   4.867  -2.785  -5.290
  852   2HAA  HEC 105          2HAA      HEC 105   5.798  -2.221  -6.662
  853   1HBA  HEC 105          1HBA      HEC 105   3.672  -3.749  -7.715
  854   2HBA  HEC 105          2HBA      HEC 105   4.325  -4.669  -6.363
  855   1HMB  HEC 105          1HMB      HEC 105  -1.506   2.550  -4.129
  856   2HMB  HEC 105          2HMB      HEC 105  -0.440   3.952  -4.212
  857   3HMB  HEC 105          3HMB      HEC 105   0.232   2.351  -3.904
  858    HAB  HEC 105           HAB      HEC 105  -2.356   4.784  -7.656
  859   1HBB  HEC 105          1HBB      HEC 105  -0.840   5.705  -5.843
  860   2HBB  HEC 105          2HBB      HEC 105  -1.983   4.980  -4.712
  861   3HBB  HEC 105          3HBB      HEC 105  -2.533   6.199  -5.862
  862   1HMC  HEC 105          1HMC      HEC 105  -3.027   3.417 -12.675
  863   2HMC  HEC 105          2HMC      HEC 105  -2.605   4.269 -11.190
  864   3HMC  HEC 105          3HMC      HEC 105  -1.799   4.684 -12.704
  865    HAC  HEC 105           HAC      HEC 105   0.065   1.639 -14.709
  866   1HBC  HEC 105          1HBC      HEC 105  -0.873   3.339 -15.876
  867   2HBC  HEC 105          2HBC      HEC 105  -0.485   4.123 -14.344
  868   3HBC  HEC 105          3HBC      HEC 105  -2.141   3.618 -14.682
  869   1HMD  HEC 105          1HMD      HEC 105   3.256  -2.746 -14.138
  870   2HMD  HEC 105          2HMD      HEC 105   2.166  -1.401 -14.474
  871   3HMD  HEC 105          3HMD      HEC 105   3.904  -1.121 -14.362
  872   1HAD  HEC 105          1HAD      HEC 105   4.635  -3.701 -10.725
  873   2HAD  HEC 105          2HAD      HEC 105   4.221  -3.842 -12.427
  874   1HBD  HEC 105          1HBD      HEC 105   6.706  -3.146 -11.360
  875   2HBD  HEC 105          2HBD      HEC 105   6.045  -1.639 -11.985
  Start of MODEL   13
    1   1H    GLY   1          1HT       GLY   1 -10.596   6.084   9.619
    2   2H    GLY   1          2HT       GLY   1  -9.592   7.369  10.098
    3   3H    GLY   1          3HT       GLY   1  -9.087   6.302   8.875
    4   1HA   GLY   1          1HA       GLY   1 -10.658   8.661   8.668
    5   2HA   GLY   1          2HA       GLY   1  -9.909   7.705   7.389
    6    H    ASP   2           H        ASP   2 -11.446   7.068   5.954
    7    HA   ASP   2           HA       ASP   2 -13.892   5.769   7.011
    8   1HB   ASP   2          2HB       ASP   2 -14.266   7.712   4.767
    9   2HB   ASP   2          1HB       ASP   2 -15.415   7.190   5.999
   10    H    VAL   3           H        VAL   3 -14.732   4.214   5.589
   11    HA   VAL   3           HA       VAL   3 -12.913   3.101   3.658
   12    HB   VAL   3           HB       VAL   3 -14.522   1.690   4.838
   13   1HG1  VAL   3          1HG1      VAL   3 -16.798   2.056   4.862
   14   2HG1  VAL   3          2HG1      VAL   3 -16.805   2.787   3.257
   15   3HG1  VAL   3          3HG1      VAL   3 -16.255   3.720   4.648
   16   1HG2  VAL   3          1HG2      VAL   3 -14.186   1.768   1.985
   17   2HG2  VAL   3          2HG2      VAL   3 -15.824   1.222   2.346
   18   3HG2  VAL   3          3HG2      VAL   3 -14.439   0.362   3.019
   19    H    GLU   4           H        GLU   4 -15.880   5.046   3.365
   20    HA   GLU   4           HA       GLU   4 -16.103   4.976   0.532
   21   1HB   GLU   4          2HB       GLU   4 -17.922   5.891   1.799
   22   2HB   GLU   4          1HB       GLU   4 -16.874   7.090   2.558
   23   1HG   GLU   4          2HG       GLU   4 -16.970   7.102  -0.416
   24   2HG   GLU   4          1HG       GLU   4 -18.417   7.662   0.422
   25    H    LYS   5           H        LYS   5 -13.887   6.665   2.620
   26    HA   LYS   5           HA       LYS   5 -13.068   8.644   0.652
   27   1HB   LYS   5          2HB       LYS   5 -12.760   8.577   3.288
   28   2HB   LYS   5          1HB       LYS   5 -11.259   7.752   2.869
   29   1HG   LYS   5          2HG       LYS   5 -10.436   9.871   2.696
   30   2HG   LYS   5          1HG       LYS   5 -11.195   9.825   1.104
   31   1HD   LYS   5          2HD       LYS   5 -13.289  10.747   2.159
   32   2HD   LYS   5          1HD       LYS   5 -12.379  10.956   3.655
   33   1HE   LYS   5          2HE       LYS   5 -10.878  12.059   1.457
   34   2HE   LYS   5          1HE       LYS   5 -12.505  12.739   1.460
   35   1HZ   LYS   5          1HZ       LYS   5 -11.741  12.688   4.093
   36   2HZ   LYS   5          2HZ       LYS   5 -11.814  14.055   3.087
   37   3HZ   LYS   5          3HZ       LYS   5 -10.354  13.205   3.265
   38    H    GLY   6           H        GLY   6 -11.516   5.673   1.929
   39   1HA   GLY   6          1HA       GLY   6  -9.419   5.734  -0.068
   40   2HA   GLY   6          2HA       GLY   6  -9.784   4.379   1.001
   41    H    LYS   7           H        LYS   7 -11.951   3.245   0.395
   42    HA   LYS   7           HA       LYS   7 -11.824   1.907  -1.965
   43   1HB   LYS   7          2HB       LYS   7 -13.575   1.000  -0.916
   44   2HB   LYS   7          1HB       LYS   7 -13.753   2.416   0.089
   45   1HG   LYS   7          2HG       LYS   7 -14.988   3.465  -1.944
   46   2HG   LYS   7          1HG       LYS   7 -15.116   1.807  -2.534
   47   1HD   LYS   7          2HD       LYS   7 -15.818   1.910   0.263
   48   2HD   LYS   7          1HD       LYS   7 -16.779   3.083  -0.638
   49   1HE   LYS   7          2HE       LYS   7 -16.474   0.444  -1.940
   50   2HE   LYS   7          1HE       LYS   7 -17.414   0.440  -0.447
   51   1HZ   LYS   7          1HZ       LYS   7 -17.884   2.340  -2.675
   52   2HZ   LYS   7          2HZ       LYS   7 -18.870   2.076  -1.316
   53   3HZ   LYS   7          3HZ       LYS   7 -18.718   0.875  -2.507
   54    H    LYS   8           H        LYS   8 -13.186   5.152  -1.532
   55    HA   LYS   8           HA       LYS   8 -14.252   5.315  -4.229
   56   1HB   LYS   8          2HB       LYS   8 -15.106   6.735  -2.390
   57   2HB   LYS   8          1HB       LYS   8 -13.535   7.529  -2.280
   58   1HG   LYS   8          2HG       LYS   8 -14.136   8.950  -3.913
   59   2HG   LYS   8          1HG       LYS   8 -14.357   7.591  -5.015
   60   1HD   LYS   8          2HD       LYS   8 -16.589   7.863  -4.944
   61   2HD   LYS   8          1HD       LYS   8 -16.575   7.678  -3.189
   62   1HE   LYS   8          2HE       LYS   8 -15.778  10.138  -3.133
   63   2HE   LYS   8          1HE       LYS   8 -16.319  10.211  -4.808
   64   1HZ   LYS   8          1HZ       LYS   8 -18.468   9.182  -3.846
   65   2HZ   LYS   8          2HZ       LYS   8 -18.188  10.847  -3.662
   66   3HZ   LYS   8          3HZ       LYS   8 -17.903   9.787  -2.365
   67    H    ILE   9           H        ILE   9 -11.286   6.494  -2.647
   68    HA   ILE   9           HA       ILE   9 -10.239   7.690  -5.064
   69    HB   ILE   9           HB       ILE   9  -9.200   7.114  -2.314
   70   1HG1  ILE   9          2HG1      ILE   9  -8.473   9.640  -2.986
   71   2HG1  ILE   9          1HG1      ILE   9  -9.854   9.424  -4.062
   72   1HG2  ILE   9          1HG2      ILE   9  -7.492   7.719  -4.741
   73   2HG2  ILE   9          2HG2      ILE   9  -7.290   6.409  -3.578
   74   3HG2  ILE   9          3HG2      ILE   9  -6.968   8.074  -3.095
   75   1HD1  ILE   9          1HD1      ILE   9  -9.893   8.917  -1.072
   76   2HD1  ILE   9          2HD1      ILE   9 -11.270   8.794  -2.167
   77   3HD1  ILE   9          3HD1      ILE   9 -10.525  10.362  -1.859
   78    H    PHE  10           H        PHE  10  -8.975   4.840  -3.247
   79    HA   PHE  10           HA       PHE  10  -7.254   3.866  -5.197
   80   1HB   PHE  10          2HB       PHE  10  -7.625   2.832  -2.928
   81   2HB   PHE  10          1HB       PHE  10  -9.086   2.081  -3.573
   82    HD1  PHE  10           HD1      PHE  10  -5.530   1.800  -3.237
   83    HD2  PHE  10           HD2      PHE  10  -8.836   0.649  -5.731
   84    HE1  PHE  10           HE1      PHE  10  -4.159  -0.017  -4.223
   85    HE2  PHE  10           HE2      PHE  10  -7.454  -1.170  -6.714
   86    HZ   PHE  10           HZ       PHE  10  -5.127  -1.501  -5.962
   87    H    ILE  11           H        ILE  11 -10.784   3.385  -5.054
   88    HA   ILE  11           HA       ILE  11 -10.939   1.592  -7.271
   89    HB   ILE  11           HB       ILE  11 -12.893   3.506  -6.004
   90   1HG1  ILE  11          2HG1      ILE  11 -12.375   1.389  -4.852
   91   2HG1  ILE  11          1HG1      ILE  11 -14.031   1.368  -5.458
   92   1HG2  ILE  11          1HG2      ILE  11 -13.031   2.304  -8.685
   93   2HG2  ILE  11          2HG2      ILE  11 -14.003   3.596  -7.984
   94   3HG2  ILE  11          3HG2      ILE  11 -14.416   1.912  -7.667
   95   1HD1  ILE  11          1HD1      ILE  11 -12.916   0.302  -7.597
   96   2HD1  ILE  11          2HD1      ILE  11 -13.270  -0.705  -6.192
   97   3HD1  ILE  11          3HD1      ILE  11 -11.630  -0.117  -6.466
   98    H    MET  12           H        MET  12 -11.004   5.149  -7.119
   99    HA   MET  12           HA       MET  12 -10.922   5.176 -10.102
  100   1HB   MET  12          2HB       MET  12 -11.910   7.299 -10.058
  101   2HB   MET  12          1HB       MET  12 -12.690   6.499  -8.695
  102   1HG   MET  12          2HG       MET  12 -10.684   7.487  -7.316
  103   2HG   MET  12          1HG       MET  12 -10.540   8.603  -8.674
  104   1HE   MET  12          1HE       MET  12 -12.244  11.170  -6.704
  105   2HE   MET  12          2HE       MET  12 -10.817  10.540  -7.525
  106   3HE   MET  12          3HE       MET  12 -11.180  10.023  -5.880
  107    H    LYS  13           H        LYS  13  -8.653   4.784  -8.033
  108    HA   LYS  13           HA       LYS  13  -6.910   6.939  -9.156
  109   1HB   LYS  13          2HB       LYS  13  -7.552   6.889  -6.554
  110   2HB   LYS  13          1HB       LYS  13  -6.217   5.736  -6.517
  111   1HG   LYS  13          2HG       LYS  13  -5.076   7.745  -6.220
  112   2HG   LYS  13          1HG       LYS  13  -4.992   7.561  -7.971
  113   1HD   LYS  13          2HD       LYS  13  -7.356   8.847  -7.789
  114   2HD   LYS  13          1HD       LYS  13  -6.569   9.489  -6.345
  115   1HE   LYS  13          2HE       LYS  13  -4.743   9.435  -8.609
  116   2HE   LYS  13          1HE       LYS  13  -6.189  10.378  -8.971
  117   1HZ   LYS  13          1HZ       LYS  13  -4.356  11.643  -7.886
  118   2HZ   LYS  13          2HZ       LYS  13  -4.601  10.707  -6.488
  119   3HZ   LYS  13          3HZ       LYS  13  -5.840  11.719  -7.067
  120    H    CYS  14           H        CYS  14  -6.590   3.820  -7.392
  121    HA   CYS  14           HA       CYS  14  -4.461   3.122  -9.370
  122   1HB   CYS  14          2HB       CYS  14  -4.722   1.670  -6.767
  123   2HB   CYS  14          1HB       CYS  14  -3.277   2.015  -7.714
  124    H    SER  15           H        SER  15  -7.633   2.519  -8.881
  125    HA   SER  15           HA       SER  15  -7.513  -0.417  -9.212
  126   1HB   SER  15          2HB       SER  15  -9.326   0.991  -7.923
  127   2HB   SER  15          1HB       SER  15 -10.028   1.188  -9.525
  128    HG   SER  15           HG       SER  15  -9.304  -1.295  -8.349
  129    H    GLN  16           H        GLN  16  -6.408   1.458 -11.211
  130    HA   GLN  16           HA       GLN  16  -8.141   0.878 -13.564
  131   1HB   GLN  16          2HB       GLN  16  -6.547   3.144 -12.821
  132   2HB   GLN  16          1HB       GLN  16  -5.829   2.421 -14.262
  133   1HG   GLN  16          2HG       GLN  16  -8.788   2.670 -14.268
  134   2HG   GLN  16          1HG       GLN  16  -7.883   4.179 -14.371
  135   1HE2  GLN  16          1HE2      GLN  16  -9.269   3.608 -16.644
  136   2HE2  GLN  16          2HE2      GLN  16  -8.249   3.012 -17.863
  137    H    CYS  17           H        CYS  17  -4.696   1.033 -12.719
  138    HA   CYS  17           HA       CYS  17  -4.027  -1.080 -14.638
  139   1HB   CYS  17          2HB       CYS  17  -2.520   0.639 -12.682
  140   2HB   CYS  17          1HB       CYS  17  -1.754  -0.826 -13.297
  141    H    HIS  18           H        HIS  18  -4.667  -0.651 -11.227
  142    HA   HIS  18           HA       HIS  18  -4.074  -3.523 -10.713
  143   1HB   HIS  18          2HB       HIS  18  -4.725  -1.309  -8.746
  144   2HB   HIS  18          1HB       HIS  18  -4.271  -2.950  -8.328
  145    HD1  HIS  18           HD1      HIS  18  -1.822  -3.540  -8.329
  146    HD2  HIS  18           HD2      HIS  18  -2.550   0.246  -9.900
  147    HE1  HIS  18           HE1      HIS  18   0.431  -2.405  -8.535
  148    H    THR  19           H        THR  19  -5.688  -4.460  -9.097
  149    HA   THR  19           HA       THR  19  -8.441  -3.563  -9.183
  150    HB   THR  19           HB       THR  19  -9.238  -5.720 -10.283
  151    HG1  THR  19           HG1      THR  19  -6.793  -5.891 -11.572
  152   1HG2  THR  19          1HG2      THR  19  -9.246  -4.736 -12.389
  153   2HG2  THR  19          2HG2      THR  19  -7.575  -4.192 -12.254
  154   3HG2  THR  19          3HG2      THR  19  -8.850  -3.347 -11.377
  155    H    VAL  20           H        VAL  20  -8.262  -3.756  -6.896
  156    HA   VAL  20           HA       VAL  20  -7.335  -6.277  -5.732
  157    HB   VAL  20           HB       VAL  20  -7.565  -5.189  -3.624
  158   1HG1  VAL  20          1HG1      VAL  20  -5.762  -4.308  -5.079
  159   2HG1  VAL  20          2HG1      VAL  20  -6.384  -3.070  -3.987
  160   3HG1  VAL  20          3HG1      VAL  20  -6.868  -3.075  -5.683
  161   1HG2  VAL  20          1HG2      VAL  20  -8.762  -2.685  -4.269
  162   2HG2  VAL  20          2HG2      VAL  20  -9.397  -3.943  -3.207
  163   3HG2  VAL  20          3HG2      VAL  20  -9.807  -3.947  -4.921
  164    H    GLU  21           H        GLU  21  -9.731  -6.495  -7.413
  165    HA   GLU  21           HA       GLU  21 -11.310  -8.141  -5.686
  166   1HB   GLU  21          2HB       GLU  21 -13.314  -6.850  -5.421
  167   2HB   GLU  21          1HB       GLU  21 -11.981  -5.828  -4.884
  168   1HG   GLU  21          2HG       GLU  21 -12.547  -4.281  -6.411
  169   2HG   GLU  21          1HG       GLU  21 -12.298  -5.459  -7.701
  170    H    LYS  22           H        LYS  22 -10.133  -7.914  -8.487
  171    HA   LYS  22           HA       LYS  22 -12.613  -8.306 -10.089
  172   1HB   LYS  22          2HB       LYS  22 -10.733  -6.766 -10.883
  173   2HB   LYS  22          1HB       LYS  22  -9.775  -8.227 -11.132
  174   1HG   LYS  22          2HG       LYS  22 -10.784  -7.840 -13.237
  175   2HG   LYS  22          1HG       LYS  22 -11.793  -9.086 -12.501
  176   1HD   LYS  22          2HD       LYS  22 -12.982  -6.801 -11.561
  177   2HD   LYS  22          1HD       LYS  22 -12.448  -6.286 -13.162
  178   1HE   LYS  22          2HE       LYS  22 -13.535  -8.327 -14.124
  179   2HE   LYS  22          1HE       LYS  22 -14.162  -8.705 -12.521
  180   1HZ   LYS  22          1HZ       LYS  22 -15.770  -7.211 -12.751
  181   2HZ   LYS  22          2HZ       LYS  22 -15.339  -7.089 -14.390
  182   3HZ   LYS  22          3HZ       LYS  22 -14.693  -6.002 -13.256
  183    H    GLY  23           H        GLY  23 -11.784 -10.317  -8.164
  184   1HA   GLY  23          2HA       GLY  23 -12.006 -12.702  -8.341
  185   2HA   GLY  23          1HA       GLY  23 -11.550 -12.593 -10.041
  186    H    GLY  24           H        GLY  24  -9.191 -10.947  -9.575
  187   1HA   GLY  24          1HA       GLY  24  -7.176 -11.308  -8.020
  188   2HA   GLY  24          2HA       GLY  24  -7.449 -13.025  -8.315
  189    H    LYS  25           H        LYS  25  -8.249 -11.499 -11.133
  190    HA   LYS  25           HA       LYS  25  -5.776 -12.362 -12.432
  191   1HB   LYS  25          2HB       LYS  25  -8.051 -12.577 -13.483
  192   2HB   LYS  25          1HB       LYS  25  -8.104 -10.818 -13.615
  193   1HG   LYS  25          2HG       LYS  25  -7.225 -11.323 -15.690
  194   2HG   LYS  25          1HG       LYS  25  -5.728 -11.197 -14.764
  195   1HD   LYS  25          2HD       LYS  25  -7.108 -13.846 -14.818
  196   2HD   LYS  25          1HD       LYS  25  -6.246 -13.339 -16.270
  197   1HE   LYS  25          2HE       LYS  25  -4.419 -12.699 -14.351
  198   2HE   LYS  25          1HE       LYS  25  -5.183 -14.111 -13.620
  199   1HZ   LYS  25          1HZ       LYS  25  -3.246 -14.565 -15.130
  200   2HZ   LYS  25          2HZ       LYS  25  -4.233 -14.077 -16.425
  201   3HZ   LYS  25          3HZ       LYS  25  -4.666 -15.424 -15.483
  202    H    HIS  26           H        HIS  26  -4.111 -11.023 -13.153
  203    HA   HIS  26           HA       HIS  26  -4.472  -8.111 -12.610
  204   1HB   HIS  26          2HB       HIS  26  -1.847  -8.242 -12.413
  205   2HB   HIS  26          1HB       HIS  26  -2.871  -8.637 -11.042
  206    HD1  HIS  26           HD1      HIS  26  -2.376 -11.004 -13.948
  207    HD2  HIS  26           HD2      HIS  26  -1.123 -10.593  -9.991
  208    HE1  HIS  26           HE1      HIS  26  -1.190 -13.156 -13.347
  209    H    LYS  27           H        LYS  27  -4.845  -7.298 -14.624
  210    HA   LYS  27           HA       LYS  27  -3.448  -8.270 -16.980
  211   1HB   LYS  27          2HB       LYS  27  -5.810  -7.026 -16.698
  212   2HB   LYS  27          1HB       LYS  27  -4.804  -5.612 -17.004
  213   1HG   LYS  27          2HG       LYS  27  -5.714  -6.539 -19.108
  214   2HG   LYS  27          1HG       LYS  27  -3.954  -6.642 -19.066
  215   1HD   LYS  27          2HD       LYS  27  -4.045  -8.876 -19.296
  216   2HD   LYS  27          1HD       LYS  27  -5.062  -9.006 -17.859
  217   1HE   LYS  27          2HE       LYS  27  -6.994  -8.248 -19.419
  218   2HE   LYS  27          1HE       LYS  27  -5.906  -8.686 -20.736
  219   1HZ   LYS  27          1HZ       LYS  27  -7.372 -10.374 -18.939
  220   2HZ   LYS  27          2HZ       LYS  27  -5.730 -10.797 -19.044
  221   3HZ   LYS  27          3HZ       LYS  27  -6.686 -10.736 -20.447
  222    H    THR  28           H        THR  28  -3.610  -4.899 -15.799
  223    HA   THR  28           HA       THR  28  -0.796  -4.525 -16.643
  224    HB   THR  28           HB       THR  28  -2.849  -2.561 -15.559
  225    HG1  THR  28           HG1      THR  28  -3.474  -2.803 -17.556
  226   1HG2  THR  28          1HG2      THR  28  -1.030  -0.989 -16.707
  227   2HG2  THR  28          2HG2      THR  28   0.041  -2.323 -16.279
  228   3HG2  THR  28          3HG2      THR  28  -0.874  -1.489 -15.022
  229    H    GLY  29           H        GLY  29  -1.966  -2.692 -13.923
  230   1HA   GLY  29          2HA       GLY  29   0.185  -3.306 -12.220
  231   2HA   GLY  29          1HA       GLY  29  -1.383  -2.758 -11.647
  232    HA   PRO  30           HA       PRO  30  -0.624  -7.455 -10.957
  233   1HB   PRO  30          2HB       PRO  30   0.516  -7.402  -8.451
  234   2HB   PRO  30          1HB       PRO  30   1.440  -7.494  -9.959
  235   1HG   PRO  30          2HG       PRO  30   0.967  -5.125  -8.182
  236   2HG   PRO  30          1HG       PRO  30   2.397  -5.535  -9.149
  237   1HD   PRO  30          2HD       PRO  30   0.516  -3.653  -9.920
  238   2HD   PRO  30          1HD       PRO  30   1.559  -4.537 -11.050
  239    H    ASN  31           H        ASN  31  -1.937  -8.702  -9.478
  240    HA   ASN  31           HA       ASN  31  -4.301  -7.382  -8.567
  241   1HB   ASN  31          2HB       ASN  31  -4.501  -9.694  -9.101
  242   2HB   ASN  31          1HB       ASN  31  -3.142 -10.130  -8.063
  243   1HD2  ASN  31          1HD2      ASN  31  -6.344  -8.461  -7.717
  244   2HD2  ASN  31          2HD2      ASN  31  -6.724  -9.199  -6.236
  245    H    LEU  32           H        LEU  32  -4.006  -5.812  -7.018
  246    HA   LEU  32           HA       LEU  32  -2.185  -6.166  -4.781
  247   1HB   LEU  32          2HB       LEU  32  -3.908  -4.027  -5.849
  248   2HB   LEU  32          1HB       LEU  32  -3.780  -4.040  -4.090
  249    HG   LEU  32           HG       LEU  32  -1.384  -3.885  -4.181
  250   1HD1  LEU  32          1HD1      LEU  32  -0.512  -5.150  -5.866
  251   2HD1  LEU  32          2HD1      LEU  32  -0.563  -3.628  -6.759
  252   3HD1  LEU  32          3HD1      LEU  32  -1.860  -4.808  -6.948
  253   1HD2  LEU  32          1HD2      LEU  32  -2.725  -2.070  -6.205
  254   2HD2  LEU  32          2HD2      LEU  32  -1.074  -1.826  -5.634
  255   3HD2  LEU  32          3HD2      LEU  32  -2.421  -1.731  -4.500
  256    H    HIS  33           H        HIS  33  -3.369  -8.284  -4.151
  257    HA   HIS  33           HA       HIS  33  -5.846  -7.739  -2.594
  258   1HB   HIS  33          2HB       HIS  33  -5.595  -9.716  -4.266
  259   2HB   HIS  33          1HB       HIS  33  -4.605 -10.458  -3.009
  260    HD1  HIS  33           HD1      HIS  33  -8.075 -10.003  -4.026
  261    HD2  HIS  33           HD2      HIS  33  -6.089 -10.651  -0.419
  262    HE1  HIS  33           HE1      HIS  33  -9.831 -10.771  -2.369
  263    H    GLY  34           H        GLY  34  -2.795  -9.576  -2.199
  264   1HA   GLY  34          2HA       GLY  34  -2.942  -8.950   0.720
  265   2HA   GLY  34          1HA       GLY  34  -2.141 -10.374   0.055
  266    H    LEU  35           H        LEU  35  -1.794  -7.349  -1.610
  267    HA   LEU  35           HA       LEU  35   0.965  -7.325  -1.784
  268   1HB   LEU  35          2HB       LEU  35  -0.489  -5.691  -2.934
  269   2HB   LEU  35          1HB       LEU  35  -0.790  -4.881  -1.396
  270    HG   LEU  35           HG       LEU  35   2.053  -5.237  -1.806
  271   1HD1  LEU  35          1HD1      LEU  35   0.553  -3.687  -3.942
  272   2HD1  LEU  35          2HD1      LEU  35   1.450  -5.184  -4.201
  273   3HD1  LEU  35          3HD1      LEU  35   2.305  -3.714  -3.731
  274   1HD2  LEU  35          1HD2      LEU  35   2.083  -2.866  -1.311
  275   2HD2  LEU  35          2HD2      LEU  35   0.860  -3.617  -0.284
  276   3HD2  LEU  35          3HD2      LEU  35   0.373  -2.714  -1.719
  277    H    PHE  36           H        PHE  36  -0.999  -6.221   0.945
  278    HA   PHE  36           HA       PHE  36   1.150  -5.030   2.431
  279   1HB   PHE  36          2HB       PHE  36  -1.562  -6.123   3.152
  280   2HB   PHE  36          1HB       PHE  36  -0.447  -5.611   4.418
  281    HD1  PHE  36           HD1      PHE  36  -0.336  -4.001   1.125
  282    HD2  PHE  36           HD2      PHE  36  -1.962  -3.774   5.096
  283    HE1  PHE  36           HE1      PHE  36  -0.974  -1.637   0.729
  284    HE2  PHE  36           HE2      PHE  36  -2.599  -1.413   4.700
  285    HZ   PHE  36           HZ       PHE  36  -2.108  -0.343   2.517
  286    H    GLY  37           H        GLY  37   2.564  -5.950   3.936
  287   1HA   GLY  37          2HA       GLY  37   3.777  -7.639   5.025
  288   2HA   GLY  37          1HA       GLY  37   2.306  -8.612   4.977
  289    H    ARG  38           H        ARG  38   3.321  -7.451   1.920
  290    HA   ARG  38           HA       ARG  38   4.805  -9.974   1.357
  291   1HB   ARG  38          2HB       ARG  38   2.228  -9.865   0.687
  292   2HB   ARG  38          1HB       ARG  38   2.870  -8.970  -0.689
  293   1HG   ARG  38          2HG       ARG  38   4.433 -11.369  -0.074
  294   2HG   ARG  38          1HG       ARG  38   2.756 -11.731  -0.485
  295   1HD   ARG  38          2HD       ARG  38   4.784 -10.218  -2.139
  296   2HD   ARG  38          1HD       ARG  38   3.932 -11.702  -2.563
  297    HE   ARG  38           HE       ARG  38   1.839 -10.036  -2.315
  298   1HH1  ARG  38          1HH2      ARG  38   2.909 -10.558  -5.046
  299   2HH1  ARG  38          2HH2      ARG  38   3.258  -8.961  -5.618
  300   1HH2  ARG  38          1HH1      ARG  38   3.174  -7.522  -2.469
  301   2HH2  ARG  38          2HH1      ARG  38   3.409  -7.244  -4.162
  302    H    LYS  39           H        LYS  39   6.443  -9.731  -0.180
  303    HA   LYS  39           HA       LYS  39   7.214  -6.967  -0.774
  304   1HB   LYS  39          2HB       LYS  39   9.211  -8.047  -1.835
  305   2HB   LYS  39          1HB       LYS  39   8.969  -8.530  -0.157
  306   1HG   LYS  39          2HG       LYS  39   7.464 -10.381  -1.591
  307   2HG   LYS  39          1HG       LYS  39   8.909 -10.162  -2.579
  308   1HD   LYS  39          2HD       LYS  39  10.322 -10.565  -0.583
  309   2HD   LYS  39          1HD       LYS  39   8.868 -10.833   0.378
  310   1HE   LYS  39          2HE       LYS  39   8.569 -12.488  -1.871
  311   2HE   LYS  39          1HE       LYS  39  10.254 -12.671  -1.386
  312   1HZ   LYS  39          1HZ       LYS  39   8.148 -13.933  -0.246
  313   2HZ   LYS  39          2HZ       LYS  39   8.423 -12.646   0.828
  314   3HZ   LYS  39          3HZ       LYS  39   9.674 -13.738   0.467
  315    H    THR  40           H        THR  40   8.321  -7.018  -3.252
  316    HA   THR  40           HA       THR  40   5.923  -7.226  -4.977
  317    HB   THR  40           HB       THR  40   8.528  -6.225  -6.027
  318    HG1  THR  40           HG1      THR  40   8.693  -4.751  -4.568
  319   1HG2  THR  40          1HG2      THR  40   6.378  -4.429  -6.404
  320   2HG2  THR  40          2HG2      THR  40   5.712  -6.049  -6.621
  321   3HG2  THR  40          3HG2      THR  40   7.083  -5.520  -7.597
  322    H    GLY  41           H        GLY  41   6.757  -7.780  -7.426
  323   1HA   GLY  41          1HA       GLY  41   7.263  -9.606  -8.819
  324   2HA   GLY  41          2HA       GLY  41   8.768  -9.675  -7.901
  325    H    GLN  42           H        GLN  42   5.706 -11.187  -8.437
  326    HA   GLN  42           HA       GLN  42   6.543 -13.451  -6.764
  327   1HB   GLN  42          2HB       GLN  42   4.933 -11.486  -5.590
  328   2HB   GLN  42          1HB       GLN  42   3.815 -12.777  -6.026
  329   1HG   GLN  42          2HG       GLN  42   4.668 -13.243  -3.805
  330   2HG   GLN  42          1HG       GLN  42   5.375 -14.411  -4.923
  331   1HE2  GLN  42          1HE2      GLN  42   6.205 -11.010  -4.018
  332   2HE2  GLN  42          2HE2      GLN  42   7.843 -11.341  -3.714
  333    H    ALA  43           H        ALA  43   3.282 -12.449  -7.785
  334    HA   ALA  43           HA       ALA  43   2.350 -14.836  -8.747
  335   1HB   ALA  43          1HB       ALA  43   1.888 -12.416 -10.460
  336   2HB   ALA  43          2HB       ALA  43   1.295 -12.425  -8.800
  337   3HB   ALA  43          3HB       ALA  43   0.739 -13.648  -9.942
  338    HA   PRO  44           HA       PRO  44   5.068 -15.883 -12.089
  339   1HB   PRO  44          2HB       PRO  44   3.624 -18.046 -12.982
  340   2HB   PRO  44          1HB       PRO  44   4.658 -18.088 -11.542
  341   1HG   PRO  44          2HG       PRO  44   1.681 -17.983 -11.715
  342   2HG   PRO  44          1HG       PRO  44   2.708 -18.654 -10.438
  343   1HD   PRO  44          2HD       PRO  44   1.382 -16.160 -10.346
  344   2HD   PRO  44          1HD       PRO  44   2.682 -16.689  -9.256
  345    H    GLY  45           H        GLY  45   5.058 -15.738 -14.415
  346   1HA   GLY  45          2HA       GLY  45   4.102 -15.317 -16.559
  347   2HA   GLY  45          1HA       GLY  45   2.509 -15.230 -15.802
  348    H    TYR  46           H        TYR  46   2.719 -13.315 -13.940
  349    HA   TYR  46           HA       TYR  46   3.349 -10.887 -15.532
  350   1HB   TYR  46          2HB       TYR  46   1.066 -11.058 -14.626
  351   2HB   TYR  46          1HB       TYR  46   1.709 -11.260 -13.002
  352    HD1  TYR  46           HD1      TYR  46  -0.024  -9.200 -12.847
  353    HD2  TYR  46           HD2      TYR  46   3.846  -9.019 -14.675
  354    HE1  TYR  46           HE1      TYR  46  -0.013  -6.746 -12.576
  355    HE2  TYR  46           HE2      TYR  46   3.857  -6.561 -14.410
  356    HH   TYR  46           HH       TYR  46   2.165  -4.737 -14.176
  357    H    SER  47           H        SER  47   5.707 -11.522 -14.986
  358    HA   SER  47           HA       SER  47   6.649 -11.213 -12.274
  359   1HB   SER  47          2HB       SER  47   8.879 -10.730 -13.533
  360   2HB   SER  47          1HB       SER  47   8.165 -12.331 -13.693
  361    HG   SER  47           HG       SER  47   7.380 -10.333 -15.483
  362    H    TYR  48           H        TYR  48   5.899  -9.303 -11.372
  363    HA   TYR  48           HA       TYR  48   5.617  -6.816 -12.640
  364   1HB   TYR  48          2HB       TYR  48   6.563  -7.010  -9.793
  365   2HB   TYR  48          1HB       TYR  48   5.420  -5.868 -10.501
  366    HD1  TYR  48           HD1      TYR  48   3.990  -8.103 -12.180
  367    HD2  TYR  48           HD2      TYR  48   5.013  -7.702  -8.054
  368    HE1  TYR  48           HE1      TYR  48   2.123  -9.614 -11.557
  369    HE2  TYR  48           HE2      TYR  48   3.155  -9.201  -7.452
  370    HH   TYR  48           HH       TYR  48   1.487 -10.448  -8.162
  371    H    THR  49           H        THR  49   7.097  -4.863 -11.637
  372    HA   THR  49           HA       THR  49   9.547  -4.977 -13.070
  373    HB   THR  49           HB       THR  49   8.523  -2.837 -12.563
  374    HG1  THR  49           HG1      THR  49  10.976  -3.306 -12.340
  375   1HG2  THR  49          1HG2      THR  49   8.291  -4.017  -9.940
  376   2HG2  THR  49          2HG2      THR  49   7.493  -2.582 -10.583
  377   3HG2  THR  49          3HG2      THR  49   9.080  -2.444  -9.827
  378    H    ALA  50           H        ALA  50  10.612  -6.896 -12.353
  379    HA   ALA  50           HA       ALA  50  11.228  -7.881  -9.889
  380   1HB   ALA  50          1HB       ALA  50  12.189  -8.596 -12.159
  381   2HB   ALA  50          2HB       ALA  50  13.273  -8.730 -10.773
  382   3HB   ALA  50          3HB       ALA  50  13.435  -7.377 -11.892
  383    H    ALA  51           H        ALA  51  12.455  -4.904 -11.277
  384    HA   ALA  51           HA       ALA  51  14.569  -4.230  -9.614
  385   1HB   ALA  51          1HB       ALA  51  13.801  -2.729 -11.374
  386   2HB   ALA  51          2HB       ALA  51  13.808  -1.862  -9.842
  387   3HB   ALA  51          3HB       ALA  51  12.289  -2.444 -10.515
  388    H    ASN  52           H        ASN  52  11.176  -3.291  -8.871
  389    HA   ASN  52           HA       ASN  52  11.493  -2.403  -6.275
  390   1HB   ASN  52          2HB       ASN  52   9.332  -3.103  -7.849
  391   2HB   ASN  52          1HB       ASN  52   9.220  -4.250  -6.513
  392   1HD2  ASN  52          1HD2      ASN  52  10.255  -2.634  -4.401
  393   2HD2  ASN  52          2HD2      ASN  52   9.186  -1.342  -4.137
  394    H    LYS  53           H        LYS  53  10.928  -5.825  -7.189
  395    HA   LYS  53           HA       LYS  53  11.105  -6.983  -4.647
  396   1HB   LYS  53          2HB       LYS  53  10.587  -8.254  -6.713
  397   2HB   LYS  53          1HB       LYS  53  12.271  -8.095  -7.219
  398   1HG   LYS  53          2HG       LYS  53  12.575  -9.083  -4.688
  399   2HG   LYS  53          1HG       LYS  53  11.077  -9.872  -5.184
  400   1HD   LYS  53          2HD       LYS  53  13.693  -9.903  -6.719
  401   2HD   LYS  53          1HD       LYS  53  13.007 -11.252  -5.815
  402   1HE   LYS  53          2HE       LYS  53  11.059 -11.297  -7.291
  403   2HE   LYS  53          1HE       LYS  53  11.661  -9.886  -8.162
  404   1HZ   LYS  53          1HZ       LYS  53  13.188 -11.098  -9.253
  405   2HZ   LYS  53          2HZ       LYS  53  12.139 -12.389  -8.913
  406   3HZ   LYS  53          3HZ       LYS  53  13.502 -12.119  -7.936
  407    H    ASN  54           H        ASN  54  13.764  -6.081  -6.826
  408    HA   ASN  54           HA       ASN  54  15.877  -7.107  -5.233
  409   1HB   ASN  54          2HB       ASN  54  16.067  -6.328  -7.625
  410   2HB   ASN  54          1HB       ASN  54  15.991  -4.670  -7.028
  411   1HD2  ASN  54          1HD2      ASN  54  18.245  -4.414  -7.902
  412   2HD2  ASN  54          2HD2      ASN  54  19.556  -5.002  -6.997
  413    H    LYS  55           H        LYS  55  14.321  -3.894  -5.270
  414    HA   LYS  55           HA       LYS  55  16.003  -2.560  -3.476
  415   1HB   LYS  55          2HB       LYS  55  13.948  -1.613  -4.613
  416   2HB   LYS  55          1HB       LYS  55  12.978  -2.416  -3.377
  417   1HG   LYS  55          2HG       LYS  55  13.282  -0.275  -2.467
  418   2HG   LYS  55          1HG       LYS  55  14.564  -1.207  -1.692
  419   1HD   LYS  55          2HD       LYS  55  15.260   0.009  -4.307
  420   2HD   LYS  55          1HD       LYS  55  15.006   1.142  -2.978
  421   1HE   LYS  55          2HE       LYS  55  17.039   0.636  -2.166
  422   2HE   LYS  55          1HE       LYS  55  16.535  -1.042  -1.965
  423   1HZ   LYS  55          1HZ       LYS  55  18.457  -0.169  -3.662
  424   2HZ   LYS  55          2HZ       LYS  55  17.115  -0.346  -4.689
  425   3HZ   LYS  55          3HZ       LYS  55  17.663  -1.663  -3.765
  426    H    GLY  56           H        GLY  56  13.938  -5.286  -2.878
  427   1HA   GLY  56          1HA       GLY  56  13.669  -6.581  -0.935
  428   2HA   GLY  56          2HA       GLY  56  15.033  -5.693  -0.247
  429    H    ILE  57           H        ILE  57  11.877  -4.555  -1.421
  430    HA   ILE  57           HA       ILE  57  11.525  -3.168   1.197
  431    HB   ILE  57           HB       ILE  57  11.479  -1.890  -1.014
  432   1HG1  ILE  57          2HG1      ILE  57  10.507  -1.071   1.163
  433   2HG1  ILE  57          1HG1      ILE  57   9.703  -0.423  -0.267
  434   1HG2  ILE  57          1HG2      ILE  57   9.732  -2.169  -2.515
  435   2HG2  ILE  57          2HG2      ILE  57   8.653  -2.849  -1.298
  436   3HG2  ILE  57          3HG2      ILE  57   9.953  -3.832  -1.970
  437   1HD1  ILE  57          1HD1      ILE  57   8.273  -2.731   0.193
  438   2HD1  ILE  57          2HD1      ILE  57   7.790  -1.124   0.728
  439   3HD1  ILE  57          3HD1      ILE  57   8.651  -2.200   1.832
  440    H    ILE  58           H        ILE  58  10.083  -4.008   2.601
  441    HA   ILE  58           HA       ILE  58   8.184  -6.072   1.675
  442    HB   ILE  58           HB       ILE  58   9.226  -6.641   3.740
  443   1HG1  ILE  58          2HG1      ILE  58   7.385  -6.811   5.263
  444   2HG1  ILE  58          1HG1      ILE  58   6.631  -5.354   4.619
  445   1HG2  ILE  58          1HG2      ILE  58  10.249  -4.756   4.594
  446   2HG2  ILE  58          2HG2      ILE  58   8.865  -4.851   5.682
  447   3HG2  ILE  58          3HG2      ILE  58   8.839  -3.734   4.317
  448   1HD1  ILE  58          1HD1      ILE  58   6.304  -6.497   2.445
  449   2HD1  ILE  58          2HD1      ILE  58   5.490  -7.351   3.755
  450   3HD1  ILE  58          3HD1      ILE  58   7.019  -7.960   3.121
  451    H    TRP  59           H        TRP  59   6.525  -5.058   0.595
  452    HA   TRP  59           HA       TRP  59   5.484  -2.552   0.826
  453   1HB   TRP  59          2HB       TRP  59   3.955  -5.130   0.446
  454   2HB   TRP  59          1HB       TRP  59   3.247  -3.533   0.206
  455    HD1  TRP  59           HD1      TRP  59   4.263  -6.015  -1.931
  456    HE1  TRP  59           HE1      TRP  59   5.490  -5.191  -4.042
  457    HE3  TRP  59           HE3      TRP  59   5.557  -1.291  -0.428
  458    HZ2  TRP  59           HZ2      TRP  59   6.838  -2.854  -4.970
  459    HZ3  TRP  59           HZ3      TRP  59   6.813   0.199  -1.952
  460    HH2  TRP  59           HH2      TRP  59   7.454  -0.573  -4.217
  461    H    GLY  60           H        GLY  60   4.887  -1.387   2.518
  462   1HA   GLY  60          1HA       GLY  60   3.025  -2.534   4.509
  463   2HA   GLY  60          2HA       GLY  60   4.556  -1.909   5.125
  464    H    GLU  61           H        GLU  61   3.383  -0.230   6.276
  465    HA   GLU  61           HA       GLU  61   1.738   1.672   4.804
  466   1HB   GLU  61          2HB       GLU  61   2.964   1.885   7.573
  467   2HB   GLU  61          1HB       GLU  61   1.710   2.938   6.916
  468   1HG   GLU  61          2HG       GLU  61   0.083   1.261   6.970
  469   2HG   GLU  61          1HG       GLU  61   1.278  -0.036   6.966
  470    H    ASP  62           H        ASP  62   4.606   2.410   6.786
  471    HA   ASP  62           HA       ASP  62   5.265   4.757   5.312
  472   1HB   ASP  62          2HB       ASP  62   6.031   4.340   7.620
  473   2HB   ASP  62          1HB       ASP  62   7.054   3.025   7.039
  474    H    THR  63           H        THR  63   6.313   1.395   4.966
  475    HA   THR  63           HA       THR  63   8.465   1.880   3.153
  476    HB   THR  63           HB       THR  63   7.386  -0.597   2.443
  477    HG1  THR  63           HG1      THR  63   5.961  -0.839   3.992
  478   1HG2  THR  63          1HG2      THR  63   9.090  -1.160   4.524
  479   2HG2  THR  63          2HG2      THR  63   9.584   0.471   4.071
  480   3HG2  THR  63          3HG2      THR  63   9.599  -0.820   2.870
  481    H    LEU  64           H        LEU  64   5.116   0.811   2.492
  482    HA   LEU  64           HA       LEU  64   5.317   1.135  -0.351
  483   1HB   LEU  64          2HB       LEU  64   3.491   0.006   1.283
  484   2HB   LEU  64          1HB       LEU  64   2.679   1.538   0.963
  485    HG   LEU  64           HG       LEU  64   3.611  -0.514  -1.055
  486   1HD1  LEU  64          1HD1      LEU  64   1.227  -0.550  -1.645
  487   2HD1  LEU  64          2HD1      LEU  64   0.899   0.701  -0.446
  488   3HD1  LEU  64          3HD1      LEU  64   1.432  -0.899   0.071
  489   1HD2  LEU  64          1HD2      LEU  64   4.145   1.753  -1.870
  490   2HD2  LEU  64          2HD2      LEU  64   2.499   2.276  -1.512
  491   3HD2  LEU  64          3HD2      LEU  64   2.789   1.076  -2.772
  492    H    MET  65           H        MET  65   4.845   3.366   2.255
  493    HA   MET  65           HA       MET  65   3.547   5.463   0.793
  494   1HB   MET  65          2HB       MET  65   3.518   5.617   3.178
  495   2HB   MET  65          1HB       MET  65   5.269   5.440   3.278
  496   1HG   MET  65          2HG       MET  65   5.614   7.609   2.264
  497   2HG   MET  65          1HG       MET  65   3.891   7.772   1.920
  498   1HE   MET  65          1HE       MET  65   4.696   9.904   2.704
  499   2HE   MET  65          2HE       MET  65   5.628  10.135   4.180
  500   3HE   MET  65          3HE       MET  65   3.895  10.452   4.183
  501    H    GLU  66           H        GLU  66   6.905   4.474   1.179
  502    HA   GLU  66           HA       GLU  66   7.992   6.856  -0.050
  503   1HB   GLU  66          2HB       GLU  66   9.105   5.037   1.527
  504   2HB   GLU  66          1HB       GLU  66   9.485   4.267  -0.014
  505   1HG   GLU  66          2HG       GLU  66  10.014   7.168   0.056
  506   2HG   GLU  66          1HG       GLU  66  11.013   6.220   1.158
  507    H    TYR  67           H        TYR  67   7.675   3.453  -1.183
  508    HA   TYR  67           HA       TYR  67   8.547   3.920  -3.833
  509   1HB   TYR  67          2HB       TYR  67   8.225   1.645  -3.160
  510   2HB   TYR  67          1HB       TYR  67   6.539   1.937  -2.735
  511    HD1  TYR  67           HD1      TYR  67   5.377   0.471  -4.209
  512    HD2  TYR  67           HD2      TYR  67   8.367   3.137  -5.763
  513    HE1  TYR  67           HE1      TYR  67   4.672  -0.085  -6.518
  514    HE2  TYR  67           HE2      TYR  67   7.659   2.578  -8.070
  515    HH   TYR  67           HH       TYR  67   6.376   0.292  -9.095
  516    H    LEU  68           H        LEU  68   5.357   4.423  -2.371
  517    HA   LEU  68           HA       LEU  68   4.128   5.130  -4.917
  518   1HB   LEU  68          2HB       LEU  68   3.165   4.456  -2.399
  519   2HB   LEU  68          1HB       LEU  68   2.787   6.174  -2.542
  520    HG   LEU  68           HG       LEU  68   1.933   5.572  -4.916
  521   1HD1  LEU  68          1HD1      LEU  68   2.959   3.233  -4.722
  522   2HD1  LEU  68          2HD1      LEU  68   1.294   3.307  -5.299
  523   3HD1  LEU  68          3HD1      LEU  68   1.631   2.853  -3.628
  524   1HD2  LEU  68          1HD2      LEU  68  -0.158   5.657  -4.023
  525   2HD2  LEU  68          2HD2      LEU  68   0.699   5.877  -2.497
  526   3HD2  LEU  68          3HD2      LEU  68   0.132   4.275  -2.969
  527    H    GLU  69           H        GLU  69   5.818   6.828  -2.365
  528    HA   GLU  69           HA       GLU  69   4.947   9.476  -2.925
  529   1HB   GLU  69          2HB       GLU  69   6.569   8.490  -1.079
  530   2HB   GLU  69          1HB       GLU  69   7.812   8.886  -2.259
  531   1HG   GLU  69          2HG       GLU  69   5.918  11.066  -2.000
  532   2HG   GLU  69          1HG       GLU  69   6.612  10.653  -0.432
  533    H    ASN  70           H        ASN  70   7.048   7.255  -4.516
  534    HA   ASN  70           HA       ASN  70   7.039   8.672  -6.996
  535   1HB   ASN  70          2HB       ASN  70   8.931   9.657  -5.139
  536   2HB   ASN  70          1HB       ASN  70   9.840   8.696  -6.306
  537   1HD2  ASN  70          1HD2      ASN  70   6.829  10.518  -6.963
  538   2HD2  ASN  70          2HD2      ASN  70   7.532  11.581  -8.083
  539    HA   PRO  71           HA       PRO  71   8.066   4.285  -7.347
  540   1HB   PRO  71          2HB       PRO  71   6.820   4.003  -9.796
  541   2HB   PRO  71          1HB       PRO  71   5.975   3.877  -8.244
  542   1HG   PRO  71          2HG       PRO  71   5.945   6.108 -10.222
  543   2HG   PRO  71          1HG       PRO  71   4.721   5.650  -9.027
  544   1HD   PRO  71          2HD       PRO  71   6.541   7.794  -8.771
  545   2HD   PRO  71          1HD       PRO  71   5.569   7.097  -7.463
  546    H    LYS  72           H        LYS  72   8.577   6.941  -9.573
  547    HA   LYS  72           HA       LYS  72  10.456   5.505 -11.259
  548   1HB   LYS  72          2HB       LYS  72   9.049   7.527 -11.953
  549   2HB   LYS  72          1HB       LYS  72  10.182   8.504 -11.020
  550   1HG   LYS  72          2HG       LYS  72  12.048   7.716 -12.379
  551   2HG   LYS  72          1HG       LYS  72  10.980   6.624 -13.261
  552   1HD   LYS  72          2HD       LYS  72  10.778   8.332 -14.741
  553   2HD   LYS  72          1HD       LYS  72   9.686   9.034 -13.547
  554   1HE   LYS  72          2HE       LYS  72  12.532   9.520 -12.982
  555   2HE   LYS  72          1HE       LYS  72  11.969  10.250 -14.486
  556   1HZ   LYS  72          1HZ       LYS  72  11.200  11.864 -13.177
  557   2HZ   LYS  72          2HZ       LYS  72  11.331  10.926 -11.766
  558   3HZ   LYS  72          3HZ       LYS  72   9.960  10.785 -12.759
  559    H    LYS  73           H        LYS  73  10.593   7.169  -8.232
  560    HA   LYS  73           HA       LYS  73  13.547   7.466  -8.455
  561   1HB   LYS  73          2HB       LYS  73  13.444   9.043  -6.780
  562   2HB   LYS  73          1HB       LYS  73  11.801   9.204  -7.391
  563   1HG   LYS  73          2HG       LYS  73  11.389   8.965  -5.116
  564   2HG   LYS  73          1HG       LYS  73  11.298   7.283  -5.638
  565   1HD   LYS  73          2HD       LYS  73  13.332   6.729  -4.687
  566   2HD   LYS  73          1HD       LYS  73  13.977   8.362  -4.863
  567   1HE   LYS  73          2HE       LYS  73  11.811   8.690  -3.143
  568   2HE   LYS  73          1HE       LYS  73  12.541   7.175  -2.615
  569   1HZ   LYS  73          1HZ       LYS  73  14.383   8.209  -1.911
  570   2HZ   LYS  73          2HZ       LYS  73  13.405   9.599  -1.885
  571   3HZ   LYS  73          3HZ       LYS  73  14.417   9.291  -3.215
  572    H    TYR  74           H        TYR  74  11.070   5.584  -6.843
  573    HA   TYR  74           HA       TYR  74  12.962   4.306  -5.008
  574   1HB   TYR  74          2HB       TYR  74  10.363   4.646  -4.741
  575   2HB   TYR  74          1HB       TYR  74  10.266   3.163  -5.690
  576    HD1  TYR  74           HD1      TYR  74   9.781   1.384  -4.253
  577    HD2  TYR  74           HD2      TYR  74  12.692   4.315  -3.073
  578    HE1  TYR  74           HE1      TYR  74  10.305   0.049  -2.229
  579    HE2  TYR  74           HE2      TYR  74  13.216   2.980  -1.049
  580    HH   TYR  74           HH       TYR  74  11.604   1.061   0.355
  581    H    ILE  75           H        ILE  75  10.811   2.836  -7.458
  582    HA   ILE  75           HA       ILE  75  12.774   0.723  -7.915
  583    HB   ILE  75           HB       ILE  75  10.338   1.026  -9.610
  584   1HG1  ILE  75          2HG1      ILE  75   9.419   1.692  -7.467
  585   2HG1  ILE  75          1HG1      ILE  75   8.968   0.012  -7.745
  586   1HG2  ILE  75          1HG2      ILE  75  10.971  -1.404  -8.050
  587   2HG2  ILE  75          2HG2      ILE  75  12.179  -0.918  -9.241
  588   3HG2  ILE  75          3HG2      ILE  75  10.519  -1.241  -9.747
  589   1HD1  ILE  75          1HD1      ILE  75   9.753  -0.002  -5.526
  590   2HD1  ILE  75          2HD1      ILE  75  11.074   1.106  -5.889
  591   3HD1  ILE  75          3HD1      ILE  75  11.143  -0.563  -6.454
  592    HA   PRO  76           HA       PRO  76  14.472   3.250 -11.200
  593   1HB   PRO  76          2HB       PRO  76  16.483   1.484 -11.853
  594   2HB   PRO  76          1HB       PRO  76  16.571   2.621 -10.495
  595   1HG   PRO  76          2HG       PRO  76  16.065  -0.326 -10.451
  596   2HG   PRO  76          1HG       PRO  76  16.840   0.698  -9.231
  597   1HD   PRO  76          2HD       PRO  76  14.204  -0.247  -9.090
  598   2HD   PRO  76          1HD       PRO  76  14.849   1.123  -8.163
  599    H    GLY  77           H        GLY  77  12.485   2.804 -12.481
  600   1HA   GLY  77          2HA       GLY  77  12.169   2.242 -14.881
  601   2HA   GLY  77          1HA       GLY  77  12.988   0.714 -14.557
  602    H    THR  78           H        THR  78  10.666   1.988 -12.251
  603    HA   THR  78           HA       THR  78   9.151  -0.311 -11.970
  604    HB   THR  78           HB       THR  78   8.846   1.844 -10.666
  605    HG1  THR  78           HG1      THR  78   6.480   1.520 -10.612
  606   1HG2  THR  78          1HG2      THR  78   7.188   2.542 -13.108
  607   2HG2  THR  78          2HG2      THR  78   8.632   3.387 -12.551
  608   3HG2  THR  78          3HG2      THR  78   7.156   3.431 -11.586
  609    H    LYS  79           H        LYS  79   7.002  -0.892 -12.844
  610    HA   LYS  79           HA       LYS  79   6.918  -0.370 -15.763
  611   1HB   LYS  79          2HB       LYS  79   5.996  -2.547 -13.986
  612   2HB   LYS  79          1HB       LYS  79   4.864  -2.123 -15.270
  613   1HG   LYS  79          2HG       LYS  79   7.797  -2.789 -15.664
  614   2HG   LYS  79          1HG       LYS  79   6.444  -3.863 -16.025
  615   1HD   LYS  79          2HD       LYS  79   5.568  -1.964 -17.531
  616   2HD   LYS  79          1HD       LYS  79   7.181  -1.268 -17.381
  617   1HE   LYS  79          2HE       LYS  79   6.808  -4.144 -18.201
  618   2HE   LYS  79          1HE       LYS  79   6.734  -2.842 -19.388
  619   1HZ   LYS  79          1HZ       LYS  79   9.003  -4.016 -18.206
  620   2HZ   LYS  79          2HZ       LYS  79   8.952  -2.371 -17.782
  621   3HZ   LYS  79          3HZ       LYS  79   8.932  -2.830 -19.418
  622    H    MET  80           H        MET  80   5.710   1.071 -13.054
  623    HA   MET  80           HA       MET  80   3.189   1.826 -14.473
  624   1HB   MET  80          2HB       MET  80   2.043   1.923 -12.447
  625   2HB   MET  80          1HB       MET  80   3.136   0.579 -12.168
  626   1HG   MET  80          2HG       MET  80   4.664   2.018 -10.982
  627   2HG   MET  80          1HG       MET  80   3.661   3.414 -11.324
  628   1HE   MET  80          1HE       MET  80   3.259   4.339  -9.601
  629   2HE   MET  80          2HE       MET  80   3.054   3.700  -7.973
  630   3HE   MET  80          3HE       MET  80   1.636   4.068  -8.951
  631    H    ILE  81           H        ILE  81   3.258   3.846 -15.248
  632    HA   ILE  81           HA       ILE  81   5.263   5.746 -14.199
  633    HB   ILE  81           HB       ILE  81   3.262   6.242 -16.416
  634   1HG1  ILE  81          2HG1      ILE  81   4.441   4.155 -16.930
  635   2HG1  ILE  81          1HG1      ILE  81   5.053   5.449 -17.960
  636   1HG2  ILE  81          1HG2      ILE  81   5.618   7.471 -17.063
  637   2HG2  ILE  81          2HG2      ILE  81   5.653   7.575 -15.303
  638   3HG2  ILE  81          3HG2      ILE  81   4.297   8.260 -16.199
  639   1HD1  ILE  81          1HD1      ILE  81   6.967   4.255 -17.117
  640   2HD1  ILE  81          2HD1      ILE  81   6.350   4.322 -15.466
  641   3HD1  ILE  81          3HD1      ILE  81   6.899   5.797 -16.262
  642    H    PHE  82           H        PHE  82   3.415   5.233 -12.264
  643    HA   PHE  82           HA       PHE  82   1.077   6.851 -12.248
  644   1HB   PHE  82          2HB       PHE  82   1.652   5.052 -10.588
  645   2HB   PHE  82          1HB       PHE  82   2.821   6.156  -9.868
  646    HD1  PHE  82           HD1      PHE  82   2.058   7.205  -7.933
  647    HD2  PHE  82           HD2      PHE  82  -0.722   6.387 -11.105
  648    HE1  PHE  82           HE1      PHE  82   0.237   8.240  -6.606
  649    HE2  PHE  82           HE2      PHE  82  -2.541   7.422  -9.778
  650    HZ   PHE  82           HZ       PHE  82  -2.061   8.345  -7.528
  651    H    VAL  83           H        VAL  83   0.736   8.959 -11.296
  652    HA   VAL  83           HA       VAL  83   2.981  10.783 -11.771
  653    HB   VAL  83           HB       VAL  83   0.628  11.341 -12.413
  654   1HG1  VAL  83          1HG1      VAL  83  -0.029  12.083  -9.619
  655   2HG1  VAL  83          2HG1      VAL  83  -0.051  10.356  -9.974
  656   3HG1  VAL  83          3HG1      VAL  83  -1.075  11.459 -10.894
  657   1HG2  VAL  83          1HG2      VAL  83   1.496  13.316 -10.318
  658   2HG2  VAL  83          2HG2      VAL  83   0.885  13.617 -11.945
  659   3HG2  VAL  83          3HG2      VAL  83   2.529  13.023 -11.717
  660    H    GLY  84           H        GLY  84   2.522   8.814  -9.290
  661   1HA   GLY  84          2HA       GLY  84   3.103   8.858  -7.017
  662   2HA   GLY  84          1HA       GLY  84   4.177  10.183  -7.467
  663    H    ILE  85           H        ILE  85   2.997  10.309  -5.003
  664    HA   ILE  85           HA       ILE  85   0.856  12.366  -5.381
  665    HB   ILE  85           HB       ILE  85   1.221  10.771  -2.852
  666   1HG1  ILE  85          2HG1      ILE  85  -0.877   9.541  -4.073
  667   2HG1  ILE  85          1HG1      ILE  85   0.149   9.878  -5.469
  668   1HG2  ILE  85          1HG2      ILE  85  -0.975  11.482  -2.373
  669   2HG2  ILE  85          2HG2      ILE  85  -1.319  11.853  -4.063
  670   3HG2  ILE  85          3HG2      ILE  85  -0.244  12.896  -3.132
  671   1HD1  ILE  85          1HD1      ILE  85   1.896   8.951  -3.465
  672   2HD1  ILE  85          2HD1      ILE  85   1.384   8.081  -4.911
  673   3HD1  ILE  85          3HD1      ILE  85   0.495   7.881  -3.401
  674    H    LYS  86           H        LYS  86   0.969  14.199  -3.925
  675    HA   LYS  86           HA       LYS  86   3.594  14.486  -2.525
  676   1HB   LYS  86          2HB       LYS  86   2.234  16.405  -4.420
  677   2HB   LYS  86          1HB       LYS  86   3.431  16.954  -3.245
  678   1HG   LYS  86          2HG       LYS  86   5.090  15.403  -4.170
  679   2HG   LYS  86          1HG       LYS  86   3.896  14.783  -5.312
  680   1HD   LYS  86          2HD       LYS  86   4.773  17.682  -5.185
  681   2HD   LYS  86          1HD       LYS  86   5.439  16.497  -6.310
  682   1HE   LYS  86          2HE       LYS  86   2.847  16.088  -6.820
  683   2HE   LYS  86          1HE       LYS  86   2.733  17.758  -6.263
  684   1HZ   LYS  86          1HZ       LYS  86   3.115  17.883  -8.555
  685   2HZ   LYS  86          2HZ       LYS  86   4.322  16.689  -8.518
  686   3HZ   LYS  86          3HZ       LYS  86   4.619  18.222  -7.850
  687    H    LYS  87           H        LYS  87   0.494  14.121  -1.930
  688    HA   LYS  87           HA       LYS  87   0.406  16.271   0.150
  689   1HB   LYS  87          2HB       LYS  87  -2.163  15.577   0.044
  690   2HB   LYS  87          1HB       LYS  87  -1.493  16.750  -1.088
  691   1HG   LYS  87          2HG       LYS  87  -1.228  15.059  -2.792
  692   2HG   LYS  87          1HG       LYS  87  -1.653  13.779  -1.656
  693   1HD   LYS  87          2HD       LYS  87  -3.695  14.078  -2.708
  694   2HD   LYS  87          1HD       LYS  87  -3.863  15.223  -1.376
  695   1HE   LYS  87          2HE       LYS  87  -2.514  16.623  -3.418
  696   2HE   LYS  87          1HE       LYS  87  -3.815  15.743  -4.221
  697   1HZ   LYS  87          1HZ       LYS  87  -4.999  16.690  -1.980
  698   2HZ   LYS  87          2HZ       LYS  87  -5.105  17.399  -3.520
  699   3HZ   LYS  87          3HZ       LYS  87  -3.957  17.961  -2.400
  700    H    LYS  88           H        LYS  88   0.328  15.574   2.243
  701    HA   LYS  88           HA       LYS  88   0.715  12.800   2.868
  702   1HB   LYS  88          2HB       LYS  88   0.260  15.308   4.435
  703   2HB   LYS  88          1HB       LYS  88   0.054  13.762   5.260
  704   1HG   LYS  88          2HG       LYS  88   2.303  13.086   4.726
  705   2HG   LYS  88          1HG       LYS  88   2.517  14.464   3.643
  706   1HD   LYS  88          2HD       LYS  88   1.949  14.756   6.603
  707   2HD   LYS  88          1HD       LYS  88   3.578  14.740   5.927
  708   1HE   LYS  88          2HE       LYS  88   1.383  16.760   5.474
  709   2HE   LYS  88          1HE       LYS  88   3.027  17.039   6.046
  710   1HZ   LYS  88          1HZ       LYS  88   3.241  17.640   3.875
  711   2HZ   LYS  88          2HZ       LYS  88   2.058  16.552   3.326
  712   3HZ   LYS  88          3HZ       LYS  88   3.608  15.990   3.733
  713    H    GLU  89           H        GLU  89  -2.144  14.861   2.765
  714    HA   GLU  89           HA       GLU  89  -3.942  13.224   4.212
  715   1HB   GLU  89          2HB       GLU  89  -4.218  15.589   3.012
  716   2HB   GLU  89          1HB       GLU  89  -4.908  14.588   1.734
  717   1HG   GLU  89          2HG       GLU  89  -5.798  14.127   4.559
  718   2HG   GLU  89          1HG       GLU  89  -6.442  15.516   3.684
  719    H    GLU  90           H        GLU  90  -3.317  13.239   0.683
  720    HA   GLU  90           HA       GLU  90  -5.001  11.034   0.063
  721   1HB   GLU  90          2HB       GLU  90  -3.241  12.712  -1.342
  722   2HB   GLU  90          1HB       GLU  90  -2.623  11.080  -1.597
  723   1HG   GLU  90          2HG       GLU  90  -5.018  10.400  -2.153
  724   2HG   GLU  90          1HG       GLU  90  -5.398  12.122  -2.195
  725    H    ARG  91           H        ARG  91  -1.574  11.126   1.017
  726    HA   ARG  91           HA       ARG  91  -0.886   8.444   0.581
  727   1HB   ARG  91          2HB       ARG  91   0.776  10.032   1.346
  728   2HB   ARG  91          1HB       ARG  91  -0.093  10.277   2.861
  729   1HG   ARG  91          2HG       ARG  91   0.533   7.459   2.283
  730   2HG   ARG  91          1HG       ARG  91   1.955   8.476   2.513
  731   1HD   ARG  91          2HD       ARG  91   1.350   9.055   4.700
  732   2HD   ARG  91          1HD       ARG  91  -0.351   8.667   4.435
  733    HE   ARG  91           HE       ARG  91   0.670   6.214   4.196
  734   1HH1  ARG  91          1HH2      ARG  91   0.931   8.664   6.571
  735   2HH1  ARG  91          2HH2      ARG  91   1.737   7.657   7.727
  736   1HH2  ARG  91          1HH1      ARG  91   1.980   4.938   5.592
  737   2HH2  ARG  91          2HH1      ARG  91   2.331   5.549   7.174
  738    H    ALA  92           H        ALA  92  -2.684   9.860   3.289
  739    HA   ALA  92           HA       ALA  92  -2.828   7.422   4.811
  740   1HB   ALA  92          1HB       ALA  92  -5.083   9.017   5.420
  741   2HB   ALA  92          2HB       ALA  92  -3.767  10.135   5.057
  742   3HB   ALA  92          3HB       ALA  92  -3.568   8.918   6.317
  743    H    ASP  93           H        ASP  93  -4.950   8.931   2.402
  744    HA   ASP  93           HA       ASP  93  -7.126   7.098   2.713
  745   1HB   ASP  93          2HB       ASP  93  -6.572   9.363   1.143
  746   2HB   ASP  93          1HB       ASP  93  -6.861   8.058  -0.009
  747    H    LEU  94           H        LEU  94  -4.107   6.911   0.921
  748    HA   LEU  94           HA       LEU  94  -4.927   4.694  -0.757
  749   1HB   LEU  94          2HB       LEU  94  -2.146   5.613   0.029
  750   2HB   LEU  94          1HB       LEU  94  -2.532   4.505  -1.287
  751    HG   LEU  94           HG       LEU  94  -3.515   7.365  -1.078
  752   1HD1  LEU  94          1HD1      LEU  94  -0.982   6.484  -1.777
  753   2HD1  LEU  94          2HD1      LEU  94  -1.700   8.018  -2.267
  754   3HD1  LEU  94          3HD1      LEU  94  -1.799   6.616  -3.334
  755   1HD2  LEU  94          1HD2      LEU  94  -5.006   6.759  -2.653
  756   2HD2  LEU  94          2HD2      LEU  94  -4.411   5.100  -2.591
  757   3HD2  LEU  94          3HD2      LEU  94  -3.679   6.257  -3.701
  758    H    ILE  95           H        ILE  95  -2.569   4.780   1.946
  759    HA   ILE  95           HA       ILE  95  -2.443   1.947   2.250
  760    HB   ILE  95           HB       ILE  95  -2.100   3.947   4.493
  761   1HG1  ILE  95          2HG1      ILE  95  -0.766   4.937   2.836
  762   2HG1  ILE  95          1HG1      ILE  95   0.372   3.851   3.631
  763   1HG2  ILE  95          1HG2      ILE  95  -0.964   1.221   3.847
  764   2HG2  ILE  95          2HG2      ILE  95  -1.921   1.694   5.252
  765   3HG2  ILE  95          3HG2      ILE  95  -0.266   2.277   5.077
  766   1HD1  ILE  95          1HD1      ILE  95  -1.002   3.522   0.972
  767   2HD1  ILE  95          2HD1      ILE  95  -0.397   2.116   1.847
  768   3HD1  ILE  95          3HD1      ILE  95   0.715   3.392   1.352
  769    H    ALA  96           H        ALA  96  -4.667   4.331   3.486
  770    HA   ALA  96           HA       ALA  96  -5.879   2.792   5.548
  771   1HB   ALA  96          1HB       ALA  96  -7.882   4.312   5.099
  772   2HB   ALA  96          2HB       ALA  96  -6.923   5.028   3.805
  773   3HB   ALA  96          3HB       ALA  96  -6.363   5.126   5.473
  774    H    TYR  97           H        TYR  97  -6.848   3.176   2.117
  775    HA   TYR  97           HA       TYR  97  -9.090   1.423   2.279
  776   1HB   TYR  97          2HB       TYR  97  -8.924   2.861   0.365
  777   2HB   TYR  97          1HB       TYR  97  -7.340   2.212  -0.059
  778    HD1  TYR  97           HD1      TYR  97  -7.156   0.368  -1.495
  779    HD2  TYR  97           HD2      TYR  97 -10.920   1.195   0.385
  780    HE1  TYR  97           HE1      TYR  97  -8.216  -1.419  -2.847
  781    HE2  TYR  97           HE2      TYR  97 -11.989  -0.586  -0.973
  782    HH   TYR  97           HH       TYR  97 -11.092  -2.783  -2.155
  783    H    LEU  98           H        LEU  98  -5.727   0.774   1.241
  784    HA   LEU  98           HA       LEU  98  -6.194  -1.982   0.672
  785   1HB   LEU  98          2HB       LEU  98  -3.775  -0.302   1.184
  786   2HB   LEU  98          1HB       LEU  98  -3.589  -2.052   1.272
  787    HG   LEU  98           HG       LEU  98  -3.126  -1.428  -1.002
  788   1HD1  LEU  98          1HD1      LEU  98  -4.840  -3.346  -0.445
  789   2HD1  LEU  98          2HD1      LEU  98  -4.604  -2.846  -2.120
  790   3HD1  LEU  98          3HD1      LEU  98  -6.002  -2.266  -1.214
  791   1HD2  LEU  98          1HD2      LEU  98  -5.350  -0.306  -2.131
  792   2HD2  LEU  98          2HD2      LEU  98  -3.961   0.619  -1.563
  793   3HD2  LEU  98          3HD2      LEU  98  -5.377   0.431  -0.531
  794    H    LYS  99           H        LYS  99  -5.584  -0.290   3.681
  795    HA   LYS  99           HA       LYS  99  -4.898  -2.597   5.241
  796   1HB   LYS  99          2HB       LYS  99  -5.232   0.171   5.702
  797   2HB   LYS  99          1HB       LYS  99  -6.371  -0.641   6.778
  798   1HG   LYS  99          2HG       LYS  99  -4.264  -2.229   7.198
  799   2HG   LYS  99          1HG       LYS  99  -3.388  -0.771   6.726
  800   1HD   LYS  99          2HD       LYS  99  -3.684   0.004   8.820
  801   2HD   LYS  99          1HD       LYS  99  -5.412   0.101   8.480
  802   1HE   LYS  99          2HE       LYS  99  -5.761  -2.156   9.282
  803   2HE   LYS  99          1HE       LYS  99  -4.023  -2.413   9.444
  804   1HZ   LYS  99          1HZ       LYS  99  -5.850  -1.052  11.206
  805   2HZ   LYS  99          2HZ       LYS  99  -4.425  -0.180  10.898
  806   3HZ   LYS  99          3HZ       LYS  99  -4.342  -1.752  11.537
  807    H    LYS 100           H        LYS 100  -7.966  -1.086   4.333
  808    HA   LYS 100           HA       LYS 100  -9.537  -2.963   5.966
  809   1HB   LYS 100          2HB       LYS 100 -10.004  -0.492   4.515
  810   2HB   LYS 100          1HB       LYS 100 -11.228  -1.697   4.112
  811   1HG   LYS 100          2HG       LYS 100 -12.221  -1.426   6.113
  812   2HG   LYS 100          1HG       LYS 100 -10.702  -1.755   6.949
  813   1HD   LYS 100          2HD       LYS 100 -11.678   0.530   7.421
  814   2HD   LYS 100          1HD       LYS 100 -10.030   0.556   6.790
  815   1HE   LYS 100          2HE       LYS 100 -12.114   0.590   4.707
  816   2HE   LYS 100          1HE       LYS 100 -12.116   2.010   5.752
  817   1HZ   LYS 100          1HZ       LYS 100 -10.312   1.335   3.694
  818   2HZ   LYS 100          2HZ       LYS 100  -9.467   1.443   5.164
  819   3HZ   LYS 100          3HZ       LYS 100 -10.390   2.759   4.614
  820    H    ALA 101           H        ALA 101  -8.202  -2.837   2.804
  821    HA   ALA 101           HA       ALA 101 -10.105  -4.637   1.561
  822   1HB   ALA 101          1HB       ALA 101  -8.198  -2.922   0.600
  823   2HB   ALA 101          2HB       ALA 101  -8.969  -4.189  -0.355
  824   3HB   ALA 101          3HB       ALA 101  -7.402  -4.484   0.398
  825    H    THR 102           H        THR 102  -6.926  -4.971   3.103
  826    HA   THR 102           HA       THR 102  -7.389  -7.925   3.112
  827    HB   THR 102           HB       THR 102  -5.655  -7.143   1.394
  828    HG1  THR 102           HG1      THR 102  -5.786  -9.222   2.800
  829   1HG2  THR 102          1HG2      THR 102  -4.066  -6.640   3.927
  830   2HG2  THR 102          2HG2      THR 102  -4.660  -5.385   2.841
  831   3HG2  THR 102          3HG2      THR 102  -3.452  -6.538   2.275
  832    H    ASN 103           H        ASN 103  -5.594  -5.218   4.589
  833    HA   ASN 103           HA       ASN 103  -4.672  -6.668   6.860
  834   1HB   ASN 103          2HB       ASN 103  -4.022  -4.295   5.994
  835   2HB   ASN 103          1HB       ASN 103  -5.360  -3.746   7.002
  836   1HD2  ASN 103          1HD2      ASN 103  -2.087  -4.949   7.051
  837   2HD2  ASN 103          2HD2      ASN 103  -1.890  -4.926   8.737
  838    H    GLU 104           HN       GLU 104  -7.839  -5.733   6.023
  839    HA   GLU 104           HA       GLU 104  -8.682  -5.952   8.888
  840   1HB   GLU 104          2HB       GLU 104  -9.265  -3.816   7.638
  841   2HB   GLU 104          1HB       GLU 104 -10.312  -4.797   6.612
  842   1HG   GLU 104          2HG       GLU 104 -11.923  -4.833   8.186
  843   2HG   GLU 104          1HG       GLU 104 -10.784  -5.416   9.398
  844    HHA  HEC 105           HHA      HEC 105   3.680  -2.918  -9.229
  845    HHB  HEC 105           HHB      HEC 105   0.887   0.831  -5.002
  846    HHC  HEC 105           HHC      HEC 105  -2.013   3.962  -9.672
  847    HHD  HEC 105           HHD      HEC 105   0.600   0.058 -13.895
  848   1HMA  HEC 105          1HMA      HEC 105   3.175  -0.303  -4.103
  849   2HMA  HEC 105          2HMA      HEC 105   3.239  -2.063  -4.185
  850   3HMA  HEC 105          3HMA      HEC 105   1.691  -1.246  -3.977
  851   1HAA  HEC 105          1HAA      HEC 105   4.151  -3.167  -5.525
  852   2HAA  HEC 105          2HAA      HEC 105   5.005  -2.777  -7.005
  853   1HBA  HEC 105          1HBA      HEC 105   4.390  -4.823  -7.721
  854   2HBA  HEC 105          2HBA      HEC 105   2.770  -4.151  -7.902
  855   1HMB  HEC 105          1HMB      HEC 105  -1.842   2.351  -4.375
  856   2HMB  HEC 105          2HMB      HEC 105  -1.002   3.896  -4.472
  857   3HMB  HEC 105          3HMB      HEC 105  -0.097   2.418  -4.150
  858    HAB  HEC 105           HAB      HEC 105  -2.567   4.865  -7.949
  859   1HBB  HEC 105          1HBB      HEC 105  -2.255   6.533  -6.459
  860   2HBB  HEC 105          2HBB      HEC 105  -0.685   5.734  -6.401
  861   3HBB  HEC 105          3HBB      HEC 105  -1.873   5.440  -5.132
  862   1HMC  HEC 105          1HMC      HEC 105  -3.232   3.704 -12.899
  863   2HMC  HEC 105          2HMC      HEC 105  -2.653   4.543 -11.458
  864   3HMC  HEC 105          3HMC      HEC 105  -1.855   4.801 -13.011
  865    HAC  HEC 105           HAC      HEC 105  -0.068   1.917 -14.934
  866   1HBC  HEC 105          1HBC      HEC 105  -1.210   3.564 -16.064
  867   2HBC  HEC 105          2HBC      HEC 105  -0.841   4.282 -14.496
  868   3HBC  HEC 105          3HBC      HEC 105  -2.465   3.683 -14.831
  869   1HMD  HEC 105          1HMD      HEC 105   3.189  -2.610 -14.415
  870   2HMD  HEC 105          2HMD      HEC 105   1.431  -2.747 -14.431
  871   3HMD  HEC 105          3HMD      HEC 105   2.197  -1.196 -14.775
  872   1HAD  HEC 105          1HAD      HEC 105   3.405  -4.396 -11.461
  873   2HAD  HEC 105          2HAD      HEC 105   4.035  -3.686 -12.939
  874   1HBD  HEC 105          1HBD      HEC 105   5.990  -3.459 -11.870
  875   2HBD  HEC 105          2HBD      HEC 105   5.273  -3.876 -10.319
  Start of MODEL   14
    1   1H    GLY   1          1HT       GLY   1  -8.340   6.662   7.152
    2   2H    GLY   1          2HT       GLY   1  -9.121   5.206   7.547
    3   3H    GLY   1          3HT       GLY   1  -8.086   5.949   8.671
    4   1HA   GLY   1          1HA       GLY   1  -9.846   6.945   9.544
    5   2HA   GLY   1          2HA       GLY   1  -9.938   7.880   8.052
    6    H    ASP   2           H        ASP   2 -11.328   7.075   6.338
    7    HA   ASP   2           HA       ASP   2 -13.488   5.300   7.389
    8   1HB   ASP   2          2HB       ASP   2 -13.573   7.274   5.085
    9   2HB   ASP   2          1HB       ASP   2 -14.940   6.358   5.721
   10    H    VAL   3           H        VAL   3 -14.294   3.619   6.011
   11    HA   VAL   3           HA       VAL   3 -12.245   2.471   4.261
   12    HB   VAL   3           HB       VAL   3 -13.680   1.091   5.795
   13   1HG1  VAL   3          1HG1      VAL   3 -16.004   0.628   5.033
   14   2HG1  VAL   3          2HG1      VAL   3 -15.822   1.867   3.790
   15   3HG1  VAL   3          3HG1      VAL   3 -15.782   2.316   5.495
   16   1HG2  VAL   3          1HG2      VAL   3 -12.718  -0.256   4.169
   17   2HG2  VAL   3          2HG2      VAL   3 -13.459   0.639   2.842
   18   3HG2  VAL   3          3HG2      VAL   3 -14.423  -0.495   3.787
   19    H    GLU   4           H        GLU   4 -15.333   4.127   3.906
   20    HA   GLU   4           HA       GLU   4 -15.595   3.519   1.071
   21   1HB   GLU   4          2HB       GLU   4 -16.958   5.452   2.949
   22   2HB   GLU   4          1HB       GLU   4 -17.292   5.460   1.216
   23   1HG   GLU   4          2HG       GLU   4 -17.749   2.958   1.426
   24   2HG   GLU   4          1HG       GLU   4 -17.722   3.193   3.173
   25    H    LYS   5           H        LYS   5 -14.135   6.089   2.982
   26    HA   LYS   5           HA       LYS   5 -13.761   7.904   0.751
   27   1HB   LYS   5          2HB       LYS   5 -13.737   8.813   2.988
   28   2HB   LYS   5          1HB       LYS   5 -12.443   7.715   3.473
   29   1HG   LYS   5          2HG       LYS   5 -11.612  10.015   2.974
   30   2HG   LYS   5          1HG       LYS   5 -10.895   8.791   1.925
   31   1HD   LYS   5          2HD       LYS   5 -11.623  10.798   0.649
   32   2HD   LYS   5          1HD       LYS   5 -12.486   9.344   0.145
   33   1HE   LYS   5          2HE       LYS   5 -14.483  10.127   0.891
   34   2HE   LYS   5          1HE       LYS   5 -13.774  10.786   2.366
   35   1HZ   LYS   5          1HZ       LYS   5 -12.902  12.201   0.052
   36   2HZ   LYS   5          2HZ       LYS   5 -13.652  12.791   1.459
   37   3HZ   LYS   5          3HZ       LYS   5 -14.594  12.207   0.170
   38    H    GLY   6           H        GLY   6 -11.470   5.818   2.556
   39   1HA   GLY   6          1HA       GLY   6  -9.261   6.220   0.810
   40   2HA   GLY   6          2HA       GLY   6  -9.470   4.815   1.855
   41    H    LYS   7           H        LYS   7 -11.821   3.738   0.770
   42    HA   LYS   7           HA       LYS   7 -10.792   2.302  -1.488
   43   1HB   LYS   7          2HB       LYS   7 -12.446   1.217  -0.143
   44   2HB   LYS   7          1HB       LYS   7 -13.573   2.561  -0.322
   45   1HG   LYS   7          2HG       LYS   7 -14.123   1.988  -2.510
   46   2HG   LYS   7          1HG       LYS   7 -12.602   1.136  -2.778
   47   1HD   LYS   7          2HD       LYS   7 -14.326  -0.536  -2.584
   48   2HD   LYS   7          1HD       LYS   7 -13.379  -0.588  -1.096
   49   1HE   LYS   7          2HE       LYS   7 -15.598   1.328  -0.982
   50   2HE   LYS   7          1HE       LYS   7 -16.129  -0.336  -1.225
   51   1HZ   LYS   7          1HZ       LYS   7 -15.873  -0.507   0.972
   52   2HZ   LYS   7          2HZ       LYS   7 -14.914   0.890   1.080
   53   3HZ   LYS   7          3HZ       LYS   7 -14.211  -0.595   0.651
   54    H    LYS   8           H        LYS   8 -12.396   5.341  -1.211
   55    HA   LYS   8           HA       LYS   8 -13.500   5.383  -3.902
   56   1HB   LYS   8          2HB       LYS   8 -13.317   7.219  -1.609
   57   2HB   LYS   8          1HB       LYS   8 -13.218   8.023  -3.176
   58   1HG   LYS   8          2HG       LYS   8 -15.344   5.960  -2.605
   59   2HG   LYS   8          1HG       LYS   8 -15.573   7.657  -2.184
   60   1HD   LYS   8          2HD       LYS   8 -14.613   7.796  -4.775
   61   2HD   LYS   8          1HD       LYS   8 -15.646   6.367  -4.815
   62   1HE   LYS   8          2HE       LYS   8 -16.923   8.484  -3.311
   63   2HE   LYS   8          1HE       LYS   8 -16.476   9.058  -4.917
   64   1HZ   LYS   8          1HZ       LYS   8 -17.596   6.412  -4.913
   65   2HZ   LYS   8          2HZ       LYS   8 -17.985   7.754  -5.879
   66   3HZ   LYS   8          3HZ       LYS   8 -18.672   7.587  -4.333
   67    H    ILE   9           H        ILE   9 -10.532   6.609  -2.367
   68    HA   ILE   9           HA       ILE   9  -9.550   7.945  -4.718
   69    HB   ILE   9           HB       ILE   9  -8.107   6.836  -2.294
   70   1HG1  ILE   9          2HG1      ILE   9  -7.980   9.611  -2.323
   71   2HG1  ILE   9          1HG1      ILE   9  -9.606   9.275  -2.915
   72   1HG2  ILE   9          1HG2      ILE   9  -6.775   7.184  -4.529
   73   2HG2  ILE   9          2HG2      ILE   9  -6.129   7.854  -3.032
   74   3HG2  ILE   9          3HG2      ILE   9  -6.978   8.898  -4.171
   75   1HD1  ILE   9          1HD1      ILE   9  -8.838   9.294  -0.252
   76   2HD1  ILE   9          2HD1      ILE   9  -8.857   7.577  -0.651
   77   3HD1  ILE   9          3HD1      ILE   9 -10.305   8.555  -0.890
   78    H    PHE  10           H        PHE  10  -8.466   4.832  -3.267
   79    HA   PHE  10           HA       PHE  10  -6.839   4.007  -5.409
   80   1HB   PHE  10          2HB       PHE  10  -7.156   2.832  -3.165
   81   2HB   PHE  10          1HB       PHE  10  -8.620   2.122  -3.844
   82    HD1  PHE  10           HD1      PHE  10  -4.950   2.158  -3.931
   83    HD2  PHE  10           HD2      PHE  10  -8.496   0.538  -5.742
   84    HE1  PHE  10           HE1      PHE  10  -3.586   0.415  -5.055
   85    HE2  PHE  10           HE2      PHE  10  -7.118  -1.203  -6.864
   86    HZ   PHE  10           HZ       PHE  10  -4.683  -1.262  -6.521
   87    H    ILE  11           H        ILE  11 -10.341   3.514  -4.960
   88    HA   ILE  11           HA       ILE  11 -10.824   1.990  -7.293
   89    HB   ILE  11           HB       ILE  11 -12.508   3.923  -5.706
   90   1HG1  ILE  11          2HG1      ILE  11 -12.706   0.943  -6.246
   91   2HG1  ILE  11          1HG1      ILE  11 -11.977   1.660  -4.808
   92   1HG2  ILE  11          1HG2      ILE  11 -13.208   2.516  -8.289
   93   2HG2  ILE  11          2HG2      ILE  11 -13.431   4.217  -7.881
   94   3HG2  ILE  11          3HG2      ILE  11 -14.441   2.989  -7.119
   95   1HD1  ILE  11          1HD1      ILE  11 -14.174   2.818  -4.369
   96   2HD1  ILE  11          2HD1      ILE  11 -14.251   1.059  -4.253
   97   3HD1  ILE  11          3HD1      ILE  11 -14.868   1.877  -5.689
   98    H    MET  12           H        MET  12 -10.530   5.511  -6.883
   99    HA   MET  12           HA       MET  12 -10.748   5.767  -9.854
  100   1HB   MET  12          2HB       MET  12 -12.181   7.123  -7.976
  101   2HB   MET  12          1HB       MET  12 -10.819   8.222  -8.205
  102   1HG   MET  12          2HG       MET  12 -11.425   8.740 -10.343
  103   2HG   MET  12          1HG       MET  12 -11.966   7.098 -10.691
  104   1HE   MET  12          1HE       MET  12 -13.921   6.692 -11.355
  105   2HE   MET  12          2HE       MET  12 -14.244   8.286 -12.032
  106   3HE   MET  12          3HE       MET  12 -15.467   7.492 -11.044
  107    H    LYS  13           H        LYS  13  -8.334   5.048  -8.161
  108    HA   LYS  13           HA       LYS  13  -6.576   7.223  -9.212
  109   1HB   LYS  13          2HB       LYS  13  -6.897   7.222  -6.660
  110   2HB   LYS  13          1HB       LYS  13  -5.986   5.711  -6.662
  111   1HG   LYS  13          2HG       LYS  13  -4.070   6.885  -6.754
  112   2HG   LYS  13          1HG       LYS  13  -4.569   7.547  -8.311
  113   1HD   LYS  13          2HD       LYS  13  -6.055   8.896  -6.285
  114   2HD   LYS  13          1HD       LYS  13  -4.358   8.903  -5.800
  115   1HE   LYS  13          2HE       LYS  13  -3.758  10.293  -7.494
  116   2HE   LYS  13          1HE       LYS  13  -4.793   9.466  -8.658
  117   1HZ   LYS  13          1HZ       LYS  13  -5.473  11.785  -8.125
  118   2HZ   LYS  13          2HZ       LYS  13  -5.822  11.272  -6.543
  119   3HZ   LYS  13          3HZ       LYS  13  -6.682  10.627  -7.859
  120    H    CYS  14           H        CYS  14  -6.287   3.962  -7.738
  121    HA   CYS  14           HA       CYS  14  -4.567   3.228 -10.076
  122   1HB   CYS  14          2HB       CYS  14  -4.149   1.544  -7.727
  123   2HB   CYS  14          1HB       CYS  14  -2.961   2.408  -8.697
  124    H    SER  15           H        SER  15  -7.520   2.948  -9.599
  125    HA   SER  15           HA       SER  15  -7.941   0.075  -9.192
  126   1HB   SER  15          2HB       SER  15  -9.565   2.062  -8.652
  127   2HB   SER  15          1HB       SER  15 -10.001   1.931 -10.353
  128    HG   SER  15           HG       SER  15 -10.053  -0.155  -8.420
  129    H    GLN  16           H        GLN  16  -6.622   1.691 -11.685
  130    HA   GLN  16           HA       GLN  16  -8.059   0.173 -13.803
  131   1HB   GLN  16          2HB       GLN  16  -7.732   2.507 -14.348
  132   2HB   GLN  16          1HB       GLN  16  -6.019   2.413 -13.933
  133   1HG   GLN  16          2HG       GLN  16  -6.298   2.310 -16.368
  134   2HG   GLN  16          1HG       GLN  16  -5.686   0.769 -15.765
  135   1HE2  GLN  16          1HE2      GLN  16  -8.007   2.072 -17.807
  136   2HE2  GLN  16          2HE2      GLN  16  -9.111   0.781 -17.814
  137    H    CYS  17           H        CYS  17  -4.705   0.875 -12.777
  138    HA   CYS  17           HA       CYS  17  -3.738  -1.495 -14.217
  139   1HB   CYS  17          2HB       CYS  17  -2.418   0.632 -12.519
  140   2HB   CYS  17          1HB       CYS  17  -1.536  -0.801 -13.050
  141    H    HIS  18           H        HIS  18  -4.829  -0.653 -11.032
  142    HA   HIS  18           HA       HIS  18  -3.996  -3.369 -10.076
  143   1HB   HIS  18          2HB       HIS  18  -4.326  -0.837  -8.447
  144   2HB   HIS  18          1HB       HIS  18  -3.998  -2.435  -7.783
  145    HD1  HIS  18           HD1      HIS  18  -1.618  -3.268  -7.858
  146    HD2  HIS  18           HD2      HIS  18  -2.150   0.250  -9.993
  147    HE1  HIS  18           HE1      HIS  18   0.699  -2.411  -8.400
  148    H    THR  19           H        THR  19  -6.052  -4.259 -10.733
  149    HA   THR  19           HA       THR  19  -8.446  -3.062  -9.465
  150    HB   THR  19           HB       THR  19  -9.711  -4.709 -10.793
  151    HG1  THR  19           HG1      THR  19  -8.721  -6.306 -11.816
  152   1HG2  THR  19          1HG2      THR  19  -9.543  -3.090 -12.351
  153   2HG2  THR  19          2HG2      THR  19  -8.218  -4.018 -13.055
  154   3HG2  THR  19          3HG2      THR  19  -7.876  -2.738 -11.890
  155    H    VAL  20           H        VAL  20  -8.228  -3.581  -7.278
  156    HA   VAL  20           HA       VAL  20  -7.557  -6.323  -6.473
  157    HB   VAL  20           HB       VAL  20  -7.532  -5.476  -4.246
  158   1HG1  VAL  20          1HG1      VAL  20  -6.694  -3.245  -6.121
  159   2HG1  VAL  20          2HG1      VAL  20  -5.697  -4.619  -5.638
  160   3HG1  VAL  20          3HG1      VAL  20  -6.175  -3.413  -4.443
  161   1HG2  VAL  20          1HG2      VAL  20  -8.479  -3.221  -3.705
  162   2HG2  VAL  20          2HG2      VAL  20  -9.711  -4.368  -4.230
  163   3HG2  VAL  20          3HG2      VAL  20  -9.121  -3.135  -5.345
  164    H    GLU  21           H        GLU  21 -10.052  -5.877  -8.030
  165    HA   GLU  21           HA       GLU  21 -11.911  -7.123  -6.073
  166   1HB   GLU  21          2HB       GLU  21 -12.529  -4.795  -7.912
  167   2HB   GLU  21          1HB       GLU  21 -13.780  -5.784  -7.157
  168   1HG   GLU  21          2HG       GLU  21 -12.699  -5.265  -4.923
  169   2HG   GLU  21          1HG       GLU  21 -11.693  -4.087  -5.767
  170    H    LYS  22           H        LYS  22 -10.239  -7.562  -8.808
  171    HA   LYS  22           HA       LYS  22 -12.385  -8.674 -10.485
  172   1HB   LYS  22          2HB       LYS  22 -10.077  -7.560 -11.190
  173   2HB   LYS  22          1HB       LYS  22  -9.484  -9.209 -10.995
  174   1HG   LYS  22          2HG       LYS  22 -10.211  -9.519 -13.125
  175   2HG   LYS  22          1HG       LYS  22 -11.818  -9.600 -12.403
  176   1HD   LYS  22          2HD       LYS  22 -12.415  -7.550 -13.195
  177   2HD   LYS  22          1HD       LYS  22 -10.819  -6.863 -12.890
  178   1HE   LYS  22          2HE       LYS  22 -10.101  -7.303 -14.996
  179   2HE   LYS  22          1HE       LYS  22 -10.846  -8.901 -15.012
  180   1HZ   LYS  22          1HZ       LYS  22 -11.737  -6.903 -16.481
  181   2HZ   LYS  22          2HZ       LYS  22 -12.640  -6.606 -15.073
  182   3HZ   LYS  22          3HZ       LYS  22 -12.764  -8.104 -15.863
  183    H    GLY  23           H        GLY  23 -10.649 -10.949 -11.352
  184   1HA   GLY  23          2HA       GLY  23 -11.363 -12.779  -9.117
  185   2HA   GLY  23          1HA       GLY  23 -11.103 -13.269 -10.791
  186    H    GLY  24           H        GLY  24  -9.002 -11.126  -8.910
  187   1HA   GLY  24          1HA       GLY  24  -6.814 -11.471  -8.100
  188   2HA   GLY  24          2HA       GLY  24  -7.057 -13.205  -8.322
  189    H    LYS  25           H        LYS  25  -7.788 -11.293 -11.070
  190    HA   LYS  25           HA       LYS  25  -5.365 -12.349 -12.415
  191   1HB   LYS  25          2HB       LYS  25  -7.837 -12.473 -13.307
  192   2HB   LYS  25          1HB       LYS  25  -7.533 -10.813 -13.818
  193   1HG   LYS  25          2HG       LYS  25  -6.396 -11.571 -15.604
  194   2HG   LYS  25          1HG       LYS  25  -5.253 -12.377 -14.531
  195   1HD   LYS  25          2HD       LYS  25  -7.930 -13.619 -15.146
  196   2HD   LYS  25          1HD       LYS  25  -6.559 -13.840 -16.233
  197   1HE   LYS  25          2HE       LYS  25  -5.233 -14.577 -14.168
  198   2HE   LYS  25          1HE       LYS  25  -6.785 -14.666 -13.335
  199   1HZ   LYS  25          1HZ       LYS  25  -7.326 -16.529 -14.403
  200   2HZ   LYS  25          2HZ       LYS  25  -5.685 -16.642 -14.828
  201   3HZ   LYS  25          3HZ       LYS  25  -6.800 -15.945 -15.905
  202    H    HIS  26           H        HIS  26  -4.113 -10.875 -13.817
  203    HA   HIS  26           HA       HIS  26  -4.357  -7.998 -13.120
  204   1HB   HIS  26          2HB       HIS  26  -1.670  -8.236 -13.081
  205   2HB   HIS  26          1HB       HIS  26  -2.653  -8.352 -11.624
  206    HD1  HIS  26           HD1      HIS  26  -2.314 -11.029 -14.299
  207    HD2  HIS  26           HD2      HIS  26  -1.255 -10.395 -10.315
  208    HE1  HIS  26           HE1      HIS  26  -1.392 -13.227 -13.443
  209    H    LYS  27           H        LYS  27  -3.755  -6.647 -14.822
  210    HA   LYS  27           HA       LYS  27  -2.748  -8.002 -17.265
  211   1HB   LYS  27          2HB       LYS  27  -5.139  -6.519 -16.879
  212   2HB   LYS  27          1HB       LYS  27  -4.080  -5.545 -17.898
  213   1HG   LYS  27          2HG       LYS  27  -3.683  -7.787 -19.188
  214   2HG   LYS  27          1HG       LYS  27  -5.182  -8.296 -18.409
  215   1HD   LYS  27          2HD       LYS  27  -6.466  -6.711 -19.527
  216   2HD   LYS  27          1HD       LYS  27  -5.093  -5.631 -19.782
  217   1HE   LYS  27          2HE       LYS  27  -4.934  -8.311 -21.065
  218   2HE   LYS  27          1HE       LYS  27  -6.097  -7.173 -21.747
  219   1HZ   LYS  27          1HZ       LYS  27  -3.582  -7.199 -22.483
  220   2HZ   LYS  27          2HZ       LYS  27  -3.422  -6.172 -21.139
  221   3HZ   LYS  27          3HZ       LYS  27  -4.474  -5.759 -22.407
  222    H    THR  28           H        THR  28  -3.049  -4.693 -15.927
  223    HA   THR  28           HA       THR  28  -0.371  -4.086 -17.076
  224    HB   THR  28           HB       THR  28  -2.450  -2.225 -15.883
  225    HG1  THR  28           HG1      THR  28  -3.289  -2.248 -17.790
  226   1HG2  THR  28          1HG2      THR  28   0.260  -1.839 -17.119
  227   2HG2  THR  28          2HG2      THR  28  -0.423  -1.082 -15.680
  228   3HG2  THR  28          3HG2      THR  28  -0.966  -0.580 -17.281
  229    H    GLY  29           H        GLY  29  -2.155  -3.303 -14.066
  230   1HA   GLY  29          2HA       GLY  29   0.426  -3.192 -12.618
  231   2HA   GLY  29          1HA       GLY  29  -1.126  -2.663 -11.988
  232    HA   PRO  30           HA       PRO  30   0.017  -7.162 -10.782
  233   1HB   PRO  30          2HB       PRO  30   1.012  -6.636  -8.268
  234   2HB   PRO  30          1HB       PRO  30   2.017  -6.834  -9.714
  235   1HG   PRO  30          2HG       PRO  30   1.193  -4.302  -8.325
  236   2HG   PRO  30          1HG       PRO  30   2.714  -4.686  -9.154
  237   1HD   PRO  30          2HD       PRO  30   0.726  -3.150 -10.301
  238   2HD   PRO  30          1HD       PRO  30   1.884  -4.117 -11.232
  239    H    ASN  31           H        ASN  31  -1.621  -8.271  -9.797
  240    HA   ASN  31           HA       ASN  31  -3.969  -7.015  -8.894
  241   1HB   ASN  31          2HB       ASN  31  -3.922  -9.379  -9.537
  242   2HB   ASN  31          1HB       ASN  31  -2.904  -9.755  -8.146
  243   1HD2  ASN  31          1HD2      ASN  31  -5.914  -7.777  -8.532
  244   2HD2  ASN  31          2HD2      ASN  31  -6.751  -8.553  -7.276
  245    H    LEU  32           H        LEU  32  -3.845  -5.510  -7.296
  246    HA   LEU  32           HA       LEU  32  -2.173  -5.878  -4.945
  247   1HB   LEU  32          2HB       LEU  32  -3.757  -3.730  -6.157
  248   2HB   LEU  32          1HB       LEU  32  -3.861  -3.755  -4.399
  249    HG   LEU  32           HG       LEU  32  -1.580  -3.353  -4.120
  250   1HD1  LEU  32          1HD1      LEU  32  -1.379  -4.890  -6.629
  251   2HD1  LEU  32          2HD1      LEU  32  -0.292  -4.856  -5.242
  252   3HD1  LEU  32          3HD1      LEU  32  -0.195  -3.594  -6.470
  253   1HD2  LEU  32          1HD2      LEU  32  -0.976  -1.784  -6.216
  254   2HD2  LEU  32          2HD2      LEU  32  -2.140  -1.292  -4.986
  255   3HD2  LEU  32          3HD2      LEU  32  -2.704  -1.972  -6.512
  256    H    HIS  33           H        HIS  33  -3.972  -8.015  -5.048
  257    HA   HIS  33           HA       HIS  33  -6.132  -7.343  -3.128
  258   1HB   HIS  33          2HB       HIS  33  -6.700  -8.766  -5.075
  259   2HB   HIS  33          1HB       HIS  33  -5.502  -9.950  -4.550
  260    HD1  HIS  33           HD1      HIS  33  -8.917  -8.654  -3.788
  261    HD2  HIS  33           HD2      HIS  33  -6.222 -11.386  -2.160
  262    HE1  HIS  33           HE1      HIS  33 -10.212 -10.011  -2.084
  263    H    GLY  34           H        GLY  34  -4.219  -6.901  -1.586
  264   1HA   GLY  34          2HA       GLY  34  -3.829  -7.996   0.646
  265   2HA   GLY  34          1HA       GLY  34  -3.435  -9.463  -0.251
  266    H    LEU  35           H        LEU  35  -2.399  -6.556  -1.718
  267    HA   LEU  35           HA       LEU  35   0.323  -7.217  -1.832
  268   1HB   LEU  35          2HB       LEU  35  -0.691  -5.467  -3.221
  269   2HB   LEU  35          1HB       LEU  35  -0.941  -4.461  -1.794
  270    HG   LEU  35           HG       LEU  35   1.595  -4.640  -1.423
  271   1HD1  LEU  35          1HD1      LEU  35   2.932  -5.172  -3.401
  272   2HD1  LEU  35          2HD1      LEU  35   1.469  -5.478  -4.337
  273   3HD1  LEU  35          3HD1      LEU  35   1.902  -6.549  -3.004
  274   1HD2  LEU  35          1HD2      LEU  35   0.149  -2.739  -2.565
  275   2HD2  LEU  35          2HD2      LEU  35   1.002  -3.256  -4.019
  276   3HD2  LEU  35          3HD2      LEU  35   1.909  -2.670  -2.625
  277    H    PHE  36           H        PHE  36  -1.469  -5.607   0.733
  278    HA   PHE  36           HA       PHE  36   0.732  -4.529   2.183
  279   1HB   PHE  36          2HB       PHE  36  -2.022  -5.464   2.979
  280   2HB   PHE  36          1HB       PHE  36  -0.873  -4.904   4.194
  281    HD1  PHE  36           HD1      PHE  36  -1.386  -3.711   0.682
  282    HD2  PHE  36           HD2      PHE  36  -1.670  -2.791   4.869
  283    HE1  PHE  36           HE1      PHE  36  -1.938  -1.361   0.127
  284    HE2  PHE  36           HE2      PHE  36  -2.224  -0.440   4.312
  285    HZ   PHE  36           HZ       PHE  36  -2.359   0.272   1.942
  286    H    GLY  37           H        GLY  37   2.121  -5.444   3.704
  287   1HA   GLY  37          2HA       GLY  37   3.314  -7.154   4.785
  288   2HA   GLY  37          1HA       GLY  37   1.764  -7.979   4.954
  289    H    ARG  38           H        ARG  38   3.083  -7.069   1.831
  290    HA   ARG  38           HA       ARG  38   3.811  -9.918   1.320
  291   1HB   ARG  38          2HB       ARG  38   1.455  -8.937   0.436
  292   2HB   ARG  38          1HB       ARG  38   2.499  -8.412  -0.885
  293   1HG   ARG  38          2HG       ARG  38   2.981 -11.180  -0.002
  294   2HG   ARG  38          1HG       ARG  38   1.379 -10.911  -0.690
  295   1HD   ARG  38          2HD       ARG  38   4.058 -10.350  -1.984
  296   2HD   ARG  38          1HD       ARG  38   2.822 -11.485  -2.520
  297    HE   ARG  38           HE       ARG  38   1.398  -9.280  -2.773
  298   1HH1  ARG  38          1HH2      ARG  38   3.731  -7.489  -2.267
  299   2HH1  ARG  38          2HH2      ARG  38   4.315  -7.181  -3.868
  300   1HH2  ARG  38          1HH1      ARG  38   2.595  -9.837  -5.290
  301   2HH2  ARG  38          2HH1      ARG  38   3.674  -8.513  -5.580
  302    H    LYS  39           H        LYS  39   5.832 -10.020   0.441
  303    HA   LYS  39           HA       LYS  39   7.252  -7.600  -0.292
  304   1HB   LYS  39          2HB       LYS  39   7.907 -10.544  -0.458
  305   2HB   LYS  39          1HB       LYS  39   8.995  -9.320  -1.111
  306   1HG   LYS  39          2HG       LYS  39   9.160  -8.240   1.067
  307   2HG   LYS  39          1HG       LYS  39   7.976  -9.358   1.744
  308   1HD   LYS  39          2HD       LYS  39   9.773 -11.120   0.716
  309   2HD   LYS  39          1HD       LYS  39  10.845  -9.784   1.137
  310   1HE   LYS  39          2HE       LYS  39  10.668 -11.254   3.060
  311   2HE   LYS  39          1HE       LYS  39   9.815  -9.754   3.424
  312   1HZ   LYS  39          1HZ       LYS  39   7.872 -11.201   2.304
  313   2HZ   LYS  39          2HZ       LYS  39   8.163 -11.145   3.976
  314   3HZ   LYS  39          3HZ       LYS  39   8.772 -12.431   3.047
  315    H    THR  40           H        THR  40   8.465  -7.623  -2.521
  316    HA   THR  40           HA       THR  40   6.424  -7.570  -4.588
  317    HB   THR  40           HB       THR  40   9.241  -7.470  -5.459
  318    HG1  THR  40           HG1      THR  40   8.202  -5.723  -3.490
  319   1HG2  THR  40          1HG2      THR  40   6.714  -6.413  -6.184
  320   2HG2  THR  40          2HG2      THR  40   8.257  -6.173  -7.005
  321   3HG2  THR  40          3HG2      THR  40   7.735  -5.040  -5.757
  322    H    GLY  41           H        GLY  41   6.922  -8.685  -6.769
  323   1HA   GLY  41          2HA       GLY  41   7.252 -10.650  -8.001
  324   2HA   GLY  41          1HA       GLY  41   8.482 -11.087  -6.820
  325    H    GLN  42           H        GLN  42   5.336 -11.817  -7.939
  326    HA   GLN  42           HA       GLN  42   5.097 -13.955  -5.965
  327   1HB   GLN  42          2HB       GLN  42   3.929 -11.492  -5.315
  328   2HB   GLN  42          1HB       GLN  42   2.594 -12.481  -5.909
  329   1HG   GLN  42          2HG       GLN  42   2.704 -13.000  -3.604
  330   2HG   GLN  42          1HG       GLN  42   3.545 -14.339  -4.385
  331   1HE2  GLN  42          1HE2      GLN  42   4.711 -11.000  -3.685
  332   2HE2  GLN  42          2HE2      GLN  42   6.036 -11.501  -2.748
  333    H    ALA  43           H        ALA  43   2.871 -12.099  -8.081
  334    HA   ALA  43           HA       ALA  43   1.247 -14.123  -9.000
  335   1HB   ALA  43          1HB       ALA  43   0.803 -11.959  -9.840
  336   2HB   ALA  43          2HB       ALA  43   1.311 -12.868 -11.264
  337   3HB   ALA  43          3HB       ALA  43   2.441 -11.773 -10.467
  338    HA   PRO  44           HA       PRO  44   3.784 -16.996 -11.152
  339   1HB   PRO  44          2HB       PRO  44   1.831 -18.148 -12.709
  340   2HB   PRO  44          1HB       PRO  44   2.018 -18.466 -10.976
  341   1HG   PRO  44          2HG       PRO  44  -0.026 -16.800 -12.368
  342   2HG   PRO  44          1HG       PRO  44  -0.139 -17.655 -10.821
  343   1HD   PRO  44          2HD       PRO  44   0.290 -14.878 -11.143
  344   2HD   PRO  44          1HD       PRO  44   0.519 -15.801  -9.643
  345    H    GLY  45           H        GLY  45   1.338 -16.153 -13.609
  346   1HA   GLY  45          2HA       GLY  45   3.479 -15.736 -15.586
  347   2HA   GLY  45          1HA       GLY  45   1.745 -15.717 -15.917
  348    H    TYR  46           H        TYR  46   4.154 -13.839 -14.055
  349    HA   TYR  46           HA       TYR  46   3.290 -11.349 -15.334
  350   1HB   TYR  46          2HB       TYR  46   1.599 -11.794 -13.494
  351   2HB   TYR  46          1HB       TYR  46   2.919 -11.688 -12.341
  352    HD1  TYR  46           HD1      TYR  46   4.416  -9.307 -13.789
  353    HD2  TYR  46           HD2      TYR  46   0.325  -9.967 -12.695
  354    HE1  TYR  46           HE1      TYR  46   4.078  -6.884 -13.657
  355    HE2  TYR  46           HE2      TYR  46   0.006  -7.524 -12.549
  356    HH   TYR  46           HH       TYR  46   2.150  -5.290 -13.830
  357    H    SER  47           H        SER  47   5.194 -10.293 -15.615
  358    HA   SER  47           HA       SER  47   7.486 -10.892 -13.857
  359   1HB   SER  47          2HB       SER  47   7.900 -10.593 -16.270
  360   2HB   SER  47          1HB       SER  47   7.184  -8.985 -16.208
  361    HG   SER  47           HG       SER  47   8.980  -8.985 -14.334
  362    H    TYR  48           H        TYR  48   6.061 -10.026 -12.020
  363    HA   TYR  48           HA       TYR  48   5.095  -7.470 -11.638
  364   1HB   TYR  48          2HB       TYR  48   6.297  -9.523  -9.894
  365   2HB   TYR  48          1HB       TYR  48   6.326  -7.898  -9.234
  366    HD1  TYR  48           HD1      TYR  48   3.847  -9.699 -11.365
  367    HD2  TYR  48           HD2      TYR  48   4.639  -7.685  -7.669
  368    HE1  TYR  48           HE1      TYR  48   1.466  -9.970 -10.709
  369    HE2  TYR  48           HE2      TYR  48   2.261  -7.940  -7.012
  370    HH   TYR  48           HH       TYR  48   0.352  -9.244  -7.505
  371    H    THR  49           H        THR  49   6.283  -5.813 -10.035
  372    HA   THR  49           HA       THR  49   8.343  -4.529 -11.507
  373    HB   THR  49           HB       THR  49   8.417  -4.062  -8.599
  374    HG1  THR  49           HG1      THR  49   6.258  -3.065  -8.789
  375   1HG2  THR  49          1HG2      THR  49   7.414  -2.030 -10.501
  376   2HG2  THR  49          2HG2      THR  49   9.031  -2.648 -10.835
  377   3HG2  THR  49          3HG2      THR  49   8.676  -1.901  -9.276
  378    H    ALA  50           H        ALA  50   9.919  -6.162 -11.983
  379    HA   ALA  50           HA       ALA  50  11.207  -7.851 -10.143
  380   1HB   ALA  50          1HB       ALA  50  11.597  -7.059 -12.843
  381   2HB   ALA  50          2HB       ALA  50  12.344  -8.418 -12.004
  382   3HB   ALA  50          3HB       ALA  50  13.143  -6.846 -12.020
  383    H    ALA  51           H        ALA  51  11.932  -4.471 -10.986
  384    HA   ALA  51           HA       ALA  51  14.320  -4.141  -9.548
  385   1HB   ALA  51          1HB       ALA  51  12.007  -2.287 -10.099
  386   2HB   ALA  51          2HB       ALA  51  13.623  -2.271 -10.803
  387   3HB   ALA  51          3HB       ALA  51  13.384  -1.749  -9.137
  388    H    ASN  52           H        ASN  52  11.154  -3.088  -8.223
  389    HA   ASN  52           HA       ASN  52  11.788  -2.834  -5.563
  390   1HB   ASN  52          2HB       ASN  52   9.374  -3.571  -7.049
  391   2HB   ASN  52          1HB       ASN  52   9.390  -4.222  -5.410
  392   1HD2  ASN  52          1HD2      ASN  52  10.801  -2.165  -4.060
  393   2HD2  ASN  52          2HD2      ASN  52   9.877  -0.742  -4.108
  394    H    LYS  53           H        LYS  53  10.978  -5.925  -7.148
  395    HA   LYS  53           HA       LYS  53  11.102  -7.654  -4.969
  396   1HB   LYS  53          2HB       LYS  53  11.027  -7.939  -7.728
  397   2HB   LYS  53          1HB       LYS  53  12.536  -8.732  -7.277
  398   1HG   LYS  53          2HG       LYS  53  10.073  -9.288  -5.660
  399   2HG   LYS  53          1HG       LYS  53  10.262 -10.079  -7.226
  400   1HD   LYS  53          2HD       LYS  53  12.604 -10.100  -5.372
  401   2HD   LYS  53          1HD       LYS  53  11.250 -11.165  -4.995
  402   1HE   LYS  53          2HE       LYS  53  12.437 -12.562  -6.397
  403   2HE   LYS  53          1HE       LYS  53  11.450 -11.730  -7.597
  404   1HZ   LYS  53          1HZ       LYS  53  14.020 -10.555  -6.806
  405   2HZ   LYS  53          2HZ       LYS  53  13.194 -10.450  -8.286
  406   3HZ   LYS  53          3HZ       LYS  53  14.022 -11.875  -7.871
  407    H    ASN  54           H        ASN  54  13.916  -6.857  -7.058
  408    HA   ASN  54           HA       ASN  54  15.812  -8.182  -5.402
  409   1HB   ASN  54          2HB       ASN  54  16.153  -5.908  -7.370
  410   2HB   ASN  54          1HB       ASN  54  17.499  -6.763  -6.614
  411   1HD2  ASN  54          1HD2      ASN  54  16.645  -6.725  -9.520
  412   2HD2  ASN  54          2HD2      ASN  54  16.412  -8.355  -9.932
  413    H    LYS  55           H        LYS  55  14.543  -4.887  -5.296
  414    HA   LYS  55           HA       LYS  55  16.466  -3.752  -3.560
  415   1HB   LYS  55          2HB       LYS  55  14.562  -2.554  -4.736
  416   2HB   LYS  55          1HB       LYS  55  13.497  -3.179  -3.475
  417   1HG   LYS  55          2HG       LYS  55  14.063  -1.240  -2.408
  418   2HG   LYS  55          1HG       LYS  55  15.498  -2.159  -1.949
  419   1HD   LYS  55          2HD       LYS  55  16.532  -1.313  -4.150
  420   2HD   LYS  55          1HD       LYS  55  15.201  -0.155  -4.189
  421   1HE   LYS  55          2HE       LYS  55  16.378   1.166  -2.800
  422   2HE   LYS  55          1HE       LYS  55  16.221  -0.076  -1.557
  423   1HZ   LYS  55          1HZ       LYS  55  18.429   0.368  -3.458
  424   2HZ   LYS  55          2HZ       LYS  55  18.182  -1.166  -2.771
  425   3HZ   LYS  55          3HZ       LYS  55  18.494   0.174  -1.774
  426    H    GLY  56           H        GLY  56  14.236  -6.281  -2.958
  427   1HA   GLY  56          1HA       GLY  56  13.700  -7.435  -0.982
  428   2HA   GLY  56          2HA       GLY  56  15.165  -6.722  -0.301
  429    H    ILE  57           H        ILE  57  12.318  -5.048  -1.572
  430    HA   ILE  57           HA       ILE  57  12.112  -3.579   0.996
  431    HB   ILE  57           HB       ILE  57  12.142  -2.467  -1.327
  432   1HG1  ILE  57          2HG1      ILE  57  11.430  -1.357   0.813
  433   2HG1  ILE  57          1HG1      ILE  57  10.603  -0.731  -0.614
  434   1HG2  ILE  57          1HG2      ILE  57   9.912  -2.347  -2.421
  435   2HG2  ILE  57          2HG2      ILE  57   9.307  -3.544  -1.278
  436   3HG2  ILE  57          3HG2      ILE  57  10.567  -3.984  -2.430
  437   1HD1  ILE  57          1HD1      ILE  57   9.514  -2.232   1.680
  438   2HD1  ILE  57          2HD1      ILE  57   8.939  -2.782   0.108
  439   3HD1  ILE  57          3HD1      ILE  57   8.711  -1.102   0.591
  440    H    ILE  58           H        ILE  58  10.434  -3.893   2.407
  441    HA   ILE  58           HA       ILE  58   8.419  -5.949   1.684
  442    HB   ILE  58           HB       ILE  58   9.748  -5.991   3.882
  443   1HG1  ILE  58          2HG1      ILE  58   7.642  -7.273   3.454
  444   2HG1  ILE  58          1HG1      ILE  58   7.827  -6.804   5.144
  445   1HG2  ILE  58          1HG2      ILE  58   9.206  -4.482   5.604
  446   2HG2  ILE  58          2HG2      ILE  58   7.734  -3.946   4.796
  447   3HG2  ILE  58          3HG2      ILE  58   9.309  -3.448   4.178
  448   1HD1  ILE  58          1HD1      ILE  58   6.499  -4.635   4.192
  449   2HD1  ILE  58          2HD1      ILE  58   5.690  -6.040   4.886
  450   3HD1  ILE  58          3HD1      ILE  58   5.848  -5.889   3.137
  451    H    TRP  59           H        TRP  59   6.620  -5.125   0.723
  452    HA   TRP  59           HA       TRP  59   5.870  -2.421   0.656
  453   1HB   TRP  59          2HB       TRP  59   4.263  -4.952   0.314
  454   2HB   TRP  59          1HB       TRP  59   3.539  -3.353   0.116
  455    HD1  TRP  59           HD1      TRP  59   4.701  -5.837  -2.042
  456    HE1  TRP  59           HE1      TRP  59   5.843  -4.918  -4.163
  457    HE3  TRP  59           HE3      TRP  59   5.595  -1.034  -0.554
  458    HZ2  TRP  59           HZ2      TRP  59   6.987  -2.470  -5.101
  459    HZ3  TRP  59           HZ3      TRP  59   6.711   0.567  -2.078
  460    HH2  TRP  59           HH2      TRP  59   7.408  -0.145  -4.350
  461    H    GLY  60           H        GLY  60   5.726  -1.300   2.548
  462   1HA   GLY  60          1HA       GLY  60   3.709  -2.274   4.534
  463   2HA   GLY  60          2HA       GLY  60   5.203  -1.480   5.036
  464    H    GLU  61           H        GLU  61   3.601   0.061   6.077
  465    HA   GLU  61           HA       GLU  61   1.987   1.763   4.367
  466   1HB   GLU  61          2HB       GLU  61   1.345   1.482   6.692
  467   2HB   GLU  61          1HB       GLU  61   2.914   2.077   7.238
  468   1HG   GLU  61          2HG       GLU  61   2.419   4.256   6.097
  469   2HG   GLU  61          1HG       GLU  61   0.800   3.654   5.743
  470    H    ASP  62           H        ASP  62   4.753   2.679   6.455
  471    HA   ASP  62           HA       ASP  62   5.285   5.108   5.073
  472   1HB   ASP  62          2HB       ASP  62   6.421   3.635   7.251
  473   2HB   ASP  62          1HB       ASP  62   7.724   4.114   6.161
  474    H    THR  63           H        THR  63   6.589   1.833   4.626
  475    HA   THR  63           HA       THR  63   8.620   2.482   2.757
  476    HB   THR  63           HB       THR  63   7.750   0.021   1.908
  477    HG1  THR  63           HG1      THR  63   6.070   0.338   3.597
  478   1HG2  THR  63          1HG2      THR  63   9.579   0.966   4.085
  479   2HG2  THR  63          2HG2      THR  63   9.973   0.166   2.563
  480   3HG2  THR  63          3HG2      THR  63   9.297  -0.766   3.900
  481    H    LEU  64           H        LEU  64   5.146   1.945   2.316
  482    HA   LEU  64           HA       LEU  64   5.340   2.111  -0.599
  483   1HB   LEU  64          2HB       LEU  64   3.445   1.129   1.148
  484   2HB   LEU  64          1HB       LEU  64   2.707   2.629   0.596
  485    HG   LEU  64           HG       LEU  64   3.801   0.431  -1.183
  486   1HD1  LEU  64          1HD1      LEU  64   1.595   0.080   0.104
  487   2HD1  LEU  64          2HD1      LEU  64   1.546  -0.129  -1.646
  488   3HD1  LEU  64          3HD1      LEU  64   0.941   1.359  -0.919
  489   1HD2  LEU  64          1HD2      LEU  64   2.528   1.874  -2.922
  490   2HD2  LEU  64          2HD2      LEU  64   4.099   2.455  -2.374
  491   3HD2  LEU  64          3HD2      LEU  64   2.622   3.159  -1.718
  492    H    MET  65           H        MET  65   4.812   4.317   2.067
  493    HA   MET  65           HA       MET  65   3.581   6.463   0.694
  494   1HB   MET  65          2HB       MET  65   3.990   6.374   3.168
  495   2HB   MET  65          1HB       MET  65   5.697   6.695   2.853
  496   1HG   MET  65          2HG       MET  65   5.043   8.796   1.672
  497   2HG   MET  65          1HG       MET  65   3.366   8.492   2.126
  498   1HE   MET  65          1HE       MET  65   3.501  10.976   3.121
  499   2HE   MET  65          2HE       MET  65   5.217  11.051   2.727
  500   3HE   MET  65          3HE       MET  65   4.673  11.479   4.347
  501    H    GLU  66           H        GLU  66   7.046   5.712   1.093
  502    HA   GLU  66           HA       GLU  66   7.910   7.929  -0.538
  503   1HB   GLU  66          2HB       GLU  66   9.245   6.547   1.226
  504   2HB   GLU  66          1HB       GLU  66   9.542   5.439  -0.114
  505   1HG   GLU  66          2HG       GLU  66  10.566   7.196  -1.426
  506   2HG   GLU  66          1HG       GLU  66  10.115   8.412  -0.230
  507    H    TYR  67           H        TYR  67   7.728   4.402  -1.155
  508    HA   TYR  67           HA       TYR  67   8.564   4.444  -3.845
  509   1HB   TYR  67          2HB       TYR  67   8.205   2.344  -2.649
  510   2HB   TYR  67          1HB       TYR  67   6.476   2.676  -2.540
  511    HD1  TYR  67           HD1      TYR  67   9.138   2.637  -5.206
  512    HD2  TYR  67           HD2      TYR  67   5.127   1.592  -4.081
  513    HE1  TYR  67           HE1      TYR  67   8.782   1.600  -7.430
  514    HE2  TYR  67           HE2      TYR  67   4.771   0.558  -6.305
  515    HH   TYR  67           HH       TYR  67   5.704  -0.007  -8.237
  516    H    LEU  68           H        LEU  68   5.591   5.577  -2.443
  517    HA   LEU  68           HA       LEU  68   4.246   5.658  -5.071
  518   1HB   LEU  68          2HB       LEU  68   3.348   5.546  -2.395
  519   2HB   LEU  68          1HB       LEU  68   2.864   7.130  -3.005
  520    HG   LEU  68           HG       LEU  68   1.794   6.094  -4.945
  521   1HD1  LEU  68          1HD1      LEU  68   1.835   3.340  -4.114
  522   2HD1  LEU  68          2HD1      LEU  68   3.493   3.920  -4.266
  523   3HD1  LEU  68          3HD1      LEU  68   2.389   4.036  -5.636
  524   1HD2  LEU  68          1HD2      LEU  68   0.535   4.300  -3.090
  525   2HD2  LEU  68          2HD2      LEU  68  -0.042   5.865  -3.661
  526   3HD2  LEU  68          3HD2      LEU  68   0.986   5.773  -2.232
  527    H    GLU  69           H        GLU  69   5.923   7.774  -2.841
  528    HA   GLU  69           HA       GLU  69   5.096  10.283  -3.906
  529   1HB   GLU  69          2HB       GLU  69   6.636   9.604  -1.846
  530   2HB   GLU  69          1HB       GLU  69   7.919   9.841  -3.025
  531   1HG   GLU  69          2HG       GLU  69   7.650  12.097  -3.043
  532   2HG   GLU  69          1HG       GLU  69   5.890  11.973  -3.039
  533    H    ASN  70           H        ASN  70   7.193   7.790  -5.010
  534    HA   ASN  70           HA       ASN  70   7.360   8.804  -7.683
  535   1HB   ASN  70          2HB       ASN  70   9.258   9.914  -5.865
  536   2HB   ASN  70          1HB       ASN  70  10.120   8.807  -6.932
  537   1HD2  ASN  70          1HD2      ASN  70   8.858   9.065  -9.356
  538   2HD2  ASN  70          2HD2      ASN  70   8.913  10.671  -9.903
  539    HA   PRO  71           HA       PRO  71   8.207   4.378  -7.300
  540   1HB   PRO  71          2HB       PRO  71   7.032   3.750  -9.714
  541   2HB   PRO  71          1HB       PRO  71   6.127   3.917  -8.201
  542   1HG   PRO  71          2HG       PRO  71   6.275   5.786 -10.517
  543   2HG   PRO  71          1HG       PRO  71   4.985   5.584  -9.319
  544   1HD   PRO  71          2HD       PRO  71   6.905   7.662  -9.345
  545   2HD   PRO  71          1HD       PRO  71   5.840   7.245  -7.987
  546    H    LYS  72           H        LYS  72   8.688   6.424 -10.164
  547    HA   LYS  72           HA       LYS  72  10.640   4.668 -11.369
  548   1HB   LYS  72          2HB       LYS  72   9.195   6.378 -12.579
  549   2HB   LYS  72          1HB       LYS  72  10.273   7.614 -11.932
  550   1HG   LYS  72          2HG       LYS  72  12.199   6.484 -12.992
  551   2HG   LYS  72          1HG       LYS  72  11.111   5.263 -13.655
  552   1HD   LYS  72          2HD       LYS  72  10.954   6.631 -15.455
  553   2HD   LYS  72          1HD       LYS  72   9.908   7.621 -14.438
  554   1HE   LYS  72          2HE       LYS  72  12.627   8.224 -13.778
  555   2HE   LYS  72          1HE       LYS  72  12.449   8.312 -15.530
  556   1HZ   LYS  72          1HZ       LYS  72  10.208   9.520 -14.650
  557   2HZ   LYS  72          2HZ       LYS  72  11.625  10.330 -15.126
  558   3HZ   LYS  72          3HZ       LYS  72  11.339  10.006 -13.483
  559    H    LYS  73           H        LYS  73  10.788   7.047  -8.859
  560    HA   LYS  73           HA       LYS  73  13.704   7.408  -9.268
  561   1HB   LYS  73          2HB       LYS  73  13.526   9.346  -8.091
  562   2HB   LYS  73          1HB       LYS  73  11.807   9.181  -8.426
  563   1HG   LYS  73          2HG       LYS  73  11.805   9.511  -6.116
  564   2HG   LYS  73          1HG       LYS  73  11.801   7.753  -6.212
  565   1HD   LYS  73          2HD       LYS  73  14.385   7.943  -6.161
  566   2HD   LYS  73          1HD       LYS  73  14.112   9.593  -5.600
  567   1HE   LYS  73          2HE       LYS  73  12.392   8.176  -3.998
  568   2HE   LYS  73          1HE       LYS  73  13.731   7.042  -4.174
  569   1HZ   LYS  73          1HZ       LYS  73  15.233   8.559  -3.288
  570   2HZ   LYS  73          2HZ       LYS  73  13.857   8.751  -2.309
  571   3HZ   LYS  73          3HZ       LYS  73  14.201   9.884  -3.527
  572    H    TYR  74           H        TYR  74  11.436   5.944  -6.968
  573    HA   TYR  74           HA       TYR  74  13.560   5.126  -5.147
  574   1HB   TYR  74          2HB       TYR  74  11.316   5.424  -4.260
  575   2HB   TYR  74          1HB       TYR  74  10.665   4.258  -5.411
  576    HD1  TYR  74           HD1      TYR  74   9.751   2.946  -3.481
  577    HD2  TYR  74           HD2      TYR  74  13.962   3.605  -4.001
  578    HE1  TYR  74           HE1      TYR  74  10.234   1.105  -1.892
  579    HE2  TYR  74           HE2      TYR  74  14.447   1.764  -2.411
  580    HH   TYR  74           HH       TYR  74  12.101   0.421  -0.384
  581    H    ILE  75           H        ILE  75  11.291   3.138  -7.090
  582    HA   ILE  75           HA       ILE  75  13.401   1.081  -7.289
  583    HB   ILE  75           HB       ILE  75  10.535   0.817  -8.174
  584   1HG1  ILE  75          2HG1      ILE  75  10.653   1.780  -5.847
  585   2HG1  ILE  75          1HG1      ILE  75   9.932   0.171  -5.913
  586   1HG2  ILE  75          1HG2      ILE  75  11.528  -1.159  -8.696
  587   2HG2  ILE  75          2HG2      ILE  75  11.292  -1.479  -6.980
  588   3HG2  ILE  75          3HG2      ILE  75  12.855  -0.907  -7.560
  589   1HD1  ILE  75          1HD1      ILE  75  12.768   0.873  -5.117
  590   2HD1  ILE  75          2HD1      ILE  75  12.218  -0.777  -5.404
  591   3HD1  ILE  75          3HD1      ILE  75  11.516   0.170  -4.094
  592    HA   PRO  76           HA       PRO  76  13.736   2.751 -11.482
  593   1HB   PRO  76          2HB       PRO  76  16.238   1.697 -11.915
  594   2HB   PRO  76          1HB       PRO  76  15.956   3.229 -11.070
  595   1HG   PRO  76          2HG       PRO  76  16.728   0.579  -9.942
  596   2HG   PRO  76          1HG       PRO  76  17.042   2.202  -9.307
  597   1HD   PRO  76          2HD       PRO  76  15.041   0.425  -8.389
  598   2HD   PRO  76          1HD       PRO  76  15.152   2.156  -8.011
  599    H    GLY  77           H        GLY  77  11.986   0.927 -11.709
  600   1HA   GLY  77          2HA       GLY  77  12.808  -0.864 -13.797
  601   2HA   GLY  77          1HA       GLY  77  12.604  -1.754 -12.287
  602    H    THR  78           H        THR  78  10.427  -0.297 -11.190
  603    HA   THR  78           HA       THR  78   8.192  -1.583 -12.191
  604    HB   THR  78           HB       THR  78   8.255  -0.092 -10.144
  605    HG1  THR  78           HG1      THR  78   6.138   0.026 -10.261
  606   1HG2  THR  78          1HG2      THR  78   7.923   2.254 -10.374
  607   2HG2  THR  78          2HG2      THR  78   7.595   2.113 -12.100
  608   3HG2  THR  78          3HG2      THR  78   9.230   1.859 -11.489
  609    H    LYS  79           H        LYS  79   6.421  -0.860 -13.570
  610    HA   LYS  79           HA       LYS  79   7.433   0.801 -15.835
  611   1HB   LYS  79          2HB       LYS  79   5.204  -1.257 -15.820
  612   2HB   LYS  79          1HB       LYS  79   5.827  -0.405 -17.235
  613   1HG   LYS  79          2HG       LYS  79   8.006  -1.623 -15.783
  614   2HG   LYS  79          1HG       LYS  79   6.779  -2.835 -16.157
  615   1HD   LYS  79          2HD       LYS  79   7.277  -1.016 -18.395
  616   2HD   LYS  79          1HD       LYS  79   8.720  -1.911 -17.913
  617   1HE   LYS  79          2HE       LYS  79   6.363  -3.618 -17.928
  618   2HE   LYS  79          1HE       LYS  79   6.634  -2.874 -19.505
  619   1HZ   LYS  79          1HZ       LYS  79   8.344  -4.214 -19.848
  620   2HZ   LYS  79          2HZ       LYS  79   7.988  -5.022 -18.396
  621   3HZ   LYS  79          3HZ       LYS  79   9.089  -3.728 -18.404
  622    H    MET  80           H        MET  80   5.586   1.153 -13.153
  623    HA   MET  80           HA       MET  80   3.401   2.619 -14.508
  624   1HB   MET  80          2HB       MET  80   2.355   2.793 -12.326
  625   2HB   MET  80          1HB       MET  80   2.917   1.149 -12.557
  626   1HG   MET  80          2HG       MET  80   4.807   1.486 -11.174
  627   2HG   MET  80          1HG       MET  80   4.515   3.206 -11.083
  628   1HE   MET  80          1HE       MET  80   3.353   4.355  -9.907
  629   2HE   MET  80          2HE       MET  80   3.308   3.866  -8.214
  630   3HE   MET  80          3HE       MET  80   1.806   4.001  -9.126
  631    H    ILE  81           H        ILE  81   3.687   4.672 -15.017
  632    HA   ILE  81           HA       ILE  81   5.786   6.268 -13.665
  633    HB   ILE  81           HB       ILE  81   4.028   7.306 -15.876
  634   1HG1  ILE  81          2HG1      ILE  81   4.690   5.091 -16.656
  635   2HG1  ILE  81          1HG1      ILE  81   5.647   6.306 -17.505
  636   1HG2  ILE  81          1HG2      ILE  81   6.721   7.926 -16.298
  637   2HG2  ILE  81          2HG2      ILE  81   6.522   8.016 -14.549
  638   3HG2  ILE  81          3HG2      ILE  81   5.501   8.993 -15.604
  639   1HD1  ILE  81          1HD1      ILE  81   7.554   5.906 -16.099
  640   2HD1  ILE  81          2HD1      ILE  81   6.969   4.326 -16.623
  641   3HD1  ILE  81          3HD1      ILE  81   6.606   4.907 -14.997
  642    H    PHE  82           H        PHE  82   3.757   5.662 -11.977
  643    HA   PHE  82           HA       PHE  82   1.505   7.373 -11.918
  644   1HB   PHE  82          2HB       PHE  82   1.863   5.368 -10.484
  645   2HB   PHE  82          1HB       PHE  82   3.053   6.278  -9.556
  646    HD1  PHE  82           HD1      PHE  82  -0.215   7.389 -11.005
  647    HD2  PHE  82           HD2      PHE  82   2.082   6.617  -7.458
  648    HE1  PHE  82           HE1      PHE  82  -2.042   8.328  -9.615
  649    HE2  PHE  82           HE2      PHE  82   0.258   7.558  -6.071
  650    HZ   PHE  82           HZ       PHE  82  -1.799   8.404  -7.151
  651    H    VAL  83           H        VAL  83   1.149   9.383 -10.943
  652    HA   VAL  83           HA       VAL  83   3.542  11.091 -10.715
  653    HB   VAL  83           HB       VAL  83   1.432  11.781 -11.945
  654   1HG1  VAL  83          1HG1      VAL  83   0.159  10.856  -9.712
  655   2HG1  VAL  83          2HG1      VAL  83  -0.564  11.982 -10.860
  656   3HG1  VAL  83          3HG1      VAL  83   0.191  12.588  -9.385
  657   1HG2  VAL  83          1HG2      VAL  83   3.233  13.318 -10.834
  658   2HG2  VAL  83          2HG2      VAL  83   1.969  13.659  -9.652
  659   3HG2  VAL  83          3HG2      VAL  83   1.710  14.039 -11.355
  660    H    GLY  84           H        GLY  84   1.759   9.158  -8.642
  661   1HA   GLY  84          2HA       GLY  84   1.783   8.980  -6.300
  662   2HA   GLY  84          1HA       GLY  84   3.055  10.204  -6.294
  663    H    ILE  85           H        ILE  85   1.313  10.489  -4.286
  664    HA   ILE  85           HA       ILE  85  -0.707  12.485  -5.206
  665    HB   ILE  85           HB       ILE  85  -0.487  10.912  -2.622
  666   1HG1  ILE  85          2HG1      ILE  85  -2.835  10.201  -3.510
  667   2HG1  ILE  85          1HG1      ILE  85  -2.256  10.808  -5.062
  668   1HG2  ILE  85          1HG2      ILE  85  -2.198  13.240  -3.451
  669   2HG2  ILE  85          2HG2      ILE  85  -1.414  12.934  -1.900
  670   3HG2  ILE  85          3HG2      ILE  85  -2.856  12.025  -2.358
  671   1HD1  ILE  85          1HD1      ILE  85  -1.850   8.263  -4.234
  672   2HD1  ILE  85          2HD1      ILE  85  -0.394   9.024  -3.590
  673   3HD1  ILE  85          3HD1      ILE  85  -0.745   9.109  -5.317
  674    H    LYS  86           H        LYS  86  -0.582  14.596  -4.464
  675    HA   LYS  86           HA       LYS  86   1.939  15.340  -3.108
  676   1HB   LYS  86          2HB       LYS  86  -0.268  17.001  -4.364
  677   2HB   LYS  86          1HB       LYS  86   1.179  17.679  -3.615
  678   1HG   LYS  86          2HG       LYS  86   2.610  16.685  -5.235
  679   2HG   LYS  86          1HG       LYS  86   1.334  15.616  -5.819
  680   1HD   LYS  86          2HD       LYS  86   0.796  17.160  -7.363
  681   2HD   LYS  86          1HD       LYS  86   0.345  18.262  -6.060
  682   1HE   LYS  86          2HE       LYS  86   2.801  18.879  -5.879
  683   2HE   LYS  86          1HE       LYS  86   3.058  17.975  -7.371
  684   1HZ   LYS  86          1HZ       LYS  86   1.944  20.575  -7.002
  685   2HZ   LYS  86          2HZ       LYS  86   0.900  19.571  -7.891
  686   3HZ   LYS  86          3HZ       LYS  86   2.492  19.830  -8.424
  687    H    LYS  87           H        LYS  87  -1.437  14.970  -2.417
  688    HA   LYS  87           HA       LYS  87  -1.184  16.525   0.102
  689   1HB   LYS  87          2HB       LYS  87  -3.274  16.229  -1.698
  690   2HB   LYS  87          1HB       LYS  87  -3.730  15.155  -0.375
  691   1HG   LYS  87          2HG       LYS  87  -3.677  16.908   1.216
  692   2HG   LYS  87          1HG       LYS  87  -2.765  17.968   0.141
  693   1HD   LYS  87          2HD       LYS  87  -5.179  17.205  -1.193
  694   2HD   LYS  87          1HD       LYS  87  -5.597  17.779   0.421
  695   1HE   LYS  87          2HE       LYS  87  -5.562  19.757  -0.855
  696   2HE   LYS  87          1HE       LYS  87  -3.970  19.741  -0.097
  697   1HZ   LYS  87          1HZ       LYS  87  -4.521  18.642  -2.798
  698   2HZ   LYS  87          2HZ       LYS  87  -3.003  18.877  -2.071
  699   3HZ   LYS  87          3HZ       LYS  87  -3.948  20.215  -2.521
  700    H    LYS  88           H        LYS  88  -0.605  15.444   1.913
  701    HA   LYS  88           HA       LYS  88  -0.272  12.610   2.014
  702   1HB   LYS  88          2HB       LYS  88   0.836  14.367   3.506
  703   2HB   LYS  88          1HB       LYS  88  -0.670  14.395   4.423
  704   1HG   LYS  88          2HG       LYS  88  -0.472  12.051   4.960
  705   2HG   LYS  88          1HG       LYS  88   0.900  11.866   3.866
  706   1HD   LYS  88          2HD       LYS  88   2.354  12.607   5.422
  707   2HD   LYS  88          1HD       LYS  88   1.341  14.000   5.803
  708   1HE   LYS  88          2HE       LYS  88   0.267  11.419   6.746
  709   2HE   LYS  88          1HE       LYS  88   1.780  11.903   7.511
  710   1HZ   LYS  88          1HZ       LYS  88  -0.192  14.005   7.218
  711   2HZ   LYS  88          2HZ       LYS  88   0.813  13.630   8.535
  712   3HZ   LYS  88          3HZ       LYS  88  -0.625  12.760   8.286
  713    H    GLU  89           H        GLU  89  -3.078  14.529   2.267
  714    HA   GLU  89           HA       GLU  89  -4.605  12.926   4.089
  715   1HB   GLU  89          2HB       GLU  89  -5.145  15.078   2.132
  716   2HB   GLU  89          1HB       GLU  89  -6.500  13.995   2.450
  717   1HG   GLU  89          2HG       GLU  89  -5.551  14.425   4.983
  718   2HG   GLU  89          1HG       GLU  89  -5.231  15.984   4.220
  719    H    GLU  90           H        GLU  90  -4.675  13.046   0.502
  720    HA   GLU  90           HA       GLU  90  -6.333  10.701   0.277
  721   1HB   GLU  90          2HB       GLU  90  -4.608  12.256  -1.641
  722   2HB   GLU  90          1HB       GLU  90  -5.353  10.737  -2.138
  723   1HG   GLU  90          2HG       GLU  90  -7.546  11.772  -1.177
  724   2HG   GLU  90          1HG       GLU  90  -6.686  13.306  -1.311
  725    H    ARG  91           H        ARG  91  -2.816  11.214   0.126
  726    HA   ARG  91           HA       ARG  91  -2.051   8.606  -0.655
  727   1HB   ARG  91          2HB       ARG  91  -0.608  10.744  -0.242
  728   2HB   ARG  91          1HB       ARG  91  -0.497  10.145   1.414
  729   1HG   ARG  91          2HG       ARG  91   0.684   8.237   0.789
  730   2HG   ARG  91          1HG       ARG  91   0.058   8.267  -0.861
  731   1HD   ARG  91          2HD       ARG  91   2.542   9.019  -0.381
  732   2HD   ARG  91          1HD       ARG  91   1.561   9.907  -1.547
  733    HE   ARG  91           HE       ARG  91   1.561  10.873   1.258
  734   1HH1  ARG  91          1HH1      ARG  91   3.422  10.997  -1.564
  735   2HH1  ARG  91          2HH1      ARG  91   3.494  12.726  -1.637
  736   1HH2  ARG  91          1HH2      ARG  91   1.261  13.194   0.973
  737   2HH2  ARG  91          2HH2      ARG  91   2.267  13.969  -0.203
  738    H    ALA  92           H        ALA  92  -2.652   9.905   2.612
  739    HA   ALA  92           HA       ALA  92  -2.057   7.474   3.993
  740   1HB   ALA  92          1HB       ALA  92  -2.128   9.302   5.428
  741   2HB   ALA  92          2HB       ALA  92  -3.711   8.587   5.729
  742   3HB   ALA  92          3HB       ALA  92  -3.562   9.979   4.658
  743    H    ASP  93           H        ASP  93  -5.179   8.866   2.937
  744    HA   ASP  93           HA       ASP  93  -6.809   6.727   3.843
  745   1HB   ASP  93          2HB       ASP  93  -7.176   9.111   2.379
  746   2HB   ASP  93          1HB       ASP  93  -7.809   7.816   1.360
  747    H    LEU  94           H        LEU  94  -4.627   6.932   1.160
  748    HA   LEU  94           HA       LEU  94  -5.828   4.826  -0.432
  749   1HB   LEU  94          2HB       LEU  94  -3.147   6.196  -0.384
  750   2HB   LEU  94          1HB       LEU  94  -3.388   4.756  -1.374
  751    HG   LEU  94           HG       LEU  94  -5.235   7.147  -1.505
  752   1HD1  LEU  94          1HD1      LEU  94  -2.935   7.833  -2.116
  753   2HD1  LEU  94          2HD1      LEU  94  -3.994   7.814  -3.526
  754   3HD1  LEU  94          3HD1      LEU  94  -2.850   6.498  -3.267
  755   1HD2  LEU  94          1HD2      LEU  94  -4.821   4.605  -3.059
  756   2HD2  LEU  94          2HD2      LEU  94  -5.485   6.022  -3.871
  757   3HD2  LEU  94          3HD2      LEU  94  -6.327   5.324  -2.487
  758    H    ILE  95           H        ILE  95  -2.835   4.859   1.541
  759    HA   ILE  95           HA       ILE  95  -2.402   2.066   1.497
  760    HB   ILE  95           HB       ILE  95  -1.791   3.870   3.851
  761   1HG1  ILE  95          2HG1      ILE  95  -0.928   5.126   2.059
  762   2HG1  ILE  95          1HG1      ILE  95   0.446   4.123   2.524
  763   1HG2  ILE  95          1HG2      ILE  95  -1.403   1.323   3.895
  764   2HG2  ILE  95          2HG2      ILE  95  -0.028   2.349   4.301
  765   3HG2  ILE  95          3HG2      ILE  95  -0.141   1.619   2.700
  766   1HD1  ILE  95          1HD1      ILE  95  -1.403   3.803   0.166
  767   2HD1  ILE  95          2HD1      ILE  95  -0.465   2.437   0.774
  768   3HD1  ILE  95          3HD1      ILE  95   0.360   3.880   0.181
  769    H    ALA  96           H        ALA  96  -4.109   4.029   3.917
  770    HA   ALA  96           HA       ALA  96  -4.909   1.936   5.636
  771   1HB   ALA  96          1HB       ALA  96  -7.029   3.861   5.420
  772   2HB   ALA  96          2HB       ALA  96  -5.482   4.702   5.328
  773   3HB   ALA  96          3HB       ALA  96  -5.846   3.673   6.714
  774    H    TYR  97           H        TYR  97  -6.385   3.124   2.644
  775    HA   TYR  97           HA       TYR  97  -8.834   1.753   2.723
  776   1HB   TYR  97          2HB       TYR  97  -8.585   3.202   0.893
  777   2HB   TYR  97          1HB       TYR  97  -6.994   2.568   0.484
  778    HD1  TYR  97           HD1      TYR  97  -6.945   1.382  -1.518
  779    HD2  TYR  97           HD2      TYR  97 -10.415   1.107   0.993
  780    HE1  TYR  97           HE1      TYR  97  -7.977  -0.205  -3.119
  781    HE2  TYR  97           HE2      TYR  97 -11.448  -0.476  -0.609
  782    HH   TYR  97           HH       TYR  97  -9.695  -1.560  -3.513
  783    H    LEU  98           H        LEU  98  -5.706   0.597   1.451
  784    HA   LEU  98           HA       LEU  98  -6.798  -2.101   1.084
  785   1HB   LEU  98          2HB       LEU  98  -4.090  -0.842   0.666
  786   2HB   LEU  98          1HB       LEU  98  -4.314  -2.590   0.554
  787    HG   LEU  98           HG       LEU  98  -6.390  -1.134  -0.888
  788   1HD1  LEU  98          1HD1      LEU  98  -3.789  -0.022  -1.066
  789   2HD1  LEU  98          2HD1      LEU  98  -5.186   0.342  -2.078
  790   3HD1  LEU  98          3HD1      LEU  98  -4.055  -0.925  -2.557
  791   1HD2  LEU  98          1HD2      LEU  98  -5.185  -2.650  -2.732
  792   2HD2  LEU  98          2HD2      LEU  98  -6.233  -3.354  -1.499
  793   3HD2  LEU  98          3HD2      LEU  98  -4.481  -3.397  -1.297
  794    H    LYS  99           H        LYS  99  -5.437  -0.360   3.669
  795    HA   LYS  99           HA       LYS  99  -4.227  -2.647   5.001
  796   1HB   LYS  99          2HB       LYS  99  -3.790  -0.034   5.295
  797   2HB   LYS  99          1HB       LYS  99  -5.054  -0.208   6.514
  798   1HG   LYS  99          2HG       LYS  99  -3.382  -2.407   6.938
  799   2HG   LYS  99          1HG       LYS  99  -2.275  -1.074   6.610
  800   1HD   LYS  99          2HD       LYS  99  -4.578  -0.643   8.488
  801   2HD   LYS  99          1HD       LYS  99  -3.135  -1.478   9.065
  802   1HE   LYS  99          2HE       LYS  99  -1.731   0.396   8.508
  803   2HE   LYS  99          1HE       LYS  99  -3.047   1.200   7.654
  804   1HZ   LYS  99          1HZ       LYS  99  -2.521   1.017  10.501
  805   2HZ   LYS  99          2HZ       LYS  99  -4.148   0.827  10.050
  806   3HZ   LYS  99          3HZ       LYS  99  -3.304   2.236   9.616
  807    H    LYS 100           H        LYS 100  -7.381  -1.542   4.496
  808    HA   LYS 100           HA       LYS 100  -8.367  -2.972   6.929
  809   1HB   LYS 100          2HB       LYS 100  -9.372  -0.650   5.344
  810   2HB   LYS 100          1HB       LYS 100 -10.576  -1.736   6.038
  811   1HG   LYS 100          2HG       LYS 100 -10.322  -0.576   7.959
  812   2HG   LYS 100          1HG       LYS 100  -8.755  -1.372   8.109
  813   1HD   LYS 100          2HD       LYS 100  -8.513   1.077   8.284
  814   2HD   LYS 100          1HD       LYS 100  -7.697   0.466   6.845
  815   1HE   LYS 100          2HE       LYS 100  -9.188   1.452   5.411
  816   2HE   LYS 100          1HE       LYS 100 -10.549   1.238   6.513
  817   1HZ   LYS 100          1HZ       LYS 100  -9.902   3.082   7.774
  818   2HZ   LYS 100          2HZ       LYS 100  -9.725   3.586   6.161
  819   3HZ   LYS 100          3HZ       LYS 100  -8.360   3.147   7.072
  820    H    ALA 101           H        ALA 101  -8.796  -2.630   3.413
  821    HA   ALA 101           HA       ALA 101 -10.750  -4.778   3.300
  822   1HB   ALA 101          1HB       ALA 101  -9.284  -3.144   1.238
  823   2HB   ALA 101          2HB       ALA 101 -11.011  -3.170   1.595
  824   3HB   ALA 101          3HB       ALA 101 -10.261  -4.536   0.769
  825    H    THR 102           H        THR 102  -7.407  -4.432   2.050
  826    HA   THR 102           HA       THR 102  -7.254  -7.396   1.891
  827    HB   THR 102           HB       THR 102  -4.877  -6.461   0.883
  828    HG1  THR 102           HG1      THR 102  -5.112  -4.490   0.234
  829   1HG2  THR 102          1HG2      THR 102  -7.557  -7.017  -0.382
  830   2HG2  THR 102          2HG2      THR 102  -6.126  -8.048  -0.336
  831   3HG2  THR 102          3HG2      THR 102  -6.148  -6.617  -1.366
  832    H    ASN 103           H        ASN 103  -7.127  -5.912   4.454
  833    HA   ASN 103           HA       ASN 103  -4.812  -7.263   5.540
  834   1HB   ASN 103          2HB       ASN 103  -3.888  -5.097   4.529
  835   2HB   ASN 103          1HB       ASN 103  -4.790  -4.253   5.788
  836   1HD2  ASN 103          1HD2      ASN 103  -2.436  -6.971   5.460
  837   2HD2  ASN 103          2HD2      ASN 103  -1.624  -6.635   6.913
  838    H    GLU 104           HN       GLU 104  -7.104  -7.925   6.418
  839    HA   GLU 104           HA       GLU 104  -8.077  -6.120   8.545
  840   1HB   GLU 104          2HB       GLU 104  -9.002  -8.827   7.544
  841   2HB   GLU 104          1HB       GLU 104  -9.744  -7.997   8.912
  842   1HG   GLU 104          2HG       GLU 104  -9.988  -5.982   7.308
  843   2HG   GLU 104          1HG       GLU 104  -9.671  -7.144   6.020
  844    HHA  HEC 105           HHA      HEC 105   4.091  -2.963  -9.216
  845    HHB  HEC 105           HHB      HEC 105   1.233   0.856  -5.065
  846    HHC  HEC 105           HHC      HEC 105  -1.718   3.821  -9.813
  847    HHD  HEC 105           HHD      HEC 105   1.029  -0.090 -13.942
  848   1HMA  HEC 105          1HMA      HEC 105   3.631  -0.363  -4.131
  849   2HMA  HEC 105          2HMA      HEC 105   3.395  -2.112  -4.150
  850   3HMA  HEC 105          3HMA      HEC 105   2.006  -1.035  -3.995
  851   1HAA  HEC 105          1HAA      HEC 105   4.992  -2.793  -5.682
  852   2HAA  HEC 105          2HAA      HEC 105   5.001  -3.238  -7.380
  853   1HBA  HEC 105          1HBA      HEC 105   2.651  -4.343  -6.663
  854   2HBA  HEC 105          2HBA      HEC 105   3.498  -4.436  -5.117
  855   1HMB  HEC 105          1HMB      HEC 105  -0.493   3.971  -4.624
  856   2HMB  HEC 105          2HMB      HEC 105   0.224   2.403  -4.253
  857   3HMB  HEC 105          3HMB      HEC 105  -1.522   2.547  -4.463
  858    HAB  HEC 105           HAB      HEC 105  -2.149   4.883  -8.084
  859   1HBB  HEC 105          1HBB      HEC 105  -0.549   5.534  -6.123
  860   2HBB  HEC 105          2HBB      HEC 105  -1.977   5.170  -5.155
  861   3HBB  HEC 105          3HBB      HEC 105  -2.061   6.390  -6.425
  862   1HMC  HEC 105          1HMC      HEC 105  -2.963   3.415 -12.983
  863   2HMC  HEC 105          2HMC      HEC 105  -2.350   4.355 -11.622
  864   3HMC  HEC 105          3HMC      HEC 105  -1.620   4.534 -13.218
  865    HAC  HEC 105           HAC      HEC 105   0.083   1.385 -15.034
  866   1HBC  HEC 105          1HBC      HEC 105  -2.012   3.398 -15.310
  867   2HBC  HEC 105          2HBC      HEC 105  -0.493   3.184 -16.179
  868   3HBC  HEC 105          3HBC      HEC 105  -0.499   3.950 -14.591
  869   1HMD  HEC 105          1HMD      HEC 105   3.576  -1.469 -14.642
  870   2HMD  HEC 105          2HMD      HEC 105   3.116  -3.147 -14.347
  871   3HMD  HEC 105          3HMD      HEC 105   1.877  -1.939 -14.691
  872   1HAD  HEC 105          1HAD      HEC 105   4.189  -4.220 -10.999
  873   2HAD  HEC 105          2HAD      HEC 105   4.021  -4.177 -12.747
  874   1HBD  HEC 105          1HBD      HEC 105   6.359  -3.736 -11.321
  875   2HBD  HEC 105          2HBD      HEC 105   5.838  -2.114 -11.765
  Start of MODEL   15
    1   1H    GLY   1          1HT       GLY   1  -8.685  10.404   8.019
    2   2H    GLY   1          2HT       GLY   1  -9.994   9.946   9.002
    3   3H    GLY   1          3HT       GLY   1  -9.797  11.572   8.548
    4   1HA   GLY   1          1HA       GLY   1 -10.959  11.276   6.705
    5   2HA   GLY   1          2HA       GLY   1  -9.892   9.953   6.236
    6    H    ASP   2           H        ASP   2 -11.565   8.569   5.521
    7    HA   ASP   2           HA       ASP   2 -13.039   7.224   7.694
    8   1HB   ASP   2          2HB       ASP   2 -14.293   9.182   6.064
    9   2HB   ASP   2          1HB       ASP   2 -14.891   7.611   5.530
   10    H    VAL   3           H        VAL   3 -14.570   5.487   6.338
   11    HA   VAL   3           HA       VAL   3 -12.579   4.004   4.706
   12    HB   VAL   3           HB       VAL   3 -13.752   2.939   6.695
   13   1HG1  VAL   3          1HG1      VAL   3 -16.078   2.117   6.204
   14   2HG1  VAL   3          2HG1      VAL   3 -16.093   3.157   4.780
   15   3HG1  VAL   3          3HG1      VAL   3 -15.974   3.867   6.390
   16   1HG2  VAL   3          1HG2      VAL   3 -13.433   0.927   5.685
   17   2HG2  VAL   3          2HG2      VAL   3 -12.951   1.879   4.282
   18   3HG2  VAL   3          3HG2      VAL   3 -14.605   1.280   4.415
   19    H    GLU   4           H        GLU   4 -15.810   5.412   4.525
   20    HA   GLU   4           HA       GLU   4 -16.526   4.263   1.990
   21   1HB   GLU   4          2HB       GLU   4 -17.448   6.709   3.503
   22   2HB   GLU   4          1HB       GLU   4 -18.091   6.313   1.909
   23   1HG   GLU   4          2HG       GLU   4 -18.018   4.066   3.836
   24   2HG   GLU   4          1HG       GLU   4 -19.148   5.363   4.229
   25    H    LYS   5           H        LYS   5 -14.887   7.287   2.897
   26    HA   LYS   5           HA       LYS   5 -14.737   8.298   0.193
   27   1HB   LYS   5          2HB       LYS   5 -13.657   9.033   2.844
   28   2HB   LYS   5          1HB       LYS   5 -12.649   9.506   1.476
   29   1HG   LYS   5          2HG       LYS   5 -15.128  10.204   0.564
   30   2HG   LYS   5          1HG       LYS   5 -15.303  10.510   2.293
   31   1HD   LYS   5          2HD       LYS   5 -13.089  11.592   0.522
   32   2HD   LYS   5          1HD       LYS   5 -14.460  12.517   1.136
   33   1HE   LYS   5          2HE       LYS   5 -13.533  12.744   3.193
   34   2HE   LYS   5          1HE       LYS   5 -12.990  11.066   3.227
   35   1HZ   LYS   5          1HZ       LYS   5 -11.039  12.303   3.157
   36   2HZ   LYS   5          2HZ       LYS   5 -11.654  13.408   2.021
   37   3HZ   LYS   5          3HZ       LYS   5 -11.259  11.826   1.544
   38    H    GLY   6           H        GLY   6 -12.185   6.937   2.313
   39   1HA   GLY   6          1HA       GLY   6 -10.135   6.760   0.426
   40   2HA   GLY   6          2HA       GLY   6 -10.327   5.612   1.751
   41    H    LYS   7           H        LYS   7 -12.917   4.618   0.847
   42    HA   LYS   7           HA       LYS   7 -12.077   2.481  -0.815
   43   1HB   LYS   7          2HB       LYS   7 -14.135   2.436   0.581
   44   2HB   LYS   7          1HB       LYS   7 -14.887   3.588  -0.523
   45   1HG   LYS   7          2HG       LYS   7 -14.299   1.877  -2.380
   46   2HG   LYS   7          1HG       LYS   7 -14.079   0.732  -1.056
   47   1HD   LYS   7          2HD       LYS   7 -16.441   1.671  -0.295
   48   2HD   LYS   7          1HD       LYS   7 -16.582   2.071  -2.007
   49   1HE   LYS   7          2HE       LYS   7 -15.890  -0.332  -2.498
   50   2HE   LYS   7          1HE       LYS   7 -16.117  -0.656  -0.780
   51   1HZ   LYS   7          1HZ       LYS   7 -18.057  -0.583  -2.770
   52   2HZ   LYS   7          2HZ       LYS   7 -18.340   0.759  -1.767
   53   3HZ   LYS   7          3HZ       LYS   7 -18.288  -0.804  -1.104
   54    H    LYS   8           H        LYS   8 -13.781   5.498  -1.680
   55    HA   LYS   8           HA       LYS   8 -13.839   4.842  -4.510
   56   1HB   LYS   8          2HB       LYS   8 -14.607   7.139  -2.801
   57   2HB   LYS   8          1HB       LYS   8 -14.164   7.539  -4.460
   58   1HG   LYS   8          2HG       LYS   8 -15.764   5.808  -5.272
   59   2HG   LYS   8          1HG       LYS   8 -16.254   5.517  -3.603
   60   1HD   LYS   8          2HD       LYS   8 -17.642   7.286  -3.650
   61   2HD   LYS   8          1HD       LYS   8 -16.328   8.348  -4.160
   62   1HE   LYS   8          2HE       LYS   8 -17.293   8.484  -6.188
   63   2HE   LYS   8          1HE       LYS   8 -16.968   6.765  -6.410
   64   1HZ   LYS   8          1HZ       LYS   8 -19.443   8.053  -6.011
   65   2HZ   LYS   8          2HZ       LYS   8 -19.171   6.963  -4.736
   66   3HZ   LYS   8          3HZ       LYS   8 -19.138   6.419  -6.345
   67    H    ILE   9           H        ILE   9 -11.583   6.445  -2.367
   68    HA   ILE   9           HA       ILE   9 -10.073   7.892  -4.295
   69    HB   ILE   9           HB       ILE   9  -9.103   6.538  -1.759
   70   1HG1  ILE   9          2HG1      ILE   9 -10.152   9.336  -2.298
   71   2HG1  ILE   9          1HG1      ILE   9 -10.960   8.091  -1.345
   72   1HG2  ILE   9          1HG2      ILE   9  -7.185   7.133  -3.039
   73   2HG2  ILE   9          2HG2      ILE   9  -7.409   8.465  -1.904
   74   3HG2  ILE   9          3HG2      ILE   9  -7.923   8.641  -3.583
   75   1HD1  ILE   9          1HD1      ILE   9  -8.432   9.604  -0.698
   76   2HD1  ILE   9          2HD1      ILE   9  -8.797   8.062   0.078
   77   3HD1  ILE   9          3HD1      ILE   9  -9.891   9.431   0.279
   78    H    PHE  10           H        PHE  10  -9.467   4.605  -2.984
   79    HA   PHE  10           HA       PHE  10  -7.381   4.071  -4.935
   80   1HB   PHE  10          2HB       PHE  10  -7.466   2.919  -2.736
   81   2HB   PHE  10          1HB       PHE  10  -8.971   2.137  -3.218
   82    HD1  PHE  10           HD1      PHE  10  -8.885   0.858  -5.544
   83    HD2  PHE  10           HD2      PHE  10  -5.447   1.815  -3.148
   84    HE1  PHE  10           HE1      PHE  10  -7.589  -0.918  -6.690
   85    HE2  PHE  10           HE2      PHE  10  -4.157   0.033  -4.294
   86    HZ   PHE  10           HZ       PHE  10  -5.229  -1.332  -6.065
   87    H    ILE  11           H        ILE  11 -10.776   3.045  -4.567
   88    HA   ILE  11           HA       ILE  11 -10.941   1.400  -6.858
   89    HB   ILE  11           HB       ILE  11 -13.012   3.150  -5.513
   90   1HG1  ILE  11          2HG1      ILE  11 -12.072   1.220  -4.238
   91   2HG1  ILE  11          1HG1      ILE  11 -13.787   1.015  -4.601
   92   1HG2  ILE  11          1HG2      ILE  11 -13.452   1.016  -7.625
   93   2HG2  ILE  11          2HG2      ILE  11 -13.572   2.751  -7.919
   94   3HG2  ILE  11          3HG2      ILE  11 -14.700   1.963  -6.815
   95   1HD1  ILE  11          1HD1      ILE  11 -11.709  -0.772  -5.230
   96   2HD1  ILE  11          2HD1      ILE  11 -12.155  -0.021  -6.763
   97   3HD1  ILE  11          3HD1      ILE  11 -13.377  -0.849  -5.796
   98    H    MET  12           H        MET  12 -10.512   4.801  -6.649
   99    HA   MET  12           HA       MET  12 -11.175   5.037  -9.557
  100   1HB   MET  12          2HB       MET  12 -12.639   6.372  -7.973
  101   2HB   MET  12          1HB       MET  12 -11.199   7.291  -7.534
  102   1HG   MET  12          2HG       MET  12 -11.027   7.420 -10.236
  103   2HG   MET  12          1HG       MET  12 -12.779   7.338 -10.046
  104   1HE   MET  12          1HE       MET  12 -10.811  10.215 -11.022
  105   2HE   MET  12          2HE       MET  12  -9.783   9.047 -10.197
  106   3HE   MET  12          3HE       MET  12  -9.952  10.675  -9.546
  107    H    LYS  13           H        LYS  13  -8.685   5.024  -7.292
  108    HA   LYS  13           HA       LYS  13  -7.004   6.878  -8.905
  109   1HB   LYS  13          2HB       LYS  13  -7.009   7.217  -6.454
  110   2HB   LYS  13          1HB       LYS  13  -6.441   5.564  -6.230
  111   1HG   LYS  13          2HG       LYS  13  -4.555   7.144  -6.127
  112   2HG   LYS  13          1HG       LYS  13  -4.404   6.084  -7.528
  113   1HD   LYS  13          2HD       LYS  13  -3.920   8.377  -8.203
  114   2HD   LYS  13          1HD       LYS  13  -5.438   7.867  -8.939
  115   1HE   LYS  13          2HE       LYS  13  -6.638   8.951  -6.989
  116   2HE   LYS  13          1HE       LYS  13  -5.083   9.625  -6.499
  117   1HZ   LYS  13          1HZ       LYS  13  -4.955  10.923  -8.389
  118   2HZ   LYS  13          2HZ       LYS  13  -6.607  11.010  -8.004
  119   3HZ   LYS  13          3HZ       LYS  13  -6.075   9.986  -9.252
  120    H    CYS  14           H        CYS  14  -6.425   3.759  -7.226
  121    HA   CYS  14           HA       CYS  14  -4.783   2.975  -9.600
  122   1HB   CYS  14          2HB       CYS  14  -4.376   1.303  -7.248
  123   2HB   CYS  14          1HB       CYS  14  -3.188   2.189  -8.195
  124    H    SER  15           H        SER  15  -7.721   2.653  -9.266
  125    HA   SER  15           HA       SER  15  -8.044  -0.257  -8.872
  126   1HB   SER  15          2HB       SER  15  -9.701   1.681  -8.201
  127   2HB   SER  15          1HB       SER  15 -10.228   1.537  -9.873
  128    HG   SER  15           HG       SER  15 -11.131  -0.306  -9.407
  129    H    GLN  16           H        GLN  16  -7.026   1.661 -11.365
  130    HA   GLN  16           HA       GLN  16  -8.418   0.138 -13.491
  131   1HB   GLN  16          2HB       GLN  16  -6.398   2.399 -13.649
  132   2HB   GLN  16          1HB       GLN  16  -7.248   1.691 -15.019
  133   1HG   GLN  16          2HG       GLN  16  -8.471   3.196 -12.694
  134   2HG   GLN  16          1HG       GLN  16  -8.438   3.695 -14.386
  135   1HE2  GLN  16          1HE2      GLN  16  -9.327   1.609 -15.835
  136   2HE2  GLN  16          2HE2      GLN  16 -10.839   1.051 -15.302
  137    H    CYS  17           H        CYS  17  -5.242   0.598 -12.033
  138    HA   CYS  17           HA       CYS  17  -4.148  -1.517 -13.820
  139   1HB   CYS  17          2HB       CYS  17  -2.897   0.675 -12.175
  140   2HB   CYS  17          1HB       CYS  17  -1.943  -0.732 -12.647
  141    H    HIS  18           H        HIS  18  -5.015  -0.779 -10.512
  142    HA   HIS  18           HA       HIS  18  -4.023  -3.493  -9.721
  143   1HB   HIS  18          2HB       HIS  18  -4.449  -1.047  -7.980
  144   2HB   HIS  18          1HB       HIS  18  -3.997  -2.640  -7.386
  145    HD1  HIS  18           HD1      HIS  18  -1.549  -3.329  -7.605
  146    HD2  HIS  18           HD2      HIS  18  -2.419   0.245  -9.548
  147    HE1  HIS  18           HE1      HIS  18   0.678  -2.314  -8.268
  148    H    THR  19           H        THR  19  -6.139  -4.273 -10.587
  149    HA   THR  19           HA       THR  19  -8.564  -3.399  -9.207
  150    HB   THR  19           HB       THR  19  -9.698  -5.057 -10.532
  151    HG1  THR  19           HG1      THR  19  -7.125  -6.159 -10.657
  152   1HG2  THR  19          1HG2      THR  19  -7.498  -3.526 -11.848
  153   2HG2  THR  19          2HG2      THR  19  -9.244  -3.376 -12.046
  154   3HG2  THR  19          3HG2      THR  19  -8.380  -4.701 -12.824
  155    H    VAL  20           H        VAL  20  -8.232  -3.803  -7.002
  156    HA   VAL  20           HA       VAL  20  -7.261  -6.407  -6.095
  157    HB   VAL  20           HB       VAL  20  -7.234  -5.466  -3.942
  158   1HG1  VAL  20          1HG1      VAL  20  -7.102  -2.958  -5.615
  159   2HG1  VAL  20          2HG1      VAL  20  -5.870  -4.215  -5.733
  160   3HG1  VAL  20          3HG1      VAL  20  -6.139  -3.384  -4.201
  161   1HG2  VAL  20          1HG2      VAL  20  -8.602  -3.231  -3.613
  162   2HG2  VAL  20          2HG2      VAL  20  -9.426  -4.785  -3.489
  163   3HG2  VAL  20          3HG2      VAL  20  -9.544  -3.839  -4.974
  164    H    GLU  21           H        GLU  21  -9.926  -6.121  -7.604
  165    HA   GLU  21           HA       GLU  21 -11.419  -7.907  -5.799
  166   1HB   GLU  21          2HB       GLU  21 -12.294  -5.150  -6.552
  167   2HB   GLU  21          1HB       GLU  21 -13.520  -6.418  -6.510
  168   1HG   GLU  21          2HG       GLU  21 -12.284  -6.965  -4.187
  169   2HG   GLU  21          1HG       GLU  21 -11.936  -5.238  -4.279
  170    H    LYS  22           H        LYS  22 -10.057  -7.783  -8.573
  171    HA   LYS  22           HA       LYS  22 -12.342  -8.361 -10.351
  172   1HB   LYS  22          2HB       LYS  22 -10.451  -7.100 -11.269
  173   2HB   LYS  22          1HB       LYS  22  -9.349  -8.412 -10.849
  174   1HG   LYS  22          2HG       LYS  22 -10.524  -9.928 -12.367
  175   2HG   LYS  22          1HG       LYS  22 -11.701  -8.671 -12.746
  176   1HD   LYS  22          2HD       LYS  22  -8.971  -7.728 -13.119
  177   2HD   LYS  22          1HD       LYS  22  -9.307  -9.152 -14.104
  178   1HE   LYS  22          2HE       LYS  22 -11.428  -8.018 -14.871
  179   2HE   LYS  22          1HE       LYS  22 -10.876  -6.562 -14.042
  180   1HZ   LYS  22          1HZ       LYS  22  -8.715  -7.108 -15.432
  181   2HZ   LYS  22          2HZ       LYS  22  -9.986  -6.177 -16.069
  182   3HZ   LYS  22          3HZ       LYS  22  -9.853  -7.824 -16.465
  183    H    GLY  23           H        GLY  23 -10.159 -10.057  -8.300
  184   1HA   GLY  23          2HA       GLY  23 -11.130 -12.454  -7.973
  185   2HA   GLY  23          1HA       GLY  23 -10.760 -12.627  -9.690
  186    H    GLY  24           H        GLY  24  -8.309 -10.902  -9.353
  187   1HA   GLY  24          1HA       GLY  24  -6.311 -11.349  -7.743
  188   2HA   GLY  24          2HA       GLY  24  -6.585 -13.037  -8.177
  189    H    LYS  25           H        LYS  25  -7.364 -11.327 -10.887
  190    HA   LYS  25           HA       LYS  25  -4.763 -11.958 -12.126
  191   1HB   LYS  25          2HB       LYS  25  -7.237 -12.304 -13.064
  192   2HB   LYS  25          1HB       LYS  25  -6.988 -10.656 -13.637
  193   1HG   LYS  25          2HG       LYS  25  -5.963 -11.639 -15.412
  194   2HG   LYS  25          1HG       LYS  25  -4.605 -11.860 -14.306
  195   1HD   LYS  25          2HD       LYS  25  -5.545 -14.066 -13.637
  196   2HD   LYS  25          1HD       LYS  25  -6.832 -13.852 -14.824
  197   1HE   LYS  25          2HE       LYS  25  -4.650 -13.370 -16.376
  198   2HE   LYS  25          1HE       LYS  25  -3.981 -14.537 -15.235
  199   1HZ   LYS  25          1HZ       LYS  25  -6.115 -14.873 -17.205
  200   2HZ   LYS  25          2HZ       LYS  25  -6.238 -15.747 -15.753
  201   3HZ   LYS  25          3HZ       LYS  25  -4.880 -15.944 -16.755
  202    H    HIS  26           H        HIS  26  -3.775 -10.261 -13.604
  203    HA   HIS  26           HA       HIS  26  -4.304  -7.498 -12.620
  204   1HB   HIS  26          2HB       HIS  26  -1.626  -7.386 -12.977
  205   2HB   HIS  26          1HB       HIS  26  -2.372  -7.739 -11.424
  206    HD1  HIS  26           HD1      HIS  26  -2.020 -10.089 -14.394
  207    HD2  HIS  26           HD2      HIS  26  -0.671  -9.735 -10.461
  208    HE1  HIS  26           HE1      HIS  26  -0.750 -12.217 -13.877
  209    H    LYS  27           H        LYS  27  -4.978  -6.454 -14.432
  210    HA   LYS  27           HA       LYS  27  -4.168  -7.216 -17.095
  211   1HB   LYS  27          2HB       LYS  27  -6.313  -6.151 -16.823
  212   2HB   LYS  27          1HB       LYS  27  -5.582  -4.768 -16.008
  213   1HG   LYS  27          2HG       LYS  27  -4.779  -3.860 -17.970
  214   2HG   LYS  27          1HG       LYS  27  -4.596  -5.434 -18.745
  215   1HD   LYS  27          2HD       LYS  27  -7.205  -5.518 -18.631
  216   2HD   LYS  27          1HD       LYS  27  -7.082  -3.771 -18.421
  217   1HE   LYS  27          2HE       LYS  27  -7.259  -4.024 -20.757
  218   2HE   LYS  27          1HE       LYS  27  -5.524  -3.845 -20.495
  219   1HZ   LYS  27          1HZ       LYS  27  -7.062  -6.236 -21.204
  220   2HZ   LYS  27          2HZ       LYS  27  -5.659  -6.429 -20.267
  221   3HZ   LYS  27          3HZ       LYS  27  -5.566  -5.698 -21.797
  222    H    THR  28           H        THR  28  -3.770  -3.973 -15.661
  223    HA   THR  28           HA       THR  28  -1.112  -3.818 -16.998
  224    HB   THR  28           HB       THR  28  -2.805  -1.630 -15.744
  225    HG1  THR  28           HG1      THR  28  -2.652  -2.766 -18.262
  226   1HG2  THR  28          1HG2      THR  28  -0.720  -0.673 -15.682
  227   2HG2  THR  28          2HG2      THR  28  -1.092  -0.353 -17.377
  228   3HG2  THR  28          3HG2      THR  28  -0.083  -1.732 -16.941
  229    H    GLY  29           H        GLY  29  -2.591  -2.778 -13.904
  230   1HA   GLY  29          2HA       GLY  29   0.033  -2.811 -12.592
  231   2HA   GLY  29          1HA       GLY  29  -1.500  -2.391 -11.833
  232    HA   PRO  30           HA       PRO  30  -0.143  -6.925 -11.070
  233   1HB   PRO  30          2HB       PRO  30   1.052  -6.584  -8.609
  234   2HB   PRO  30          1HB       PRO  30   1.933  -6.614 -10.148
  235   1HG   PRO  30          2HG       PRO  30   1.161  -4.249  -8.470
  236   2HG   PRO  30          1HG       PRO  30   2.617  -4.502  -9.452
  237   1HD   PRO  30          2HD       PRO  30   0.488  -2.948 -10.285
  238   2HD   PRO  30          1HD       PRO  30   1.601  -3.774 -11.390
  239    H    ASN  31           H        ASN  31  -1.502  -8.216  -9.855
  240    HA   ASN  31           HA       ASN  31  -3.899  -7.177  -8.806
  241   1HB   ASN  31          2HB       ASN  31  -3.732  -9.493  -9.497
  242   2HB   ASN  31          1HB       ASN  31  -2.511  -9.817  -8.267
  243   1HD2  ASN  31          1HD2      ASN  31  -5.715  -8.138  -8.170
  244   2HD2  ASN  31          2HD2      ASN  31  -6.314  -9.050  -6.872
  245    H    LEU  32           H        LEU  32  -3.692  -5.616  -7.218
  246    HA   LEU  32           HA       LEU  32  -1.945  -6.050  -4.913
  247   1HB   LEU  32          2HB       LEU  32  -3.370  -3.818  -6.114
  248   2HB   LEU  32          1HB       LEU  32  -3.605  -3.866  -4.368
  249    HG   LEU  32           HG       LEU  32  -1.303  -3.661  -3.926
  250   1HD1  LEU  32          1HD1      LEU  32   0.104  -3.733  -6.320
  251   2HD1  LEU  32          2HD1      LEU  32  -1.067  -5.041  -6.493
  252   3HD1  LEU  32          3HD1      LEU  32   0.043  -5.026  -5.122
  253   1HD2  LEU  32          1HD2      LEU  32  -2.423  -1.939  -6.010
  254   2HD2  LEU  32          2HD2      LEU  32  -0.661  -1.992  -6.059
  255   3HD2  LEU  32          3HD2      LEU  32  -1.487  -1.501  -4.581
  256    H    HIS  33           H        HIS  33  -3.593  -8.146  -4.817
  257    HA   HIS  33           HA       HIS  33  -5.904  -7.437  -3.092
  258   1HB   HIS  33          2HB       HIS  33  -6.689  -9.670  -3.470
  259   2HB   HIS  33          1HB       HIS  33  -6.110  -9.082  -5.027
  260    HD1  HIS  33           HD1      HIS  33  -6.146 -12.078  -4.682
  261    HD2  HIS  33           HD2      HIS  33  -2.866  -9.757  -3.572
  262    HE1  HIS  33           HE1      HIS  33  -4.147 -13.633  -4.647
  263    H    GLY  34           H        GLY  34  -3.532  -6.904  -1.834
  264   1HA   GLY  34          2HA       GLY  34  -3.342  -7.610   0.622
  265   2HA   GLY  34          1HA       GLY  34  -3.126  -9.241  -0.013
  266    H    LEU  35           H        LEU  35  -1.766  -5.982  -0.601
  267    HA   LEU  35           HA       LEU  35   0.804  -7.108  -1.361
  268   1HB   LEU  35          2HB       LEU  35  -0.143  -4.994  -2.333
  269   2HB   LEU  35          1HB       LEU  35   0.101  -4.225  -0.765
  270    HG   LEU  35           HG       LEU  35   2.561  -5.233  -1.090
  271   1HD1  LEU  35          1HD1      LEU  35   1.619  -4.655  -3.915
  272   2HD1  LEU  35          2HD1      LEU  35   1.923  -6.271  -3.276
  273   3HD1  LEU  35          3HD1      LEU  35   3.249  -5.118  -3.426
  274   1HD2  LEU  35          1HD2      LEU  35   2.116  -2.797  -2.720
  275   2HD2  LEU  35          2HD2      LEU  35   3.165  -3.040  -1.324
  276   3HD2  LEU  35          3HD2      LEU  35   1.441  -2.748  -1.092
  277    H    PHE  36           H        PHE  36  -0.615  -5.682   1.522
  278    HA   PHE  36           HA       PHE  36   1.769  -5.138   2.970
  279   1HB   PHE  36          2HB       PHE  36  -0.863  -6.117   4.111
  280   2HB   PHE  36          1HB       PHE  36   0.377  -5.190   4.958
  281    HD1  PHE  36           HD1      PHE  36  -2.730  -4.680   4.001
  282    HD2  PHE  36           HD2      PHE  36   1.158  -3.205   2.919
  283    HE1  PHE  36           HE1      PHE  36  -3.754  -2.572   3.192
  284    HE2  PHE  36           HE2      PHE  36   0.132  -1.097   2.113
  285    HZ   PHE  36           HZ       PHE  36  -2.323  -0.780   2.249
  286    H    GLY  37           H        GLY  37   3.151  -6.435   4.127
  287   1HA   GLY  37          2HA       GLY  37   4.136  -8.385   4.971
  288   2HA   GLY  37          1HA       GLY  37   2.510  -9.051   5.100
  289    H    ARG  38           H        ARG  38   3.769  -7.927   2.017
  290    HA   ARG  38           HA       ARG  38   4.314 -10.743   1.220
  291   1HB   ARG  38          2HB       ARG  38   1.989 -10.347   0.582
  292   2HB   ARG  38          1HB       ARG  38   2.444  -8.851  -0.236
  293   1HG   ARG  38          2HG       ARG  38   3.951 -10.203  -1.726
  294   2HG   ARG  38          1HG       ARG  38   3.295 -11.662  -0.985
  295   1HD   ARG  38          2HD       ARG  38   2.013 -11.313  -2.972
  296   2HD   ARG  38          1HD       ARG  38   0.984 -10.793  -1.636
  297    HE   ARG  38           HE       ARG  38   1.065  -8.618  -2.529
  298   1HH1  ARG  38          1HH2      ARG  38   1.724  -9.650  -5.226
  299   2HH1  ARG  38          2HH2      ARG  38   3.199  -8.822  -5.601
  300   1HH2  ARG  38          1HH1      ARG  38   3.839  -7.915  -2.317
  301   2HH2  ARG  38          2HH1      ARG  38   4.396  -7.843  -3.956
  302    H    LYS  39           H        LYS  39   6.245 -10.802   0.191
  303    HA   LYS  39           HA       LYS  39   7.705  -8.430  -0.495
  304   1HB   LYS  39          2HB       LYS  39   9.377  -9.913  -1.366
  305   2HB   LYS  39          1HB       LYS  39   8.665 -10.741   0.018
  306   1HG   LYS  39          2HG       LYS  39   7.046 -11.437  -2.174
  307   2HG   LYS  39          1HG       LYS  39   8.704 -11.548  -2.765
  308   1HD   LYS  39          2HD       LYS  39   7.899 -12.748  -0.116
  309   2HD   LYS  39          1HD       LYS  39   7.712 -13.644  -1.625
  310   1HE   LYS  39          2HE       LYS  39  10.337 -12.343  -0.906
  311   2HE   LYS  39          1HE       LYS  39   9.925 -13.951  -0.312
  312   1HZ   LYS  39          1HZ       LYS  39  10.319 -14.834  -2.296
  313   2HZ   LYS  39          2HZ       LYS  39  11.012 -13.351  -2.748
  314   3HZ   LYS  39          3HZ       LYS  39   9.381 -13.671  -3.097
  315    H    THR  40           H        THR  40   8.618  -8.269  -2.891
  316    HA   THR  40           HA       THR  40   6.227  -8.084  -4.634
  317    HB   THR  40           HB       THR  40   7.855  -6.145  -4.279
  318    HG1  THR  40           HG1      THR  40   7.393  -5.478  -6.260
  319   1HG2  THR  40          1HG2      THR  40   9.928  -6.198  -5.560
  320   2HG2  THR  40          2HG2      THR  40   9.561  -7.823  -6.139
  321   3HG2  THR  40          3HG2      THR  40   9.909  -7.551  -4.431
  322    H    GLY  41           H        GLY  41   7.148  -8.339  -7.135
  323   1HA   GLY  41          2HA       GLY  41   7.526 -10.016  -8.738
  324   2HA   GLY  41          1HA       GLY  41   9.012 -10.285  -7.830
  325    H    GLN  42           H        GLN  42   5.719 -11.395  -8.329
  326    HA   GLN  42           HA       GLN  42   6.455 -14.025  -7.291
  327   1HB   GLN  42          2HB       GLN  42   4.630 -14.126  -5.613
  328   2HB   GLN  42          1HB       GLN  42   5.842 -12.917  -5.191
  329   1HG   GLN  42          2HG       GLN  42   3.379 -12.168  -6.765
  330   2HG   GLN  42          1HG       GLN  42   3.350 -12.240  -5.005
  331   1HE2  GLN  42          1HE2      GLN  42   4.181 -10.251  -7.672
  332   2HE2  GLN  42          2HE2      GLN  42   5.022  -9.058  -6.810
  333    H    ALA  43           H        ALA  43   3.934 -11.873  -8.550
  334    HA   ALA  43           HA       ALA  43   2.151 -13.993  -9.346
  335   1HB   ALA  43          1HB       ALA  43   0.876 -12.138  -9.532
  336   2HB   ALA  43          2HB       ALA  43   1.683 -11.850 -11.074
  337   3HB   ALA  43          3HB       ALA  43   2.294 -11.092  -9.603
  338    HA   PRO  44           HA       PRO  44   4.406 -15.277 -12.936
  339   1HB   PRO  44          2HB       PRO  44   2.460 -16.937 -13.942
  340   2HB   PRO  44          1HB       PRO  44   3.503 -17.368 -12.575
  341   1HG   PRO  44          2HG       PRO  44   0.630 -16.582 -12.564
  342   2HG   PRO  44          1HG       PRO  44   1.527 -17.570 -11.399
  343   1HD   PRO  44          2HD       PRO  44   0.806 -14.844 -11.074
  344   2HD   PRO  44          1HD       PRO  44   1.942 -15.758 -10.059
  345    H    GLY  45           H        GLY  45   3.890 -15.443 -15.407
  346   1HA   GLY  45          2HA       GLY  45   3.350 -14.208 -17.336
  347   2HA   GLY  45          1HA       GLY  45   1.714 -14.236 -16.676
  348    H    TYR  46           H        TYR  46   4.307 -12.725 -14.897
  349    HA   TYR  46           HA       TYR  46   3.507 -10.023 -15.836
  350   1HB   TYR  46          2HB       TYR  46   2.126 -10.843 -13.771
  351   2HB   TYR  46          1HB       TYR  46   3.624 -10.598 -12.880
  352    HD1  TYR  46           HD1      TYR  46   0.721  -9.104 -13.036
  353    HD2  TYR  46           HD2      TYR  46   4.724  -8.162 -14.249
  354    HE1  TYR  46           HE1      TYR  46   0.199  -6.692 -12.890
  355    HE2  TYR  46           HE2      TYR  46   4.205  -5.753 -14.104
  356    HH   TYR  46           HH       TYR  46   1.007  -4.631 -13.007
  357    H    SER  47           H        SER  47   5.398  -8.963 -16.204
  358    HA   SER  47           HA       SER  47   7.876  -9.909 -14.919
  359   1HB   SER  47          2HB       SER  47   7.319  -8.744 -17.378
  360   2HB   SER  47          1HB       SER  47   8.034  -7.418 -16.465
  361    HG   SER  47           HG       SER  47   9.335  -9.271 -17.659
  362    H    TYR  48           H        TYR  48   6.667  -9.233 -12.800
  363    HA   TYR  48           HA       TYR  48   6.073  -6.671 -11.980
  364   1HB   TYR  48          2HB       TYR  48   7.312  -9.010 -10.591
  365   2HB   TYR  48          1HB       TYR  48   7.307  -7.462  -9.750
  366    HD1  TYR  48           HD1      TYR  48   4.801  -9.042 -12.065
  367    HD2  TYR  48           HD2      TYR  48   5.613  -7.515  -8.145
  368    HE1  TYR  48           HE1      TYR  48   2.428  -9.403 -11.419
  369    HE2  TYR  48           HE2      TYR  48   3.252  -7.870  -7.503
  370    HH   TYR  48           HH       TYR  48   1.317  -8.861  -8.110
  371    H    THR  49           H        THR  49   7.495  -5.236 -10.518
  372    HA   THR  49           HA       THR  49   9.702  -4.261 -12.072
  373    HB   THR  49           HB       THR  49   9.477  -3.554  -9.181
  374    HG1  THR  49           HG1      THR  49   7.699  -2.173 -10.650
  375   1HG2  THR  49          1HG2      THR  49   9.924  -2.118 -11.801
  376   2HG2  THR  49          2HG2      THR  49  11.044  -2.292 -10.449
  377   3HG2  THR  49          3HG2      THR  49   9.630  -1.249 -10.294
  378    H    ALA  50           H        ALA  50  11.126  -6.104 -12.256
  379    HA   ALA  50           HA       ALA  50  12.196  -7.707 -10.265
  380   1HB   ALA  50          1HB       ALA  50  12.792  -7.498 -12.819
  381   2HB   ALA  50          2HB       ALA  50  14.007  -8.105 -11.695
  382   3HB   ALA  50          3HB       ALA  50  14.069  -6.429 -12.240
  383    H    ALA  51           H        ALA  51  12.919  -4.331 -10.950
  384    HA   ALA  51           HA       ALA  51  15.195  -3.915  -9.370
  385   1HB   ALA  51          1HB       ALA  51  14.723  -1.878 -10.227
  386   2HB   ALA  51          2HB       ALA  51  13.620  -1.674  -8.866
  387   3HB   ALA  51          3HB       ALA  51  13.015  -2.273 -10.410
  388    H    ASN  52           H        ASN  52  11.815  -3.432  -8.247
  389    HA   ASN  52           HA       ASN  52  12.382  -3.081  -5.521
  390   1HB   ASN  52          2HB       ASN  52  10.123  -2.854  -6.646
  391   2HB   ASN  52          1HB       ASN  52   9.998  -4.611  -6.596
  392   1HD2  ASN  52          1HD2      ASN  52   9.463  -1.747  -4.778
  393   2HD2  ASN  52          2HD2      ASN  52   9.181  -2.482  -3.275
  394    H    LYS  53           H        LYS  53  11.557  -6.143  -7.176
  395    HA   LYS  53           HA       LYS  53  11.807  -7.908  -5.033
  396   1HB   LYS  53          2HB       LYS  53  11.184  -8.571  -7.354
  397   2HB   LYS  53          1HB       LYS  53  12.870  -8.379  -7.835
  398   1HG   LYS  53          2HG       LYS  53  13.191 -10.521  -7.214
  399   2HG   LYS  53          1HG       LYS  53  12.971  -9.987  -5.546
  400   1HD   LYS  53          2HD       LYS  53  10.376 -10.155  -6.398
  401   2HD   LYS  53          1HD       LYS  53  11.121 -11.474  -7.302
  402   1HE   LYS  53          2HE       LYS  53  11.367 -11.065  -4.307
  403   2HE   LYS  53          1HE       LYS  53  10.290 -12.224  -5.084
  404   1HZ   LYS  53          1HZ       LYS  53  12.414 -13.202  -4.356
  405   2HZ   LYS  53          2HZ       LYS  53  13.238 -12.176  -5.432
  406   3HZ   LYS  53          3HZ       LYS  53  12.163 -13.351  -6.026
  407    H    ASN  54           H        ASN  54  14.363  -6.296  -6.843
  408    HA   ASN  54           HA       ASN  54  16.493  -7.810  -5.592
  409   1HB   ASN  54          2HB       ASN  54  16.826  -6.814  -7.809
  410   2HB   ASN  54          1HB       ASN  54  16.560  -5.205  -7.137
  411   1HD2  ASN  54          1HD2      ASN  54  18.908  -5.020  -8.134
  412   2HD2  ASN  54          2HD2      ASN  54  20.187  -5.390  -7.083
  413    H    LYS  55           H        LYS  55  14.905  -4.690  -5.016
  414    HA   LYS  55           HA       LYS  55  16.760  -3.695  -3.104
  415   1HB   LYS  55          2HB       LYS  55  14.684  -2.559  -4.210
  416   2HB   LYS  55          1HB       LYS  55  13.800  -3.242  -2.847
  417   1HG   LYS  55          2HG       LYS  55  14.463  -1.078  -2.119
  418   2HG   LYS  55          1HG       LYS  55  15.609  -2.183  -1.357
  419   1HD   LYS  55          2HD       LYS  55  16.979  -1.765  -3.594
  420   2HD   LYS  55          1HD       LYS  55  16.039  -0.272  -3.621
  421   1HE   LYS  55          2HE       LYS  55  16.825   0.306  -1.381
  422   2HE   LYS  55          1HE       LYS  55  17.690  -1.226  -1.264
  423   1HZ   LYS  55          1HZ       LYS  55  18.464   1.198  -2.562
  424   2HZ   LYS  55          2HZ       LYS  55  18.561  -0.138  -3.607
  425   3HZ   LYS  55          3HZ       LYS  55  19.407  -0.145  -2.134
  426    H    GLY  56           H        GLY  56  14.710  -6.414  -2.948
  427   1HA   GLY  56          1HA       GLY  56  14.156  -7.856  -1.179
  428   2HA   GLY  56          2HA       GLY  56  15.557  -7.178  -0.344
  429    H    ILE  57           H        ILE  57  12.772  -5.354  -1.486
  430    HA   ILE  57           HA       ILE  57  12.379  -4.281   1.228
  431    HB   ILE  57           HB       ILE  57  12.329  -2.877  -0.889
  432   1HG1  ILE  57          2HG1      ILE  57  11.347  -2.158   1.315
  433   2HG1  ILE  57          1HG1      ILE  57  10.548  -1.440  -0.082
  434   1HG2  ILE  57          1HG2      ILE  57  10.662  -4.815  -1.828
  435   2HG2  ILE  57          2HG2      ILE  57  10.737  -3.181  -2.487
  436   3HG2  ILE  57          3HG2      ILE  57   9.492  -3.601  -1.313
  437   1HD1  ILE  57          1HD1      ILE  57   8.656  -2.155   0.986
  438   2HD1  ILE  57          2HD1      ILE  57   9.513  -3.409   1.882
  439   3HD1  ILE  57          3HD1      ILE  57   9.052  -3.684   0.202
  440    H    ILE  58           H        ILE  58  10.893  -5.075   2.619
  441    HA   ILE  58           HA       ILE  58   8.936  -7.076   1.667
  442    HB   ILE  58           HB       ILE  58   9.965  -7.671   3.742
  443   1HG1  ILE  58          2HG1      ILE  58   8.099  -7.766   5.275
  444   2HG1  ILE  58          1HG1      ILE  58   7.349  -6.355   4.528
  445   1HG2  ILE  58          1HG2      ILE  58   9.534  -5.834   5.670
  446   2HG2  ILE  58          2HG2      ILE  58   9.670  -4.761   4.277
  447   3HG2  ILE  58          3HG2      ILE  58  10.995  -5.851   4.683
  448   1HD1  ILE  58          1HD1      ILE  58   6.786  -7.538   2.569
  449   2HD1  ILE  58          2HD1      ILE  58   6.460  -8.699   3.857
  450   3HD1  ILE  58          3HD1      ILE  58   7.942  -8.826   2.909
  451    H    TRP  59           H        TRP  59   7.434  -5.868   0.504
  452    HA   TRP  59           HA       TRP  59   6.419  -3.383   0.759
  453   1HB   TRP  59          2HB       TRP  59   5.014  -5.972   0.194
  454   2HB   TRP  59          1HB       TRP  59   4.092  -4.471   0.260
  455    HD1  TRP  59           HD1      TRP  59   5.348  -6.450  -2.296
  456    HE1  TRP  59           HE1      TRP  59   6.258  -5.116  -4.307
  457    HE3  TRP  59           HE3      TRP  59   5.889  -1.853  -0.136
  458    HZ2  TRP  59           HZ2      TRP  59   7.108  -2.452  -4.916
  459    HZ3  TRP  59           HZ3      TRP  59   6.750   0.060  -1.451
  460    HH2  TRP  59           HH2      TRP  59   7.358  -0.231  -3.836
  461    H    GLY  60           H        GLY  60   5.669  -2.173   2.373
  462   1HA   GLY  60          1HA       GLY  60   3.910  -3.391   4.431
  463   2HA   GLY  60          2HA       GLY  60   5.350  -2.530   4.978
  464    H    GLU  61           H        GLU  61   3.601  -1.143   6.034
  465    HA   GLU  61           HA       GLU  61   1.950   0.532   4.334
  466   1HB   GLU  61          2HB       GLU  61   2.414   0.166   7.198
  467   2HB   GLU  61          1HB       GLU  61   2.213   1.864   6.762
  468   1HG   GLU  61          2HG       GLU  61  -0.003   1.557   6.556
  469   2HG   GLU  61          1HG       GLU  61   0.280   0.347   5.304
  470    H    ASP  62           H        ASP  62   4.629   1.476   6.525
  471    HA   ASP  62           HA       ASP  62   5.024   4.023   5.334
  472   1HB   ASP  62          2HB       ASP  62   7.143   4.077   6.530
  473   2HB   ASP  62          1HB       ASP  62   5.925   3.327   7.562
  474    H    THR  63           H        THR  63   6.496   0.870   4.615
  475    HA   THR  63           HA       THR  63   8.477   1.781   2.799
  476    HB   THR  63           HB       THR  63   7.624  -0.648   1.750
  477    HG1  THR  63           HG1      THR  63   6.098  -0.652   3.531
  478   1HG2  THR  63          1HG2      THR  63   9.852  -0.711   2.165
  479   2HG2  THR  63          2HG2      THR  63   9.380  -1.369   3.732
  480   3HG2  THR  63          3HG2      THR  63   9.713   0.355   3.564
  481    H    LEU  64           H        LEU  64   5.034   1.108   2.345
  482    HA   LEU  64           HA       LEU  64   5.135   1.494  -0.540
  483   1HB   LEU  64          2HB       LEU  64   3.210   0.626   1.388
  484   2HB   LEU  64          1HB       LEU  64   2.508   1.966   0.481
  485    HG   LEU  64           HG       LEU  64   3.679  -0.591  -0.637
  486   1HD1  LEU  64          1HD1      LEU  64   1.391  -0.829   0.102
  487   2HD1  LEU  64          2HD1      LEU  64   1.375  -0.708  -1.657
  488   3HD1  LEU  64          3HD1      LEU  64   0.932   0.686  -0.673
  489   1HD2  LEU  64          1HD2      LEU  64   4.284   0.664  -2.425
  490   2HD2  LEU  64          2HD2      LEU  64   3.436   2.081  -1.809
  491   3HD2  LEU  64          3HD2      LEU  64   2.558   0.861  -2.730
  492    H    MET  65           H        MET  65   4.814   3.542   2.250
  493    HA   MET  65           HA       MET  65   3.580   5.782   0.945
  494   1HB   MET  65          2HB       MET  65   3.653   5.528   3.409
  495   2HB   MET  65          1HB       MET  65   5.404   5.736   3.366
  496   1HG   MET  65          2HG       MET  65   5.153   7.970   3.379
  497   2HG   MET  65          1HG       MET  65   4.204   7.881   1.894
  498   1HE   MET  65          1HE       MET  65   3.389   9.749   5.290
  499   2HE   MET  65          2HE       MET  65   4.688   8.564   5.173
  500   3HE   MET  65          3HE       MET  65   3.277   8.217   6.168
  501    H    GLU  66           H        GLU  66   6.971   4.871   1.530
  502    HA   GLU  66           HA       GLU  66   8.008   7.261   0.270
  503   1HB   GLU  66          2HB       GLU  66   9.139   5.640   2.006
  504   2HB   GLU  66          1HB       GLU  66   9.612   4.745   0.562
  505   1HG   GLU  66          2HG       GLU  66  10.637   6.792  -0.372
  506   2HG   GLU  66          1HG       GLU  66  10.173   7.681   1.079
  507    H    TYR  67           H        TYR  67   7.856   3.820  -0.720
  508    HA   TYR  67           HA       TYR  67   8.987   4.046  -3.267
  509   1HB   TYR  67          2HB       TYR  67   8.357   1.866  -2.479
  510   2HB   TYR  67          1HB       TYR  67   6.665   2.342  -2.329
  511    HD1  TYR  67           HD1      TYR  67   5.290   1.442  -3.978
  512    HD2  TYR  67           HD2      TYR  67   9.304   2.574  -5.000
  513    HE1  TYR  67           HE1      TYR  67   4.882   0.769  -6.329
  514    HE2  TYR  67           HE2      TYR  67   8.897   1.900  -7.348
  515    HH   TYR  67           HH       TYR  67   5.687   0.878  -8.435
  516    H    LEU  68           H        LEU  68   5.597   4.674  -2.331
  517    HA   LEU  68           HA       LEU  68   4.837   5.441  -5.023
  518   1HB   LEU  68          2HB       LEU  68   3.506   4.980  -2.553
  519   2HB   LEU  68          1HB       LEU  68   3.107   6.623  -3.065
  520    HG   LEU  68           HG       LEU  68   2.815   5.443  -5.428
  521   1HD1  LEU  68          1HD1      LEU  68   1.658   3.179  -4.898
  522   2HD1  LEU  68          2HD1      LEU  68   2.565   3.235  -3.387
  523   3HD1  LEU  68          3HD1      LEU  68   3.421   3.217  -4.929
  524   1HD2  LEU  68          1HD2      LEU  68   0.457   5.382  -5.012
  525   2HD2  LEU  68          2HD2      LEU  68   1.102   6.651  -3.972
  526   3HD2  LEU  68          3HD2      LEU  68   0.699   5.074  -3.294
  527    H    GLU  69           H        GLU  69   6.058   7.144  -2.192
  528    HA   GLU  69           HA       GLU  69   5.475   9.805  -3.006
  529   1HB   GLU  69          2HB       GLU  69   6.592   8.843  -0.822
  530   2HB   GLU  69          1HB       GLU  69   8.089   9.082  -1.713
  531   1HG   GLU  69          2HG       GLU  69   7.215  11.467  -2.182
  532   2HG   GLU  69          1HG       GLU  69   6.058  11.156  -0.886
  533    H    ASN  70           H        ASN  70   7.731   7.427  -4.060
  534    HA   ASN  70           HA       ASN  70   8.353   8.791  -6.499
  535   1HB   ASN  70          2HB       ASN  70   9.843   9.737  -4.332
  536   2HB   ASN  70          1HB       ASN  70  10.919   8.584  -5.124
  537   1HD2  ASN  70          1HD2      ASN  70   9.715   9.028  -7.817
  538   2HD2  ASN  70          2HD2      ASN  70  10.251  10.557  -8.323
  539    HA   PRO  71           HA       PRO  71   9.122   4.283  -6.350
  540   1HB   PRO  71          2HB       PRO  71   7.637   3.757  -8.611
  541   2HB   PRO  71          1HB       PRO  71   6.951   3.811  -6.978
  542   1HG   PRO  71          2HG       PRO  71   6.715   5.810  -9.174
  543   2HG   PRO  71          1HG       PRO  71   5.619   5.499  -7.819
  544   1HD   PRO  71          2HD       PRO  71   7.473   7.633  -7.991
  545   2HD   PRO  71          1HD       PRO  71   6.613   7.115  -6.529
  546    H    LYS  72           H        LYS  72   9.473   6.776  -8.738
  547    HA   LYS  72           HA       LYS  72  11.078   5.228 -10.589
  548   1HB   LYS  72          2HB       LYS  72   9.941   7.154 -11.475
  549   2HB   LYS  72          1HB       LYS  72  10.617   8.198 -10.224
  550   1HG   LYS  72          2HG       LYS  72  12.553   8.484 -11.360
  551   2HG   LYS  72          1HG       LYS  72  12.673   6.767 -11.746
  552   1HD   LYS  72          2HD       LYS  72  10.478   8.031 -13.182
  553   2HD   LYS  72          1HD       LYS  72  12.018   8.817 -13.530
  554   1HE   LYS  72          2HE       LYS  72  12.420   5.975 -13.493
  555   2HE   LYS  72          1HE       LYS  72  11.059   6.343 -14.553
  556   1HZ   LYS  72          1HZ       LYS  72  12.622   6.823 -16.049
  557   2HZ   LYS  72          2HZ       LYS  72  13.855   6.930 -14.886
  558   3HZ   LYS  72          3HZ       LYS  72  12.846   8.265 -15.183
  559    H    LYS  73           H        LYS  73  11.577   6.752  -7.567
  560    HA   LYS  73           HA       LYS  73  14.527   6.891  -7.991
  561   1HB   LYS  73          2HB       LYS  73  12.798   7.889  -5.706
  562   2HB   LYS  73          1HB       LYS  73  14.547   8.083  -5.810
  563   1HG   LYS  73          2HG       LYS  73  12.541   9.163  -7.811
  564   2HG   LYS  73          1HG       LYS  73  13.377  10.117  -6.586
  565   1HD   LYS  73          2HD       LYS  73  14.613   8.651  -8.929
  566   2HD   LYS  73          1HD       LYS  73  14.601  10.391  -8.639
  567   1HE   LYS  73          2HE       LYS  73  15.734   9.435  -6.320
  568   2HE   LYS  73          1HE       LYS  73  16.372   8.319  -7.529
  569   1HZ   LYS  73          1HZ       LYS  73  16.479  10.893  -8.599
  570   2HZ   LYS  73          2HZ       LYS  73  17.777   9.885  -8.165
  571   3HZ   LYS  73          3HZ       LYS  73  17.130  10.976  -7.034
  572    H    TYR  74           H        TYR  74  12.044   5.374  -5.968
  573    HA   TYR  74           HA       TYR  74  13.940   3.899  -4.339
  574   1HB   TYR  74          2HB       TYR  74  11.562   4.450  -3.672
  575   2HB   TYR  74          1HB       TYR  74  11.022   3.259  -4.854
  576    HD1  TYR  74           HD1      TYR  74  14.017   3.126  -2.631
  577    HD2  TYR  74           HD2      TYR  74  10.138   1.512  -3.523
  578    HE1  TYR  74           HE1      TYR  74  14.390   1.316  -0.978
  579    HE2  TYR  74           HE2      TYR  74  10.511  -0.299  -1.872
  580    HH   TYR  74           HH       TYR  74  13.101  -0.230   0.376
  581    H    ILE  75           H        ILE  75  11.527   2.689  -6.683
  582    HA   ILE  75           HA       ILE  75  13.289   0.395  -7.268
  583    HB   ILE  75           HB       ILE  75  10.555   0.786  -8.441
  584   1HG1  ILE  75          2HG1      ILE  75  10.415   1.387  -6.000
  585   2HG1  ILE  75          1HG1      ILE  75   9.514  -0.072  -6.414
  586   1HG2  ILE  75          1HG2      ILE  75  10.524  -1.673  -8.020
  587   2HG2  ILE  75          2HG2      ILE  75  12.166  -1.539  -7.392
  588   3HG2  ILE  75          3HG2      ILE  75  11.834  -1.161  -9.082
  589   1HD1  ILE  75          1HD1      ILE  75  12.280   0.048  -5.183
  590   2HD1  ILE  75          2HD1      ILE  75  11.479  -1.436  -5.703
  591   3HD1  ILE  75          3HD1      ILE  75  10.799  -0.481  -4.385
  592    HA   PRO  76           HA       PRO  76  14.272   2.886 -10.915
  593   1HB   PRO  76          2HB       PRO  76  16.586   1.514 -11.484
  594   2HB   PRO  76          1HB       PRO  76  16.493   2.830 -10.301
  595   1HG   PRO  76          2HG       PRO  76  16.706  -0.106  -9.829
  596   2HG   PRO  76          1HG       PRO  76  17.227   1.237  -8.798
  597   1HD   PRO  76          2HD       PRO  76  14.880  -0.308  -8.445
  598   2HD   PRO  76          1HD       PRO  76  15.251   1.233  -7.642
  599    H    GLY  77           H        GLY  77  12.374   1.810 -11.975
  600   1HA   GLY  77          2HA       GLY  77  12.720   0.628 -14.362
  601   2HA   GLY  77          1HA       GLY  77  12.931  -0.768 -13.306
  602    H    THR  78           H        THR  78  10.880   0.800 -11.469
  603    HA   THR  78           HA       THR  78   8.633  -0.753 -11.899
  604    HB   THR  78           HB       THR  78   8.825   0.788  -9.991
  605    HG1  THR  78           HG1      THR  78   6.735   0.065 -10.990
  606   1HG2  THR  78          1HG2      THR  78   9.475   2.898 -10.432
  607   2HG2  THR  78          2HG2      THR  78   7.826   3.201 -10.978
  608   3HG2  THR  78          3HG2      THR  78   9.068   2.733 -12.139
  609    H    LYS  79           H        LYS  79   7.065  -0.897 -13.395
  610    HA   LYS  79           HA       LYS  79   7.175   0.962 -15.703
  611   1HB   LYS  79          2HB       LYS  79   6.779  -1.791 -15.498
  612   2HB   LYS  79          1HB       LYS  79   5.164  -1.158 -15.824
  613   1HG   LYS  79          2HG       LYS  79   7.290   0.074 -17.450
  614   2HG   LYS  79          1HG       LYS  79   7.060  -1.649 -17.751
  615   1HD   LYS  79          2HD       LYS  79   4.779  -1.356 -18.334
  616   2HD   LYS  79          1HD       LYS  79   4.726   0.264 -17.639
  617   1HE   LYS  79          2HE       LYS  79   5.597   1.223 -19.505
  618   2HE   LYS  79          1HE       LYS  79   6.767  -0.076 -19.736
  619   1HZ   LYS  79          1HZ       LYS  79   5.359  -0.352 -21.517
  620   2HZ   LYS  79          2HZ       LYS  79   3.970   0.086 -20.640
  621   3HZ   LYS  79          3HZ       LYS  79   4.691  -1.433 -20.393
  622    H    MET  80           H        MET  80   6.043   1.556 -12.973
  623    HA   MET  80           HA       MET  80   3.210   1.633 -13.014
  624   1HB   MET  80          2HB       MET  80   5.329   3.302 -11.693
  625   2HB   MET  80          1HB       MET  80   3.636   3.751 -11.543
  626   1HG   MET  80          2HG       MET  80   4.069   0.905 -11.066
  627   2HG   MET  80          1HG       MET  80   4.974   1.915  -9.942
  628   1HE   MET  80          1HE       MET  80   4.369   3.345  -8.522
  629   2HE   MET  80          2HE       MET  80   3.042   2.909  -7.447
  630   3HE   MET  80          3HE       MET  80   2.876   4.294  -8.523
  631    H    ILE  81           H        ILE  81   1.844   2.776 -14.312
  632    HA   ILE  81           HA       ILE  81   2.965   4.898 -16.043
  633    HB   ILE  81           HB       ILE  81   0.113   3.871 -15.934
  634   1HG1  ILE  81          2HG1      ILE  81   1.661   2.002 -16.359
  635   2HG1  ILE  81          1HG1      ILE  81   0.775   2.412 -17.828
  636   1HG2  ILE  81          1HG2      ILE  81  -0.005   5.763 -17.248
  637   2HG2  ILE  81          2HG2      ILE  81   0.529   4.617 -18.478
  638   3HG2  ILE  81          3HG2      ILE  81   1.698   5.682 -17.699
  639   1HD1  ILE  81          1HD1      ILE  81   3.656   2.665 -17.238
  640   2HD1  ILE  81          2HD1      ILE  81   2.945   4.064 -18.040
  641   3HD1  ILE  81          3HD1      ILE  81   2.837   2.472 -18.788
  642    H    PHE  82           H        PHE  82   2.364   5.003 -13.012
  643    HA   PHE  82           HA       PHE  82   0.230   6.786 -12.483
  644   1HB   PHE  82          2HB       PHE  82   2.261   5.544 -11.036
  645   2HB   PHE  82          1HB       PHE  82   2.592   7.259 -10.837
  646    HD1  PHE  82           HD1      PHE  82   1.880   7.735  -8.648
  647    HD2  PHE  82           HD2      PHE  82  -0.694   5.554 -11.306
  648    HE1  PHE  82           HE1      PHE  82   0.042   7.896  -6.995
  649    HE2  PHE  82           HE2      PHE  82  -2.535   5.717  -9.652
  650    HZ   PHE  82           HZ       PHE  82  -2.164   6.886  -7.499
  651    H    VAL  83           H        VAL  83   0.403   9.113 -11.957
  652    HA   VAL  83           HA       VAL  83   2.207  10.496 -13.870
  653    HB   VAL  83           HB       VAL  83   0.688  12.395 -13.612
  654   1HG1  VAL  83          1HG1      VAL  83   0.139  10.200 -15.000
  655   2HG1  VAL  83          2HG1      VAL  83  -1.043  11.502 -14.866
  656   3HG1  VAL  83          3HG1      VAL  83  -1.184  10.074 -13.841
  657   1HG2  VAL  83          1HG2      VAL  83  -1.410  12.000 -12.207
  658   2HG2  VAL  83          2HG2      VAL  83   0.079  12.271 -11.303
  659   3HG2  VAL  83          3HG2      VAL  83  -0.554  10.636 -11.488
  660    H    GLY  84           H        GLY  84   1.171  10.567 -10.460
  661   1HA   GLY  84          2HA       GLY  84   3.212  10.872  -8.918
  662   2HA   GLY  84          1HA       GLY  84   3.529  12.313  -9.885
  663    H    ILE  85           H        ILE  85   1.356  10.873  -7.514
  664    HA   ILE  85           HA       ILE  85  -0.268  13.311  -7.305
  665    HB   ILE  85           HB       ILE  85  -0.219  10.996  -5.360
  666   1HG1  ILE  85          2HG1      ILE  85  -0.488   9.957  -7.507
  667   2HG1  ILE  85          1HG1      ILE  85  -2.108  10.099  -6.821
  668   1HG2  ILE  85          1HG2      ILE  85  -1.581  12.711  -4.510
  669   2HG2  ILE  85          2HG2      ILE  85  -2.732  11.695  -5.377
  670   3HG2  ILE  85          3HG2      ILE  85  -2.144  13.187  -6.113
  671   1HD1  ILE  85          1HD1      ILE  85  -2.472  12.174  -8.113
  672   2HD1  ILE  85          2HD1      ILE  85  -2.094  10.821  -9.179
  673   3HD1  ILE  85          3HD1      ILE  85  -0.857  12.022  -8.807
  674    H    LYS  86           H        LYS  86  -0.403  14.494  -5.196
  675    HA   LYS  86           HA       LYS  86   1.990  14.235  -3.475
  676   1HB   LYS  86          2HB       LYS  86   2.713  15.802  -5.208
  677   2HB   LYS  86          1HB       LYS  86   1.271  16.785  -4.949
  678   1HG   LYS  86          2HG       LYS  86   2.397  17.919  -3.366
  679   2HG   LYS  86          1HG       LYS  86   2.439  16.442  -2.403
  680   1HD   LYS  86          2HD       LYS  86   4.424  16.420  -4.548
  681   2HD   LYS  86          1HD       LYS  86   4.655  17.770  -3.436
  682   1HE   LYS  86          2HE       LYS  86   5.552  16.362  -1.931
  683   2HE   LYS  86          1HE       LYS  86   4.027  15.479  -1.866
  684   1HZ   LYS  86          1HZ       LYS  86   6.459  14.645  -2.960
  685   2HZ   LYS  86          2HZ       LYS  86   5.348  14.798  -4.238
  686   3HZ   LYS  86          3HZ       LYS  86   4.988  13.801  -2.910
  687    H    LYS  87           H        LYS  87  -0.513  13.563  -2.659
  688    HA   LYS  87           HA       LYS  87  -1.192  15.812  -0.818
  689   1HB   LYS  87          2HB       LYS  87  -2.834  15.251  -2.867
  690   2HB   LYS  87          1HB       LYS  87  -3.403  14.028  -1.730
  691   1HG   LYS  87          2HG       LYS  87  -4.315  15.573  -0.328
  692   2HG   LYS  87          1HG       LYS  87  -2.983  16.707  -0.556
  693   1HD   LYS  87          2HD       LYS  87  -4.356  16.503  -3.042
  694   2HD   LYS  87          1HD       LYS  87  -5.571  16.740  -1.786
  695   1HE   LYS  87          2HE       LYS  87  -3.263  18.444  -1.332
  696   2HE   LYS  87          1HE       LYS  87  -3.949  18.720  -2.934
  697   1HZ   LYS  87          1HZ       LYS  87  -6.165  18.597  -1.499
  698   2HZ   LYS  87          2HZ       LYS  87  -5.319  20.048  -1.759
  699   3HZ   LYS  87          3HZ       LYS  87  -5.113  19.189  -0.308
  700    H    LYS  88           H        LYS  88  -0.776  15.070   1.203
  701    HA   LYS  88           HA       LYS  88  -0.433  12.287   1.822
  702   1HB   LYS  88          2HB       LYS  88  -0.038  14.780   3.136
  703   2HB   LYS  88          1HB       LYS  88  -1.046  13.785   4.189
  704   1HG   LYS  88          2HG       LYS  88   1.041  13.020   4.829
  705   2HG   LYS  88          1HG       LYS  88   0.716  11.908   3.499
  706   1HD   LYS  88          2HD       LYS  88   2.939  12.789   3.178
  707   2HD   LYS  88          1HD       LYS  88   1.894  13.528   1.965
  708   1HE   LYS  88          2HE       LYS  88   2.908  15.440   2.751
  709   2HE   LYS  88          1HE       LYS  88   1.585  15.343   3.914
  710   1HZ   LYS  88          1HZ       LYS  88   4.425  14.809   4.278
  711   2HZ   LYS  88          2HZ       LYS  88   3.351  13.790   5.110
  712   3HZ   LYS  88          3HZ       LYS  88   3.297  15.469   5.360
  713    H    GLU  89           H        GLU  89  -3.237  14.291   1.636
  714    HA   GLU  89           HA       GLU  89  -4.859  12.746   3.473
  715   1HB   GLU  89          2HB       GLU  89  -5.148  15.142   1.955
  716   2HB   GLU  89          1HB       GLU  89  -6.476  14.066   1.518
  717   1HG   GLU  89          2HG       GLU  89  -7.309  15.199   3.407
  718   2HG   GLU  89          1HG       GLU  89  -6.711  13.682   4.079
  719    H    GLU  90           H        GLU  90  -4.224  12.693  -0.001
  720    HA   GLU  90           HA       GLU  90  -6.258  10.644  -0.497
  721   1HB   GLU  90          2HB       GLU  90  -4.535  12.359  -2.080
  722   2HB   GLU  90          1HB       GLU  90  -4.465  10.695  -2.660
  723   1HG   GLU  90          2HG       GLU  90  -6.292  11.897  -3.773
  724   2HG   GLU  90          1HG       GLU  90  -6.943  10.633  -2.729
  725    H    ARG  91           H        ARG  91  -2.717  10.773  -0.204
  726    HA   ARG  91           HA       ARG  91  -2.294   7.993  -0.813
  727   1HB   ARG  91          2HB       ARG  91  -0.641  10.125  -0.495
  728   2HB   ARG  91          1HB       ARG  91  -0.412   9.317   1.056
  729   1HG   ARG  91          2HG       ARG  91  -0.308   7.764  -1.524
  730   2HG   ARG  91          1HG       ARG  91   1.117   8.608  -0.917
  731   1HD   ARG  91          2HD       ARG  91   1.044   7.361   1.161
  732   2HD   ARG  91          1HD       ARG  91  -0.488   6.615   0.706
  733    HE   ARG  91           HE       ARG  91   2.164   5.954  -0.446
  734   1HH1  ARG  91          1HH1      ARG  91  -1.011   6.027  -1.498
  735   2HH1  ARG  91          2HH1      ARG  91  -1.123   4.335  -1.854
  736   1HH2  ARG  91          1HH2      ARG  91   1.926   3.556  -0.396
  737   2HH2  ARG  91          2HH2      ARG  91   0.539   2.936  -1.227
  738    H    ALA  92           H        ALA  92  -2.413   9.742   2.312
  739    HA   ALA  92           HA       ALA  92  -2.150   7.479   3.986
  740   1HB   ALA  92          1HB       ALA  92  -2.341  10.092   4.495
  741   2HB   ALA  92          2HB       ALA  92  -2.741   8.890   5.723
  742   3HB   ALA  92          3HB       ALA  92  -4.026   9.663   4.794
  743    H    ASP  93           H        ASP  93  -5.095   8.980   2.641
  744    HA   ASP  93           HA       ASP  93  -6.958   7.208   3.848
  745   1HB   ASP  93          2HB       ASP  93  -7.066   8.729   1.231
  746   2HB   ASP  93          1HB       ASP  93  -8.442   7.858   1.908
  747    H    LEU  94           H        LEU  94  -4.871   6.835   1.053
  748    HA   LEU  94           HA       LEU  94  -6.211   4.591  -0.126
  749   1HB   LEU  94          2HB       LEU  94  -3.399   5.659  -0.235
  750   2HB   LEU  94          1HB       LEU  94  -3.785   4.107  -0.979
  751    HG   LEU  94           HG       LEU  94  -5.177   6.737  -1.569
  752   1HD1  LEU  94          1HD1      LEU  94  -3.975   6.803  -3.591
  753   2HD1  LEU  94          2HD1      LEU  94  -3.526   5.101  -3.486
  754   3HD1  LEU  94          3HD1      LEU  94  -2.759   6.282  -2.426
  755   1HD2  LEU  94          1HD2      LEU  94  -6.849   5.329  -2.197
  756   2HD2  LEU  94          2HD2      LEU  94  -5.798   3.914  -2.134
  757   3HD2  LEU  94          3HD2      LEU  94  -5.805   4.943  -3.566
  758    H    ILE  95           H        ILE  95  -3.409   4.726   2.103
  759    HA   ILE  95           HA       ILE  95  -3.150   1.916   2.452
  760    HB   ILE  95           HB       ILE  95  -2.629   3.952   4.627
  761   1HG1  ILE  95          2HG1      ILE  95  -1.606   5.006   2.782
  762   2HG1  ILE  95          1HG1      ILE  95  -0.300   4.040   3.468
  763   1HG2  ILE  95          1HG2      ILE  95  -2.052   1.164   4.204
  764   2HG2  ILE  95          2HG2      ILE  95  -1.684   2.163   5.609
  765   3HG2  ILE  95          3HG2      ILE  95  -0.538   2.067   4.272
  766   1HD1  ILE  95          1HD1      ILE  95  -0.274   3.664   1.094
  767   2HD1  ILE  95          2HD1      ILE  95  -2.013   3.373   1.063
  768   3HD1  ILE  95          3HD1      ILE  95  -0.938   2.209   1.837
  769    H    ALA  96           H        ALA  96  -5.177   4.294   4.090
  770    HA   ALA  96           HA       ALA  96  -6.139   2.604   6.171
  771   1HB   ALA  96          1HB       ALA  96  -6.485   5.223   5.551
  772   2HB   ALA  96          2HB       ALA  96  -7.500   4.358   6.705
  773   3HB   ALA  96          3HB       ALA  96  -8.043   4.572   5.040
  774    H    TYR  97           H        TYR  97  -7.381   3.196   2.882
  775    HA   TYR  97           HA       TYR  97  -9.716   1.571   3.172
  776   1HB   TYR  97          2HB       TYR  97  -9.640   3.117   1.341
  777   2HB   TYR  97          1HB       TYR  97  -8.127   2.432   0.747
  778    HD1  TYR  97           HD1      TYR  97  -8.385   1.183  -1.195
  779    HD2  TYR  97           HD2      TYR  97 -11.463   1.050   1.798
  780    HE1  TYR  97           HE1      TYR  97  -9.656  -0.437  -2.575
  781    HE2  TYR  97           HE2      TYR  97 -12.736  -0.571   0.418
  782    HH   TYR  97           HH       TYR  97 -11.387  -2.213  -2.198
  783    H    LEU  98           H        LEU  98  -6.480   0.861   1.840
  784    HA   LEU  98           HA       LEU  98  -7.129  -1.910   1.312
  785   1HB   LEU  98          2HB       LEU  98  -4.712  -0.188   1.186
  786   2HB   LEU  98          1HB       LEU  98  -4.415  -1.908   1.435
  787    HG   LEU  98           HG       LEU  98  -4.439  -1.522  -0.946
  788   1HD1  LEU  98          1HD1      LEU  98  -5.829  -3.463   0.148
  789   2HD1  LEU  98          2HD1      LEU  98  -5.992  -3.147  -1.579
  790   3HD1  LEU  98          3HD1      LEU  98  -7.216  -2.557  -0.456
  791   1HD2  LEU  98          1HD2      LEU  98  -6.659   0.269  -0.214
  792   2HD2  LEU  98          2HD2      LEU  98  -6.963  -0.686  -1.665
  793   3HD2  LEU  98          3HD2      LEU  98  -5.546   0.360  -1.579
  794    H    LYS  99           H        LYS  99  -6.338  -0.174   4.149
  795    HA   LYS  99           HA       LYS  99  -5.079  -2.370   5.562
  796   1HB   LYS  99          2HB       LYS  99  -5.561   0.395   6.041
  797   2HB   LYS  99          1HB       LYS  99  -6.276  -0.509   7.375
  798   1HG   LYS  99          2HG       LYS  99  -4.152  -1.721   7.701
  799   2HG   LYS  99          1HG       LYS  99  -3.432  -0.821   6.364
  800   1HD   LYS  99          2HD       LYS  99  -2.737   0.535   8.083
  801   2HD   LYS  99          1HD       LYS  99  -4.327   1.253   7.823
  802   1HE   LYS  99          2HE       LYS  99  -5.275   0.100   9.659
  803   2HE   LYS  99          1HE       LYS  99  -3.944  -1.054   9.730
  804   1HZ   LYS  99          1HZ       LYS  99  -4.149   1.584  10.864
  805   2HZ   LYS  99          2HZ       LYS  99  -2.690   1.310  10.040
  806   3HZ   LYS  99          3HZ       LYS  99  -3.155   0.285  11.313
  807    H    LYS 100           H        LYS 100  -8.360  -1.147   5.172
  808    HA   LYS 100           HA       LYS 100  -9.399  -3.046   7.185
  809   1HB   LYS 100          2HB       LYS 100 -10.366  -0.764   6.994
  810   2HB   LYS 100          1HB       LYS 100 -10.876  -1.137   5.347
  811   1HG   LYS 100          2HG       LYS 100 -11.784  -3.271   6.977
  812   2HG   LYS 100          1HG       LYS 100 -12.196  -1.779   7.819
  813   1HD   LYS 100          2HD       LYS 100 -13.903  -1.455   6.395
  814   2HD   LYS 100          1HD       LYS 100 -12.756  -1.375   5.058
  815   1HE   LYS 100          2HE       LYS 100 -13.240  -3.480   4.364
  816   2HE   LYS 100          1HE       LYS 100 -13.274  -4.110   6.011
  817   1HZ   LYS 100          1HZ       LYS 100 -15.448  -2.340   5.529
  818   2HZ   LYS 100          2HZ       LYS 100 -15.472  -3.953   6.062
  819   3HZ   LYS 100          3HZ       LYS 100 -15.439  -3.605   4.400
  820    H    ALA 101           H        ALA 101  -9.455  -2.567   3.671
  821    HA   ALA 101           HA       ALA 101 -11.241  -4.745   3.123
  822   1HB   ALA 101          1HB       ALA 101  -9.675  -4.458   0.852
  823   2HB   ALA 101          2HB       ALA 101  -9.613  -2.859   1.592
  824   3HB   ALA 101          3HB       ALA 101 -11.169  -3.584   1.187
  825    H    THR 102           H        THR 102  -7.684  -4.516   2.674
  826    HA   THR 102           HA       THR 102  -7.633  -7.501   2.878
  827    HB   THR 102           HB       THR 102  -5.197  -6.442   1.789
  828    HG1  THR 102           HG1      THR 102  -7.295  -5.832   0.080
  829   1HG2  THR 102          1HG2      THR 102  -7.175  -8.482   1.296
  830   2HG2  THR 102          2HG2      THR 102  -5.492  -8.425   0.774
  831   3HG2  THR 102          3HG2      THR 102  -6.749  -7.684  -0.218
  832    H    ASN 103           H        ASN 103  -7.566  -5.735   5.196
  833    HA   ASN 103           HA       ASN 103  -5.157  -6.797   6.424
  834   1HB   ASN 103          2HB       ASN 103  -5.048  -4.196   5.294
  835   2HB   ASN 103          1HB       ASN 103  -5.086  -3.998   7.047
  836   1HD2  ASN 103          1HD2      ASN 103  -2.780  -3.358   7.004
  837   2HD2  ASN 103          2HD2      ASN 103  -1.569  -4.530   6.801
  838    H    GLU 104           HN       GLU 104  -7.788  -7.316   7.030
  839    HA   GLU 104           HA       GLU 104  -8.177  -5.816   9.591
  840   1HB   GLU 104          2HB       GLU 104  -9.940  -5.607   7.662
  841   2HB   GLU 104          1HB       GLU 104 -10.422  -7.227   8.170
  842   1HG   GLU 104          2HG       GLU 104 -10.092  -5.622  10.516
  843   2HG   GLU 104          1HG       GLU 104 -11.104  -4.731   9.377
  844    HHA  HEC 105           HHA      HEC 105   4.030  -2.624  -9.229
  845    HHB  HEC 105           HHB      HEC 105   1.265   1.014  -4.895
  846    HHC  HEC 105           HHC      HEC 105  -2.179   3.801  -9.413
  847    HHD  HEC 105           HHD      HEC 105   0.600   0.157 -13.762
  848   1HMA  HEC 105          1HMA      HEC 105   2.288  -0.949  -3.886
  849   2HMA  HEC 105          2HMA      HEC 105   3.717   0.051  -4.142
  850   3HMA  HEC 105          3HMA      HEC 105   3.852  -1.706  -4.187
  851   1HAA  HEC 105          1HAA      HEC 105   4.863  -2.654  -5.581
  852   2HAA  HEC 105          2HAA      HEC 105   5.451  -2.389  -7.210
  853   1HBA  HEC 105          1HBA      HEC 105   4.943  -4.738  -6.949
  854   2HBA  HEC 105          2HBA      HEC 105   3.740  -4.028  -8.026
  855   1HMB  HEC 105          1HMB      HEC 105  -0.519   3.908  -4.258
  856   2HMB  HEC 105          2HMB      HEC 105   0.054   2.264  -3.984
  857   3HMB  HEC 105          3HMB      HEC 105  -1.673   2.580  -4.149
  858    HAB  HEC 105           HAB      HEC 105  -2.604   4.780  -7.652
  859   1HBB  HEC 105          1HBB      HEC 105  -1.961   4.973  -4.743
  860   2HBB  HEC 105          2HBB      HEC 105  -2.763   6.159  -5.771
  861   3HBB  HEC 105          3HBB      HEC 105  -1.055   5.794  -6.014
  862   1HMC  HEC 105          1HMC      HEC 105  -2.865   4.393 -11.182
  863   2HMC  HEC 105          2HMC      HEC 105  -2.343   4.522 -12.862
  864   3HMC  HEC 105          3HMC      HEC 105  -3.610   3.378 -12.416
  865    HAC  HEC 105           HAC      HEC 105  -0.549   1.668 -14.806
  866   1HBC  HEC 105          1HBC      HEC 105  -1.268   4.085 -14.373
  867   2HBC  HEC 105          2HBC      HEC 105  -2.903   3.456 -14.574
  868   3HBC  HEC 105          3HBC      HEC 105  -1.727   3.289 -15.878
  869   1HMD  HEC 105          1HMD      HEC 105   3.176  -1.186 -14.621
  870   2HMD  HEC 105          2HMD      HEC 105   2.719  -2.858 -14.303
  871   3HMD  HEC 105          3HMD      HEC 105   1.473  -1.642 -14.585
  872   1HAD  HEC 105          1HAD      HEC 105   3.643  -4.170 -11.666
  873   2HAD  HEC 105          2HAD      HEC 105   4.407  -3.262 -12.963
  874   1HBD  HEC 105          1HBD      HEC 105   5.294  -2.126 -10.515
  875   2HBD  HEC 105          2HBD      HEC 105   6.235  -3.035 -11.694
  Start of MODEL   16
    1   1H    GLY   1          1HT       GLY   1  -8.662  10.855   9.234
    2   2H    GLY   1          2HT       GLY   1 -10.349  10.925   9.046
    3   3H    GLY   1          3HT       GLY   1  -9.354  12.032   8.227
    4   1HA   GLY   1          1HA       GLY   1  -9.216  10.682   6.500
    5   2HA   GLY   1          2HA       GLY   1  -8.502   9.454   7.548
    6    H    ASP   2           H        ASP   2 -10.684   9.444   5.347
    7    HA   ASP   2           HA       ASP   2 -12.703   7.936   6.960
    8   1HB   ASP   2          2HB       ASP   2 -13.403   9.147   4.307
    9   2HB   ASP   2          1HB       ASP   2 -14.446   8.802   5.688
   10    H    VAL   3           H        VAL   3 -13.493   5.990   6.006
   11    HA   VAL   3           HA       VAL   3 -11.585   4.720   4.165
   12    HB   VAL   3           HB       VAL   3 -12.637   3.571   6.182
   13   1HG1  VAL   3          1HG1      VAL   3 -14.903   2.683   5.886
   14   2HG1  VAL   3          2HG1      VAL   3 -15.026   3.474   4.314
   15   3HG1  VAL   3          3HG1      VAL   3 -14.933   4.444   5.784
   16   1HG2  VAL   3          1HG2      VAL   3 -12.877   1.427   5.005
   17   2HG2  VAL   3          2HG2      VAL   3 -11.526   2.338   4.331
   18   3HG2  VAL   3          3HG2      VAL   3 -13.063   2.275   3.469
   19    H    GLU   4           H        GLU   4 -14.601   6.356   3.958
   20    HA   GLU   4           HA       GLU   4 -15.518   5.026   1.529
   21   1HB   GLU   4          2HB       GLU   4 -16.352   7.726   2.629
   22   2HB   GLU   4          1HB       GLU   4 -17.247   6.724   1.486
   23   1HG   GLU   4          2HG       GLU   4 -16.756   5.021   3.645
   24   2HG   GLU   4          1HG       GLU   4 -17.159   6.567   4.394
   25    H    LYS   5           H        LYS   5 -13.826   8.064   2.291
   26    HA   LYS   5           HA       LYS   5 -13.708   8.925  -0.479
   27   1HB   LYS   5          2HB       LYS   5 -13.322  10.200   1.882
   28   2HB   LYS   5          1HB       LYS   5 -11.646   9.894   1.426
   29   1HG   LYS   5          2HG       LYS   5 -13.272  10.839  -0.820
   30   2HG   LYS   5          1HG       LYS   5 -13.202  11.999   0.508
   31   1HD   LYS   5          2HD       LYS   5 -10.680  11.645   0.521
   32   2HD   LYS   5          1HD       LYS   5 -10.881  10.774  -0.999
   33   1HE   LYS   5          2HE       LYS   5 -12.328  13.048  -1.487
   34   2HE   LYS   5          1HE       LYS   5 -11.037  13.670  -0.458
   35   1HZ   LYS   5          1HZ       LYS   5 -10.569  11.947  -2.826
   36   2HZ   LYS   5          2HZ       LYS   5  -9.405  12.783  -1.912
   37   3HZ   LYS   5          3HZ       LYS   5 -10.512  13.641  -2.874
   38    H    GLY   6           H        GLY   6 -11.476   7.233   1.717
   39   1HA   GLY   6          2HA       GLY   6  -9.273   7.155  -0.131
   40   2HA   GLY   6          1HA       GLY   6  -9.472   6.095   1.265
   41    H    LYS   7           H        LYS   7 -11.742   4.704   0.712
   42    HA   LYS   7           HA       LYS   7 -10.911   2.717  -1.121
   43   1HB   LYS   7          2HB       LYS   7 -12.599   2.238   0.560
   44   2HB   LYS   7          1HB       LYS   7 -13.698   3.417  -0.155
   45   1HG   LYS   7          2HG       LYS   7 -12.827   1.580  -2.192
   46   2HG   LYS   7          1HG       LYS   7 -13.449   0.671  -0.814
   47   1HD   LYS   7          2HD       LYS   7 -15.210   2.851  -1.170
   48   2HD   LYS   7          1HD       LYS   7 -14.917   2.188  -2.780
   49   1HE   LYS   7          2HE       LYS   7 -16.772   0.967  -1.860
   50   2HE   LYS   7          1HE       LYS   7 -15.376  -0.108  -1.798
   51   1HZ   LYS   7          1HZ       LYS   7 -15.212   0.072   0.452
   52   2HZ   LYS   7          2HZ       LYS   7 -16.893   0.255   0.284
   53   3HZ   LYS   7          3HZ       LYS   7 -15.905   1.620   0.506
   54    H    LYS   8           H        LYS   8 -12.647   5.709  -1.652
   55    HA   LYS   8           HA       LYS   8 -13.531   4.982  -4.340
   56   1HB   LYS   8          2HB       LYS   8 -14.822   6.627  -3.090
   57   2HB   LYS   8          1HB       LYS   8 -13.396   7.650  -2.902
   58   1HG   LYS   8          2HG       LYS   8 -13.318   8.141  -5.235
   59   2HG   LYS   8          1HG       LYS   8 -14.475   6.865  -5.615
   60   1HD   LYS   8          2HD       LYS   8 -16.289   8.072  -4.725
   61   2HD   LYS   8          1HD       LYS   8 -15.238   9.132  -3.785
   62   1HE   LYS   8          2HE       LYS   8 -15.214  10.613  -5.476
   63   2HE   LYS   8          1HE       LYS   8 -14.507   9.391  -6.533
   64   1HZ   LYS   8          1HZ       LYS   8 -16.460   9.002  -7.511
   65   2HZ   LYS   8          2HZ       LYS   8 -16.947  10.490  -6.853
   66   3HZ   LYS   8          3HZ       LYS   8 -17.325   9.040  -6.053
   67    H    ILE   9           H        ILE   9 -10.801   6.677  -2.885
   68    HA   ILE   9           HA       ILE   9  -9.735   7.835  -5.260
   69    HB   ILE   9           HB       ILE   9  -8.396   6.854  -2.728
   70   1HG1  ILE   9          2HG1      ILE   9  -8.553   9.713  -3.560
   71   2HG1  ILE   9          1HG1      ILE   9 -10.055   8.950  -3.039
   72   1HG2  ILE   9          1HG2      ILE   9  -6.509   6.897  -4.009
   73   2HG2  ILE   9          2HG2      ILE   9  -6.656   8.644  -3.815
   74   3HG2  ILE   9          3HG2      ILE   9  -7.270   7.864  -5.273
   75   1HD1  ILE   9          1HD1      ILE   9  -7.839   8.266  -1.279
   76   2HD1  ILE   9          2HD1      ILE   9  -9.411   8.958  -0.879
   77   3HD1  ILE   9          3HD1      ILE   9  -8.083  10.010  -1.372
   78    H    PHE  10           H        PHE  10  -8.772   4.767  -3.656
   79    HA   PHE  10           HA       PHE  10  -7.084   3.877  -5.769
   80   1HB   PHE  10          2HB       PHE  10  -7.172   2.854  -3.483
   81   2HB   PHE  10          1HB       PHE  10  -8.733   2.141  -3.903
   82    HD1  PHE  10           HD1      PHE  10  -8.775   0.797  -6.186
   83    HD2  PHE  10           HD2      PHE  10  -5.230   1.624  -3.905
   84    HE1  PHE  10           HE1      PHE  10  -7.613  -1.085  -7.307
   85    HE2  PHE  10           HE2      PHE  10  -4.069  -0.258  -5.026
   86    HZ   PHE  10           HZ       PHE  10  -5.261  -1.612  -6.727
   87    H    ILE  11           H        ILE  11 -10.531   3.237  -5.134
   88    HA   ILE  11           HA       ILE  11 -11.023   1.537  -7.344
   89    HB   ILE  11           HB       ILE  11 -12.799   3.533  -5.920
   90   1HG1  ILE  11          2HG1      ILE  11 -11.891   1.465  -4.730
   91   2HG1  ILE  11          1HG1      ILE  11 -13.649   1.610  -4.768
   92   1HG2  ILE  11          1HG2      ILE  11 -13.333   1.715  -8.247
   93   2HG2  ILE  11          2HG2      ILE  11 -13.947   3.338  -7.933
   94   3HG2  ILE  11          3HG2      ILE  11 -14.601   1.960  -7.046
   95   1HD1  ILE  11          1HD1      ILE  11 -12.819  -0.690  -5.354
   96   2HD1  ILE  11          2HD1      ILE  11 -12.040   0.006  -6.775
   97   3HD1  ILE  11          3HD1      ILE  11 -13.797   0.052  -6.619
   98    H    MET  12           H        MET  12 -10.458   4.970  -7.214
   99    HA   MET  12           HA       MET  12 -11.130   5.123 -10.128
  100   1HB   MET  12          2HB       MET  12 -12.512   6.480  -8.351
  101   2HB   MET  12          1HB       MET  12 -11.110   7.549  -8.361
  102   1HG   MET  12          2HG       MET  12 -11.319   7.613 -10.892
  103   2HG   MET  12          1HG       MET  12 -12.869   6.793 -10.706
  104   1HE   MET  12          1HE       MET  12 -13.497  10.619 -11.583
  105   2HE   MET  12          2HE       MET  12 -13.636   8.962 -12.163
  106   3HE   MET  12          3HE       MET  12 -12.044   9.694 -11.986
  107    H    LYS  13           H        LYS  13  -8.546   4.781  -8.271
  108    HA   LYS  13           HA       LYS  13  -6.937   6.748  -9.849
  109   1HB   LYS  13          2HB       LYS  13  -7.112   7.077  -7.274
  110   2HB   LYS  13          1HB       LYS  13  -6.052   5.671  -7.177
  111   1HG   LYS  13          2HG       LYS  13  -4.570   7.517  -7.204
  112   2HG   LYS  13          1HG       LYS  13  -4.544   6.906  -8.858
  113   1HD   LYS  13          2HD       LYS  13  -5.704   8.714  -9.694
  114   2HD   LYS  13          1HD       LYS  13  -6.589   8.975  -8.190
  115   1HE   LYS  13          2HE       LYS  13  -4.643   9.949  -7.135
  116   2HE   LYS  13          1HE       LYS  13  -3.627   9.521  -8.512
  117   1HZ   LYS  13          1HZ       LYS  13  -5.667  11.617  -8.287
  118   2HZ   LYS  13          2HZ       LYS  13  -5.384  10.912  -9.807
  119   3HZ   LYS  13          3HZ       LYS  13  -4.120  11.689  -8.978
  120    H    CYS  14           H        CYS  14  -6.578   3.686  -8.008
  121    HA   CYS  14           HA       CYS  14  -4.782   2.762 -10.216
  122   1HB   CYS  14          2HB       CYS  14  -4.471   1.258  -7.739
  123   2HB   CYS  14          1HB       CYS  14  -3.244   2.073  -8.701
  124    H    SER  15           H        SER  15  -7.793   2.483  -9.721
  125    HA   SER  15           HA       SER  15  -8.111  -0.407  -9.271
  126   1HB   SER  15          2HB       SER  15  -9.768   1.588  -8.712
  127   2HB   SER  15          1HB       SER  15 -10.293   1.326 -10.371
  128    HG   SER  15           HG       SER  15 -10.168  -1.045  -9.455
  129    H    GLN  16           H        GLN  16  -6.976   1.311 -11.808
  130    HA   GLN  16           HA       GLN  16  -8.396  -0.268 -13.881
  131   1HB   GLN  16          2HB       GLN  16  -6.370   1.965 -14.213
  132   2HB   GLN  16          1HB       GLN  16  -7.383   1.265 -15.471
  133   1HG   GLN  16          2HG       GLN  16  -9.087   2.061 -13.325
  134   2HG   GLN  16          1HG       GLN  16  -8.017   3.413 -13.699
  135   1HE2  GLN  16          1HE2      GLN  16 -10.775   1.627 -14.799
  136   2HE2  GLN  16          2HE2      GLN  16 -10.969   2.429 -16.282
  137    H    CYS  17           H        CYS  17  -5.154   0.426 -12.608
  138    HA   CYS  17           HA       CYS  17  -4.046  -1.763 -14.277
  139   1HB   CYS  17          2HB       CYS  17  -2.848   0.449 -12.622
  140   2HB   CYS  17          1HB       CYS  17  -1.874  -0.958 -13.046
  141    H    HIS  18           H        HIS  18  -4.968  -1.003 -10.993
  142    HA   HIS  18           HA       HIS  18  -3.927  -3.673 -10.127
  143   1HB   HIS  18          2HB       HIS  18  -4.501  -1.189  -8.490
  144   2HB   HIS  18          1HB       HIS  18  -4.073  -2.753  -7.802
  145    HD1  HIS  18           HD1      HIS  18  -1.624  -3.418  -7.826
  146    HD2  HIS  18           HD2      HIS  18  -2.380   0.026 -10.036
  147    HE1  HIS  18           HE1      HIS  18   0.634  -2.442  -8.426
  148    H    THR  19           H        THR  19  -5.936  -4.622 -11.009
  149    HA   THR  19           HA       THR  19  -8.487  -3.824  -9.824
  150    HB   THR  19           HB       THR  19  -9.417  -5.701 -11.064
  151    HG1  THR  19           HG1      THR  19  -8.163  -7.380 -11.066
  152   1HG2  THR  19          1HG2      THR  19  -7.219  -4.348 -12.654
  153   2HG2  THR  19          2HG2      THR  19  -8.830  -3.693 -12.367
  154   3HG2  THR  19          3HG2      THR  19  -8.632  -5.152 -13.336
  155    H    VAL  20           H        VAL  20  -7.870  -4.037  -7.547
  156    HA   VAL  20           HA       VAL  20  -7.125  -6.677  -6.527
  157    HB   VAL  20           HB       VAL  20  -7.034  -5.613  -4.381
  158   1HG1  VAL  20          1HG1      VAL  20  -5.831  -3.397  -5.010
  159   2HG1  VAL  20          2HG1      VAL  20  -6.126  -3.888  -6.677
  160   3HG1  VAL  20          3HG1      VAL  20  -5.156  -4.910  -5.616
  161   1HG2  VAL  20          1HG2      VAL  20  -8.965  -3.741  -5.667
  162   2HG2  VAL  20          2HG2      VAL  20  -7.854  -3.049  -4.487
  163   3HG2  VAL  20          3HG2      VAL  20  -8.933  -4.360  -4.016
  164    H    GLU  21           H        GLU  21  -9.558  -6.896  -7.904
  165    HA   GLU  21           HA       GLU  21 -11.248  -7.990  -5.816
  166   1HB   GLU  21          2HB       GLU  21 -13.237  -6.489  -6.767
  167   2HB   GLU  21          1HB       GLU  21 -12.239  -5.941  -5.421
  168   1HG   GLU  21          2HG       GLU  21 -10.793  -4.701  -6.983
  169   2HG   GLU  21          1HG       GLU  21 -11.780  -5.252  -8.337
  170    H    LYS  22           H        LYS  22  -9.932  -8.618  -8.492
  171    HA   LYS  22           HA       LYS  22 -12.348  -9.363 -10.065
  172   1HB   LYS  22          2HB       LYS  22 -10.395  -8.224 -11.203
  173   2HB   LYS  22          1HB       LYS  22  -9.440  -9.669 -10.864
  174   1HG   LYS  22          2HG       LYS  22 -11.141 -11.032 -12.084
  175   2HG   LYS  22          1HG       LYS  22 -11.994  -9.544 -12.498
  176   1HD   LYS  22          2HD       LYS  22 -10.317  -8.824 -13.944
  177   2HD   LYS  22          1HD       LYS  22  -9.071  -9.779 -13.140
  178   1HE   LYS  22          2HE       LYS  22  -9.537 -10.864 -15.237
  179   2HE   LYS  22          1HE       LYS  22 -10.267 -11.854 -13.974
  180   1HZ   LYS  22          1HZ       LYS  22 -12.254 -10.158 -14.533
  181   2HZ   LYS  22          2HZ       LYS  22 -12.080 -11.685 -15.256
  182   3HZ   LYS  22          3HZ       LYS  22 -11.528 -10.293 -16.060
  183    H    GLY  23           H        GLY  23  -9.215 -11.019  -9.578
  184   1HA   GLY  23          2HA       GLY  23 -10.151 -13.185  -8.031
  185   2HA   GLY  23          1HA       GLY  23 -10.396 -13.629  -9.721
  186    H    GLY  24           H        GLY  24  -7.784 -11.889  -7.990
  187   1HA   GLY  24          1HA       GLY  24  -5.486 -12.368  -7.869
  188   2HA   GLY  24          2HA       GLY  24  -5.865 -14.014  -8.374
  189    H    LYS  25           H        LYS  25  -7.233 -11.894 -10.568
  190    HA   LYS  25           HA       LYS  25  -5.082 -12.462 -12.519
  191   1HB   LYS  25          2HB       LYS  25  -7.460 -12.876 -13.129
  192   2HB   LYS  25          1HB       LYS  25  -7.793 -11.157 -12.918
  193   1HG   LYS  25          2HG       LYS  25  -7.421 -11.451 -15.255
  194   2HG   LYS  25          1HG       LYS  25  -5.938 -10.733 -14.627
  195   1HD   LYS  25          2HD       LYS  25  -5.307 -12.560 -16.075
  196   2HD   LYS  25          1HD       LYS  25  -4.997 -13.064 -14.413
  197   1HE   LYS  25          2HE       LYS  25  -6.701 -14.606 -14.417
  198   2HE   LYS  25          1HE       LYS  25  -7.700 -13.654 -15.515
  199   1HZ   LYS  25          1HZ       LYS  25  -5.294 -14.493 -16.775
  200   2HZ   LYS  25          2HZ       LYS  25  -6.905 -14.757 -17.247
  201   3HZ   LYS  25          3HZ       LYS  25  -6.147 -15.826 -16.165
  202    H    HIS  26           H        HIS  26  -3.912 -10.812 -13.576
  203    HA   HIS  26           HA       HIS  26  -4.392  -8.034 -12.599
  204   1HB   HIS  26          2HB       HIS  26  -1.697  -8.024 -12.871
  205   2HB   HIS  26          1HB       HIS  26  -2.505  -8.360 -11.342
  206    HD1  HIS  26           HD1      HIS  26  -2.063 -10.648 -14.360
  207    HD2  HIS  26           HD2      HIS  26  -1.016 -10.478 -10.328
  208    HE1  HIS  26           HE1      HIS  26  -0.955 -12.858 -13.813
  209    H    LYS  27           H        LYS  27  -4.858  -6.848 -14.376
  210    HA   LYS  27           HA       LYS  27  -4.146  -7.667 -17.042
  211   1HB   LYS  27          2HB       LYS  27  -5.242  -5.085 -15.905
  212   2HB   LYS  27          1HB       LYS  27  -4.949  -5.319 -17.629
  213   1HG   LYS  27          2HG       LYS  27  -6.357  -7.610 -16.748
  214   2HG   LYS  27          1HG       LYS  27  -7.184  -6.218 -16.047
  215   1HD   LYS  27          2HD       LYS  27  -6.568  -5.442 -18.671
  216   2HD   LYS  27          1HD       LYS  27  -7.124  -7.110 -18.810
  217   1HE   LYS  27          2HE       LYS  27  -8.598  -4.871 -17.389
  218   2HE   LYS  27          1HE       LYS  27  -9.022  -5.545 -18.963
  219   1HZ   LYS  27          1HZ       LYS  27  -9.821  -6.458 -16.478
  220   2HZ   LYS  27          2HZ       LYS  27  -8.724  -7.615 -17.064
  221   3HZ   LYS  27          3HZ       LYS  27 -10.092  -7.196 -17.981
  222    H    THR  28           H        THR  28  -3.408  -4.413 -15.888
  223    HA   THR  28           HA       THR  28  -0.672  -4.722 -17.021
  224    HB   THR  28           HB       THR  28  -2.312  -2.277 -16.296
  225    HG1  THR  28           HG1      THR  28  -1.733  -2.042 -18.686
  226   1HG2  THR  28          1HG2      THR  28  -0.032  -1.559 -17.796
  227   2HG2  THR  28          2HG2      THR  28   0.548  -2.605 -16.499
  228   3HG2  THR  28          3HG2      THR  28  -0.375  -1.153 -16.115
  229    H    GLY  29           H        GLY  29  -2.331  -3.456 -14.118
  230   1HA   GLY  29          2HA       GLY  29   0.218  -3.249 -12.679
  231   2HA   GLY  29          1HA       GLY  29  -1.371  -2.872 -12.022
  232    HA   PRO  30           HA       PRO  30   0.175  -7.277 -10.911
  233   1HB   PRO  30          2HB       PRO  30   1.343  -6.727  -8.499
  234   2HB   PRO  30          1HB       PRO  30   2.235  -6.846 -10.020
  235   1HG   PRO  30          2HG       PRO  30   1.409  -4.394  -8.505
  236   2HG   PRO  30          1HG       PRO  30   2.851  -4.669  -9.499
  237   1HD   PRO  30          2HD       PRO  30   0.637  -3.243 -10.369
  238   2HD   PRO  30          1HD       PRO  30   1.788  -4.064 -11.441
  239    H    ASN  31           H        ASN  31  -1.333  -8.463  -9.886
  240    HA   ASN  31           HA       ASN  31  -3.666  -7.404  -8.755
  241   1HB   ASN  31          2HB       ASN  31  -3.311  -9.791  -9.465
  242   2HB   ASN  31          1HB       ASN  31  -2.415 -10.048  -7.967
  243   1HD2  ASN  31          1HD2      ASN  31  -5.459  -8.223  -8.632
  244   2HD2  ASN  31          2HD2      ASN  31  -6.380  -9.056  -7.476
  245    H    LEU  32           H        LEU  32  -3.404  -5.843  -7.190
  246    HA   LEU  32           HA       LEU  32  -1.596  -6.205  -4.942
  247   1HB   LEU  32          2HB       LEU  32  -3.211  -4.075  -6.103
  248   2HB   LEU  32          1HB       LEU  32  -3.329  -4.098  -4.346
  249    HG   LEU  32           HG       LEU  32  -1.014  -3.748  -4.063
  250   1HD1  LEU  32          1HD1      LEU  32  -0.866  -5.165  -6.631
  251   2HD1  LEU  32          2HD1      LEU  32   0.305  -5.105  -5.313
  252   3HD1  LEU  32          3HD1      LEU  32   0.263  -3.815  -6.515
  253   1HD2  LEU  32          1HD2      LEU  32  -2.283  -2.203  -6.248
  254   2HD2  LEU  32          2HD2      LEU  32  -0.526  -2.074  -6.158
  255   3HD2  LEU  32          3HD2      LEU  32  -1.515  -1.634  -4.765
  256    H    HIS  33           H        HIS  33  -2.774  -8.347  -4.387
  257    HA   HIS  33           HA       HIS  33  -5.295  -7.852  -2.889
  258   1HB   HIS  33          2HB       HIS  33  -5.727 -10.175  -3.031
  259   2HB   HIS  33          1HB       HIS  33  -5.030  -9.770  -4.598
  260    HD1  HIS  33           HD1      HIS  33  -2.371 -10.272  -4.825
  261    HD2  HIS  33           HD2      HIS  33  -4.313 -12.113  -1.630
  262    HE1  HIS  33           HE1      HIS  33  -0.836 -12.120  -4.022
  263    H    GLY  34           H        GLY  34  -2.108  -9.430  -2.433
  264   1HA   GLY  34          2HA       GLY  34  -2.479  -8.976   0.502
  265   2HA   GLY  34          1HA       GLY  34  -1.652 -10.394  -0.143
  266    H    LEU  35           H        LEU  35  -1.253  -7.178  -1.514
  267    HA   LEU  35           HA       LEU  35   1.521  -7.187  -1.651
  268   1HB   LEU  35          2HB       LEU  35   0.451  -5.369  -2.705
  269   2HB   LEU  35          1HB       LEU  35  -0.445  -4.938  -1.250
  270    HG   LEU  35           HG       LEU  35   2.509  -4.870  -0.999
  271   1HD1  LEU  35          1HD1      LEU  35   2.812  -3.641  -2.875
  272   2HD1  LEU  35          2HD1      LEU  35   1.970  -2.352  -2.015
  273   3HD1  LEU  35          3HD1      LEU  35   1.079  -3.415  -3.106
  274   1HD2  LEU  35          1HD2      LEU  35   1.625  -3.932   0.879
  275   2HD2  LEU  35          2HD2      LEU  35   0.093  -3.564   0.088
  276   3HD2  LEU  35          3HD2      LEU  35   1.474  -2.486  -0.120
  277    H    PHE  36           H        PHE  36  -0.497  -6.265   1.122
  278    HA   PHE  36           HA       PHE  36   1.687  -5.419   2.795
  279   1HB   PHE  36          2HB       PHE  36  -1.032  -6.485   3.617
  280   2HB   PHE  36          1HB       PHE  36   0.060  -5.532   4.620
  281    HD1  PHE  36           HD1      PHE  36  -2.104  -5.463   1.609
  282    HD2  PHE  36           HD2      PHE  36   0.259  -3.152   4.353
  283    HE1  PHE  36           HE1      PHE  36  -3.060  -3.376   0.672
  284    HE2  PHE  36           HE2      PHE  36  -0.700  -1.064   3.418
  285    HZ   PHE  36           HZ       PHE  36  -2.358  -1.175   1.577
  286    H    GLY  37           H        GLY  37   2.768  -6.576   4.437
  287   1HA   GLY  37          2HA       GLY  37   3.825  -8.458   5.349
  288   2HA   GLY  37          1HA       GLY  37   2.228  -9.203   5.302
  289    H    ARG  38           H        ARG  38   3.456  -8.134   2.265
  290    HA   ARG  38           HA       ARG  38   4.649 -10.776   1.655
  291   1HB   ARG  38          2HB       ARG  38   2.030 -10.590   1.193
  292   2HB   ARG  38          1HB       ARG  38   2.587  -9.772  -0.267
  293   1HG   ARG  38          2HG       ARG  38   4.115 -11.741  -0.686
  294   2HG   ARG  38          1HG       ARG  38   3.314 -12.567   0.653
  295   1HD   ARG  38          2HD       ARG  38   2.398 -13.061  -1.689
  296   2HD   ARG  38          1HD       ARG  38   1.213 -12.575  -0.476
  297    HE   ARG  38           HE       ARG  38   0.726 -10.810  -1.946
  298   1HH1  ARG  38          1HH2      ARG  38   3.808 -12.023  -2.713
  299   2HH1  ARG  38          2HH2      ARG  38   4.344 -10.586  -3.518
  300   1HH2  ARG  38          1HH1      ARG  38   1.528  -8.747  -2.678
  301   2HH2  ARG  38          2HH1      ARG  38   3.057  -8.730  -3.492
  302    H    LYS  39           H        LYS  39   6.549 -10.236   0.698
  303    HA   LYS  39           HA       LYS  39   7.157  -7.666  -0.363
  304   1HB   LYS  39          2HB       LYS  39   8.414 -10.378  -0.516
  305   2HB   LYS  39          1HB       LYS  39   8.969  -9.147  -1.649
  306   1HG   LYS  39          2HG       LYS  39   9.760  -7.748   0.050
  307   2HG   LYS  39          1HG       LYS  39   8.715  -8.478   1.270
  308   1HD   LYS  39          2HD       LYS  39  10.727  -9.462   1.846
  309   2HD   LYS  39          1HD       LYS  39  10.139 -10.648   0.681
  310   1HE   LYS  39          2HE       LYS  39  12.366 -10.211  -0.001
  311   2HE   LYS  39          1HE       LYS  39  11.375  -9.248  -1.096
  312   1HZ   LYS  39          1HZ       LYS  39  12.097  -7.921   1.366
  313   2HZ   LYS  39          2HZ       LYS  39  12.125  -7.343  -0.232
  314   3HZ   LYS  39          3HZ       LYS  39  13.411  -8.283   0.359
  315    H    THR  40           H        THR  40   8.107  -7.790  -2.873
  316    HA   THR  40           HA       THR  40   5.672  -8.012  -4.477
  317    HB   THR  40           HB       THR  40   8.103  -7.632  -6.021
  318    HG1  THR  40           HG1      THR  40   9.018  -6.055  -4.917
  319   1HG2  THR  40          1HG2      THR  40   6.645  -6.304  -7.096
  320   2HG2  THR  40          2HG2      THR  40   6.500  -5.269  -5.676
  321   3HG2  THR  40          3HG2      THR  40   5.444  -6.669  -5.857
  322    H    GLY  41           H        GLY  41   6.653  -8.910  -6.931
  323   1HA   GLY  41          2HA       GLY  41   6.891 -10.920  -8.119
  324   2HA   GLY  41          1HA       GLY  41   8.151 -11.292  -6.944
  325    H    GLN  42           H        GLN  42   4.927 -12.022  -7.946
  326    HA   GLN  42           HA       GLN  42   4.839 -14.215  -5.990
  327   1HB   GLN  42          2HB       GLN  42   2.691 -13.602  -5.035
  328   2HB   GLN  42          1HB       GLN  42   3.824 -12.273  -4.795
  329   1HG   GLN  42          2HG       GLN  42   2.594 -11.863  -7.323
  330   2HG   GLN  42          1HG       GLN  42   1.308 -12.242  -6.178
  331   1HE2  GLN  42          1HE2      GLN  42   4.358 -10.291  -6.125
  332   2HE2  GLN  42          2HE2      GLN  42   3.656  -8.957  -5.344
  333    H    ALA  43           H        ALA  43   3.442 -12.579  -8.800
  334    HA   ALA  43           HA       ALA  43   1.809 -14.975  -9.399
  335   1HB   ALA  43          1HB       ALA  43   0.497 -13.174  -9.971
  336   2HB   ALA  43          2HB       ALA  43   1.344 -13.371 -11.505
  337   3HB   ALA  43          3HB       ALA  43   1.883 -12.151 -10.350
  338    HA   PRO  44           HA       PRO  44   5.004 -16.447 -12.099
  339   1HB   PRO  44          2HB       PRO  44   3.553 -18.517 -13.177
  340   2HB   PRO  44          1HB       PRO  44   4.281 -18.571 -11.562
  341   1HG   PRO  44          2HG       PRO  44   1.418 -18.231 -12.317
  342   2HG   PRO  44          1HG       PRO  44   2.115 -18.888 -10.827
  343   1HD   PRO  44          2HD       PRO  44   1.037 -16.284 -11.161
  344   2HD   PRO  44          1HD       PRO  44   2.003 -16.851  -9.781
  345    H    GLY  45           H        GLY  45   5.546 -15.932 -14.222
  346   1HA   GLY  45          2HA       GLY  45   5.150 -15.572 -16.558
  347   2HA   GLY  45          1HA       GLY  45   3.414 -15.638 -16.247
  348    H    TYR  46           H        TYR  46   3.818 -13.746 -13.923
  349    HA   TYR  46           HA       TYR  46   3.799 -11.246 -15.534
  350   1HB   TYR  46          2HB       TYR  46   1.865 -11.806 -14.025
  351   2HB   TYR  46          1HB       TYR  46   2.961 -11.712 -12.653
  352    HD1  TYR  46           HD1      TYR  46   4.410  -9.234 -14.433
  353    HD2  TYR  46           HD2      TYR  46   0.589 -10.060 -12.683
  354    HE1  TYR  46           HE1      TYR  46   3.976  -6.823 -14.267
  355    HE2  TYR  46           HE2      TYR  46   0.179  -7.634 -12.521
  356    HH   TYR  46           HH       TYR  46   2.556  -5.308 -12.870
  357    H    SER  47           H        SER  47   5.836 -10.397 -15.652
  358    HA   SER  47           HA       SER  47   7.792 -10.760 -13.518
  359   1HB   SER  47          2HB       SER  47   8.779  -8.725 -15.078
  360   2HB   SER  47          1HB       SER  47   9.031 -10.438 -15.404
  361    HG   SER  47           HG       SER  47   7.666 -10.329 -17.016
  362    H    TYR  48           H        TYR  48   6.436  -9.861 -11.793
  363    HA   TYR  48           HA       TYR  48   5.282  -7.339 -11.600
  364   1HB   TYR  48          2HB       TYR  48   6.565  -9.240  -9.741
  365   2HB   TYR  48          1HB       TYR  48   6.446  -7.592  -9.151
  366    HD1  TYR  48           HD1      TYR  48   4.111  -9.484 -11.378
  367    HD2  TYR  48           HD2      TYR  48   4.785  -7.644  -7.574
  368    HE1  TYR  48           HE1      TYR  48   1.746  -9.906 -10.757
  369    HE2  TYR  48           HE2      TYR  48   2.423  -8.057  -6.941
  370    HH   TYR  48           HH       TYR  48   0.563  -9.290  -7.505
  371    H    THR  49           H        THR  49   6.411  -5.547 -10.034
  372    HA   THR  49           HA       THR  49   8.467  -4.306 -11.562
  373    HB   THR  49           HB       THR  49   8.688  -3.529  -8.795
  374    HG1  THR  49           HG1      THR  49   6.677  -3.459  -8.170
  375   1HG2  THR  49          1HG2      THR  49   7.079  -1.795 -10.474
  376   2HG2  THR  49          2HG2      THR  49   8.500  -2.379 -11.338
  377   3HG2  THR  49          3HG2      THR  49   8.687  -1.522  -9.809
  378    H    ALA  50           H        ALA  50  10.074  -5.910 -11.933
  379    HA   ALA  50           HA       ALA  50  11.361  -7.518 -10.029
  380   1HB   ALA  50          1HB       ALA  50  13.245  -6.449 -11.976
  381   2HB   ALA  50          2HB       ALA  50  11.720  -6.910 -12.735
  382   3HB   ALA  50          3HB       ALA  50  12.635  -8.095 -11.801
  383    H    ALA  51           H        ALA  51  11.958  -4.131 -10.868
  384    HA   ALA  51           HA       ALA  51  14.369  -3.792  -9.415
  385   1HB   ALA  51          1HB       ALA  51  12.224  -2.011 -10.433
  386   2HB   ALA  51          2HB       ALA  51  13.968  -1.911 -10.653
  387   3HB   ALA  51          3HB       ALA  51  13.239  -1.352  -9.151
  388    H    ASN  52           H        ASN  52  10.974  -3.380  -8.324
  389    HA   ASN  52           HA       ASN  52  11.620  -2.629  -5.640
  390   1HB   ASN  52          2HB       ASN  52   9.359  -2.392  -6.700
  391   2HB   ASN  52          1HB       ASN  52   9.174  -4.142  -6.599
  392   1HD2  ASN  52          1HD2      ASN  52   8.870  -1.193  -4.818
  393   2HD2  ASN  52          2HD2      ASN  52   8.530  -1.888  -3.308
  394    H    LYS  53           H        LYS  53  10.597  -5.806  -6.940
  395    HA   LYS  53           HA       LYS  53  10.838  -7.321  -4.600
  396   1HB   LYS  53          2HB       LYS  53   9.955  -8.300  -6.637
  397   2HB   LYS  53          1HB       LYS  53  11.509  -8.107  -7.449
  398   1HG   LYS  53          2HG       LYS  53  12.294 -10.029  -6.568
  399   2HG   LYS  53          1HG       LYS  53  11.810  -9.548  -4.942
  400   1HD   LYS  53          2HD       LYS  53   9.408 -10.147  -5.693
  401   2HD   LYS  53          1HD       LYS  53  10.184 -10.995  -7.030
  402   1HE   LYS  53          2HE       LYS  53  11.285 -12.508  -5.591
  403   2HE   LYS  53          1HE       LYS  53  11.044 -11.476  -4.180
  404   1HZ   LYS  53          1HZ       LYS  53   9.192 -12.585  -3.765
  405   2HZ   LYS  53          2HZ       LYS  53   9.373 -13.510  -5.179
  406   3HZ   LYS  53          3HZ       LYS  53   8.533 -12.034  -5.228
  407    H    ASN  54           H        ASN  54  13.413  -6.327  -6.826
  408    HA   ASN  54           HA       ASN  54  15.436  -7.818  -5.363
  409   1HB   ASN  54          2HB       ASN  54  15.440  -5.940  -7.704
  410   2HB   ASN  54          1HB       ASN  54  16.958  -6.308  -6.885
  411   1HD2  ASN  54          1HD2      ASN  54  16.474  -7.171  -9.579
  412   2HD2  ASN  54          2HD2      ASN  54  16.368  -8.865  -9.587
  413    H    LYS  55           H        LYS  55  14.049  -4.633  -5.258
  414    HA   LYS  55           HA       LYS  55  16.189  -3.272  -3.954
  415   1HB   LYS  55          2HB       LYS  55  13.793  -2.540  -4.979
  416   2HB   LYS  55          1HB       LYS  55  13.395  -2.563  -3.268
  417   1HG   LYS  55          2HG       LYS  55  15.793  -1.109  -4.413
  418   2HG   LYS  55          1HG       LYS  55  14.239  -0.335  -4.108
  419   1HD   LYS  55          2HD       LYS  55  16.074  -1.622  -2.073
  420   2HD   LYS  55          1HD       LYS  55  15.631   0.080  -2.188
  421   1HE   LYS  55          2HE       LYS  55  13.229  -0.603  -1.814
  422   2HE   LYS  55          1HE       LYS  55  13.809  -2.233  -1.476
  423   1HZ   LYS  55          1HZ       LYS  55  14.331   0.253   0.030
  424   2HZ   LYS  55          2HZ       LYS  55  15.330  -1.111   0.200
  425   3HZ   LYS  55          3HZ       LYS  55  13.681  -1.207   0.596
  426    H    GLY  56           H        GLY  56  14.209  -5.829  -2.920
  427   1HA   GLY  56          1HA       GLY  56  13.965  -6.860  -0.823
  428   2HA   GLY  56          2HA       GLY  56  15.375  -5.931  -0.311
  429    H    ILE  57           H        ILE  57  11.941  -5.328  -1.133
  430    HA   ILE  57           HA       ILE  57  11.819  -3.572   1.287
  431    HB   ILE  57           HB       ILE  57  11.871  -2.299  -0.884
  432   1HG1  ILE  57          2HG1      ILE  57  10.707  -1.486   1.221
  433   2HG1  ILE  57          1HG1      ILE  57  10.090  -0.798  -0.280
  434   1HG2  ILE  57          1HG2      ILE  57  10.093  -2.479  -2.447
  435   2HG2  ILE  57          2HG2      ILE  57   9.108  -3.432  -1.337
  436   3HG2  ILE  57          3HG2      ILE  57  10.540  -4.145  -2.078
  437   1HD1  ILE  57          1HD1      ILE  57   8.743  -2.530   1.672
  438   2HD1  ILE  57          2HD1      ILE  57   8.546  -3.075   0.009
  439   3HD1  ILE  57          3HD1      ILE  57   8.051  -1.445   0.468
  440    H    ILE  58           H        ILE  58  10.352  -4.333   2.706
  441    HA   ILE  58           HA       ILE  58   8.313  -6.276   1.830
  442    HB   ILE  58           HB       ILE  58   9.278  -6.823   3.937
  443   1HG1  ILE  58          2HG1      ILE  58   7.421  -6.747   5.463
  444   2HG1  ILE  58          1HG1      ILE  58   6.770  -5.300   4.694
  445   1HG2  ILE  58          1HG2      ILE  58  10.438  -4.960   4.688
  446   2HG2  ILE  58          2HG2      ILE  58   9.064  -4.939   5.793
  447   3HG2  ILE  58          3HG2      ILE  58   9.084  -3.869   4.391
  448   1HD1  ILE  58          1HD1      ILE  58   7.170  -7.769   3.038
  449   2HD1  ILE  58          2HD1      ILE  58   5.995  -6.468   2.838
  450   3HD1  ILE  58          3HD1      ILE  58   5.770  -7.673   4.107
  451    H    TRP  59           H        TRP  59   6.772  -5.167   0.655
  452    HA   TRP  59           HA       TRP  59   5.892  -2.602   0.736
  453   1HB   TRP  59          2HB       TRP  59   4.397  -5.162   0.319
  454   2HB   TRP  59          1HB       TRP  59   3.499  -3.643   0.363
  455    HD1  TRP  59           HD1      TRP  59   4.592  -5.709  -2.177
  456    HE1  TRP  59           HE1      TRP  59   5.494  -4.467  -4.249
  457    HE3  TRP  59           HE3      TRP  59   5.399  -1.084  -0.158
  458    HZ2  TRP  59           HZ2      TRP  59   6.438  -1.862  -4.951
  459    HZ3  TRP  59           HZ3      TRP  59   6.303   0.752  -1.550
  460    HH2  TRP  59           HH2      TRP  59   6.821   0.368  -3.940
  461    H    GLY  60           H        GLY  60   5.556  -1.349   2.464
  462   1HA   GLY  60          1HA       GLY  60   3.677  -2.343   4.565
  463   2HA   GLY  60          2HA       GLY  60   5.148  -1.475   5.005
  464    H    GLU  61           H        GLU  61   3.411  -0.011   6.004
  465    HA   GLU  61           HA       GLU  61   1.761   1.587   4.245
  466   1HB   GLU  61          2HB       GLU  61   1.051   1.370   6.522
  467   2HB   GLU  61          1HB       GLU  61   2.618   1.903   7.129
  468   1HG   GLU  61          2HG       GLU  61   2.260   4.139   6.389
  469   2HG   GLU  61          1HG       GLU  61   0.882   3.666   5.393
  470    H    ASP  62           H        ASP  62   4.669   2.441   6.174
  471    HA   ASP  62           HA       ASP  62   5.006   4.977   4.879
  472   1HB   ASP  62          2HB       ASP  62   5.976   4.117   7.138
  473   2HB   ASP  62          1HB       ASP  62   7.276   3.462   6.142
  474    H    THR  63           H        THR  63   6.515   1.790   4.340
  475    HA   THR  63           HA       THR  63   8.397   2.610   2.385
  476    HB   THR  63           HB       THR  63   7.608   0.095   1.543
  477    HG1  THR  63           HG1      THR  63   7.550  -0.650   4.013
  478   1HG2  THR  63          1HG2      THR  63   9.893   0.886   2.125
  479   2HG2  THR  63          2HG2      THR  63   9.529  -0.685   2.839
  480   3HG2  THR  63          3HG2      THR  63   9.475   0.770   3.835
  481    H    LEU  64           H        LEU  64   4.971   1.759   2.086
  482    HA   LEU  64           HA       LEU  64   4.938   1.931  -0.806
  483   1HB   LEU  64          2HB       LEU  64   3.173   1.032   1.096
  484   2HB   LEU  64          1HB       LEU  64   2.431   2.554   0.610
  485    HG   LEU  64           HG       LEU  64   3.166   0.210  -1.152
  486   1HD1  LEU  64          1HD1      LEU  64   0.625   1.610  -0.325
  487   2HD1  LEU  64          2HD1      LEU  64   1.028  -0.101  -0.189
  488   3HD1  LEU  64          3HD1      LEU  64   0.690   0.603  -1.770
  489   1HD2  LEU  64          1HD2      LEU  64   3.827   2.093  -2.441
  490   2HD2  LEU  64          2HD2      LEU  64   2.491   3.076  -1.839
  491   3HD2  LEU  64          3HD2      LEU  64   2.177   1.759  -2.970
  492    H    MET  65           H        MET  65   4.462   4.189   1.850
  493    HA   MET  65           HA       MET  65   3.290   6.356   0.485
  494   1HB   MET  65          2HB       MET  65   3.770   6.242   2.955
  495   2HB   MET  65          1HB       MET  65   5.467   6.555   2.589
  496   1HG   MET  65          2HG       MET  65   4.395   8.583   1.211
  497   2HG   MET  65          1HG       MET  65   3.119   8.387   2.412
  498   1HE   MET  65          1HE       MET  65   7.186   7.807   3.058
  499   2HE   MET  65          2HE       MET  65   7.469   9.536   2.875
  500   3HE   MET  65          3HE       MET  65   6.664   8.641   1.589
  501    H    GLU  66           H        GLU  66   6.680   5.318   0.609
  502    HA   GLU  66           HA       GLU  66   7.669   7.593  -0.871
  503   1HB   GLU  66          2HB       GLU  66   8.934   5.895   0.679
  504   2HB   GLU  66          1HB       GLU  66   9.080   4.945  -0.798
  505   1HG   GLU  66          2HG       GLU  66  10.872   6.212  -1.314
  506   2HG   GLU  66          1HG       GLU  66   9.746   7.542  -1.585
  507    H    TYR  67           H        TYR  67   7.292   4.148  -1.801
  508    HA   TYR  67           HA       TYR  67   7.923   4.359  -4.509
  509   1HB   TYR  67          2HB       TYR  67   7.405   2.227  -3.363
  510   2HB   TYR  67          1HB       TYR  67   5.701   2.676  -3.318
  511    HD1  TYR  67           HD1      TYR  67   4.428   1.561  -4.907
  512    HD2  TYR  67           HD2      TYR  67   8.419   2.776  -5.923
  513    HE1  TYR  67           HE1      TYR  67   4.125   0.647  -7.190
  514    HE2  TYR  67           HE2      TYR  67   8.116   1.863  -8.207
  515    HH   TYR  67           HH       TYR  67   5.452  -0.144  -9.039
  516    H    LEU  68           H        LEU  68   4.949   5.375  -2.907
  517    HA   LEU  68           HA       LEU  68   3.572   5.856  -5.448
  518   1HB   LEU  68          2HB       LEU  68   2.846   5.743  -2.668
  519   2HB   LEU  68          1HB       LEU  68   2.307   7.281  -3.343
  520    HG   LEU  68           HG       LEU  68   1.162   6.123  -5.164
  521   1HD1  LEU  68          1HD1      LEU  68   1.272   3.815  -5.535
  522   2HD1  LEU  68          2HD1      LEU  68   1.775   3.472  -3.879
  523   3HD1  LEU  68          3HD1      LEU  68   2.921   4.172  -5.021
  524   1HD2  LEU  68          1HD2      LEU  68   0.197   4.457  -2.932
  525   2HD2  LEU  68          2HD2      LEU  68  -0.655   5.686  -3.867
  526   3HD2  LEU  68          3HD2      LEU  68   0.382   6.162  -2.522
  527    H    GLU  69           H        GLU  69   5.280   7.772  -3.004
  528    HA   GLU  69           HA       GLU  69   4.674  10.351  -4.032
  529   1HB   GLU  69          2HB       GLU  69   6.048   9.507  -1.911
  530   2HB   GLU  69          1HB       GLU  69   7.410   9.726  -2.999
  531   1HG   GLU  69          2HG       GLU  69   6.510  12.058  -3.477
  532   2HG   GLU  69          1HG       GLU  69   5.393  11.809  -2.135
  533    H    ASN  70           H        ASN  70   6.643   7.767  -5.132
  534    HA   ASN  70           HA       ASN  70   7.036   8.822  -7.742
  535   1HB   ASN  70          2HB       ASN  70   9.585   9.098  -7.525
  536   2HB   ASN  70          1HB       ASN  70   8.593  10.404  -6.875
  537   1HD2  ASN  70          1HD2      ASN  70  10.940  10.484  -5.678
  538   2HD2  ASN  70          2HD2      ASN  70  10.960   9.716  -4.165
  539    HA   PRO  71           HA       PRO  71   7.719   4.364  -7.328
  540   1HB   PRO  71          2HB       PRO  71   6.597   3.778  -9.778
  541   2HB   PRO  71          1HB       PRO  71   5.663   3.949  -8.283
  542   1HG   PRO  71          2HG       PRO  71   5.904   5.843 -10.573
  543   2HG   PRO  71          1HG       PRO  71   4.577   5.641  -9.419
  544   1HD   PRO  71          2HD       PRO  71   6.502   7.702  -9.346
  545   2HD   PRO  71          1HD       PRO  71   5.419   7.249  -8.012
  546    H    LYS  72           H        LYS  72   8.442   6.487 -10.075
  547    HA   LYS  72           HA       LYS  72  10.367   4.668 -11.246
  548   1HB   LYS  72          2HB       LYS  72   9.034   6.716 -12.291
  549   2HB   LYS  72          1HB       LYS  72  10.453   7.612 -11.754
  550   1HG   LYS  72          2HG       LYS  72  11.187   5.113 -13.064
  551   2HG   LYS  72          1HG       LYS  72  10.231   6.150 -14.123
  552   1HD   LYS  72          2HD       LYS  72  11.770   8.041 -13.612
  553   2HD   LYS  72          1HD       LYS  72  12.753   6.946 -12.639
  554   1HE   LYS  72          2HE       LYS  72  13.866   6.404 -14.522
  555   2HE   LYS  72          1HE       LYS  72  12.392   5.618 -15.086
  556   1HZ   LYS  72          1HZ       LYS  72  11.753   7.475 -16.276
  557   2HZ   LYS  72          2HZ       LYS  72  13.436   7.456 -16.516
  558   3HZ   LYS  72          3HZ       LYS  72  12.746   8.527 -15.391
  559    H    LYS  73           H        LYS  73  10.363   6.793  -8.586
  560    HA   LYS  73           HA       LYS  73  13.291   7.234  -8.659
  561   1HB   LYS  73          2HB       LYS  73  12.062   9.146  -7.915
  562   2HB   LYS  73          1HB       LYS  73  11.084   8.175  -6.814
  563   1HG   LYS  73          2HG       LYS  73  12.823   9.412  -5.579
  564   2HG   LYS  73          1HG       LYS  73  13.093   7.673  -5.469
  565   1HD   LYS  73          2HD       LYS  73  14.615   7.984  -7.542
  566   2HD   LYS  73          1HD       LYS  73  14.577   9.699  -7.137
  567   1HE   LYS  73          2HE       LYS  73  15.081   8.086  -4.774
  568   2HE   LYS  73          1HE       LYS  73  16.278   7.763  -6.030
  569   1HZ   LYS  73          1HZ       LYS  73  15.550  10.547  -5.490
  570   2HZ   LYS  73          2HZ       LYS  73  17.034   9.894  -5.996
  571   3HZ   LYS  73          3HZ       LYS  73  16.552   9.757  -4.372
  572    H    TYR  74           H        TYR  74  10.845   5.621  -6.612
  573    HA   TYR  74           HA       TYR  74  12.821   4.478  -4.821
  574   1HB   TYR  74          2HB       TYR  74  10.285   4.837  -4.399
  575   2HB   TYR  74          1HB       TYR  74  10.066   3.346  -5.312
  576    HD1  TYR  74           HD1      TYR  74  12.703   4.410  -2.871
  577    HD2  TYR  74           HD2      TYR  74   9.570   1.626  -3.810
  578    HE1  TYR  74           HE1      TYR  74  13.275   3.086  -0.854
  579    HE2  TYR  74           HE2      TYR  74  10.142   0.302  -1.794
  580    HH   TYR  74           HH       TYR  74  11.743   1.350   0.696
  581    H    ILE  75           H        ILE  75  10.604   2.815  -7.080
  582    HA   ILE  75           HA       ILE  75  12.617   0.696  -7.441
  583    HB   ILE  75           HB       ILE  75   9.812   0.836  -8.560
  584   1HG1  ILE  75          2HG1      ILE  75   9.606   1.185  -6.171
  585   2HG1  ILE  75          1HG1      ILE  75   9.202  -0.500  -6.506
  586   1HG2  ILE  75          1HG2      ILE  75  11.069  -0.920  -9.523
  587   2HG2  ILE  75          2HG2      ILE  75  10.127  -1.683  -8.243
  588   3HG2  ILE  75          3HG2      ILE  75  11.833  -1.316  -7.985
  589   1HD1  ILE  75          1HD1      ILE  75  11.583   0.642  -5.126
  590   2HD1  ILE  75          2HD1      ILE  75  11.846  -0.780  -6.136
  591   3HD1  ILE  75          3HD1      ILE  75  10.703  -0.850  -4.795
  592    HA   PRO  76           HA       PRO  76  13.501   2.963 -11.253
  593   1HB   PRO  76          2HB       PRO  76  15.937   1.756 -11.652
  594   2HB   PRO  76          1HB       PRO  76  15.698   3.149 -10.584
  595   1HG   PRO  76          2HG       PRO  76  16.137   0.287  -9.867
  596   2HG   PRO  76          1HG       PRO  76  16.517   1.747  -8.938
  597   1HD   PRO  76          2HD       PRO  76  14.299   0.046  -8.509
  598   2HD   PRO  76          1HD       PRO  76  14.513   1.675  -7.838
  599    H    GLY  77           H        GLY  77  11.682   1.530 -12.129
  600   1HA   GLY  77          2HA       GLY  77  12.373   0.151 -14.430
  601   2HA   GLY  77          1HA       GLY  77  12.385  -1.090 -13.177
  602    H    THR  78           H        THR  78  10.179   0.491 -11.729
  603    HA   THR  78           HA       THR  78   7.958  -0.989 -12.449
  604    HB   THR  78           HB       THR  78   8.083   0.691 -10.546
  605    HG1  THR  78           HG1      THR  78   6.132  -0.288 -11.061
  606   1HG2  THR  78          1HG2      THR  78   8.321   2.478 -12.765
  607   2HG2  THR  78          2HG2      THR  78   8.337   2.869 -11.045
  608   3HG2  THR  78          3HG2      THR  78   6.812   2.843 -11.929
  609    H    LYS  79           H        LYS  79   6.096  -0.557 -13.792
  610    HA   LYS  79           HA       LYS  79   6.796   1.075 -16.194
  611   1HB   LYS  79          2HB       LYS  79   5.189  -1.450 -15.835
  612   2HB   LYS  79          1HB       LYS  79   4.945  -0.423 -17.248
  613   1HG   LYS  79          2HG       LYS  79   7.175  -0.717 -17.991
  614   2HG   LYS  79          1HG       LYS  79   7.703  -1.333 -16.425
  615   1HD   LYS  79          2HD       LYS  79   6.850  -3.438 -16.806
  616   2HD   LYS  79          1HD       LYS  79   5.543  -2.838 -17.828
  617   1HE   LYS  79          2HE       LYS  79   7.637  -2.151 -19.375
  618   2HE   LYS  79          1HE       LYS  79   8.344  -3.540 -18.550
  619   1HZ   LYS  79          1HZ       LYS  79   7.195  -4.852 -19.889
  620   2HZ   LYS  79          2HZ       LYS  79   6.463  -3.514 -20.638
  621   3HZ   LYS  79          3HZ       LYS  79   5.744  -4.225 -19.273
  622    H    MET  80           H        MET  80   5.154   1.452 -13.448
  623    HA   MET  80           HA       MET  80   2.683   2.499 -14.711
  624   1HB   MET  80          2HB       MET  80   1.745   2.617 -12.499
  625   2HB   MET  80          1HB       MET  80   2.588   1.091 -12.637
  626   1HG   MET  80          2HG       MET  80   4.464   1.903 -11.412
  627   2HG   MET  80          1HG       MET  80   3.801   3.521 -11.386
  628   1HE   MET  80          1HE       MET  80   2.663   3.806  -8.182
  629   2HE   MET  80          2HE       MET  80   1.470   4.127  -9.440
  630   3HE   MET  80          3HE       MET  80   3.179   4.417  -9.760
  631    H    ILE  81           H        ILE  81   2.673   4.536 -15.357
  632    HA   ILE  81           HA       ILE  81   4.725   6.423 -14.441
  633    HB   ILE  81           HB       ILE  81   2.402   6.830 -16.353
  634   1HG1  ILE  81          2HG1      ILE  81   4.101   5.055 -16.986
  635   2HG1  ILE  81          1HG1      ILE  81   3.984   6.399 -18.122
  636   1HG2  ILE  81          1HG2      ILE  81   3.006   9.002 -16.114
  637   2HG2  ILE  81          2HG2      ILE  81   4.452   8.562 -17.024
  638   3HG2  ILE  81          3HG2      ILE  81   4.491   8.580 -15.261
  639   1HD1  ILE  81          1HD1      ILE  81   5.957   6.590 -15.877
  640   2HD1  ILE  81          2HD1      ILE  81   6.031   7.293 -17.492
  641   3HD1  ILE  81          3HD1      ILE  81   6.350   5.574 -17.264
  642    H    PHE  82           H        PHE  82   3.746   6.195 -12.172
  643    HA   PHE  82           HA       PHE  82   1.330   7.890 -11.818
  644   1HB   PHE  82          2HB       PHE  82   1.590   5.611 -10.691
  645   2HB   PHE  82          1HB       PHE  82   2.827   6.355  -9.682
  646    HD1  PHE  82           HD1      PHE  82   1.903   6.636  -7.544
  647    HD2  PHE  82           HD2      PHE  82  -0.417   7.691 -11.001
  648    HE1  PHE  82           HE1      PHE  82   0.128   7.555  -6.074
  649    HE2  PHE  82           HE2      PHE  82  -2.190   8.611  -9.532
  650    HZ   PHE  82           HZ       PHE  82  -1.918   8.537  -7.068
  651    H    VAL  83           H        VAL  83   1.425   9.734 -10.423
  652    HA   VAL  83           HA       VAL  83   4.136  10.933 -10.294
  653    HB   VAL  83           HB       VAL  83   2.546  12.916  -9.374
  654   1HG1  VAL  83          1HG1      VAL  83   3.410  13.796 -11.252
  655   2HG1  VAL  83          2HG1      VAL  83   2.232  12.903 -12.215
  656   3HG1  VAL  83          3HG1      VAL  83   3.794  12.178 -11.835
  657   1HG2  VAL  83          1HG2      VAL  83   0.396  12.893 -10.477
  658   2HG2  VAL  83          2HG2      VAL  83   0.535  11.389  -9.566
  659   3HG2  VAL  83          3HG2      VAL  83   0.784  11.388 -11.310
  660    H    GLY  84           H        GLY  84   1.551  11.687  -8.018
  661   1HA   GLY  84          2HA       GLY  84   1.920  10.221  -5.802
  662   2HA   GLY  84          1HA       GLY  84   3.442  11.114  -5.817
  663    H    ILE  85           H        ILE  85   0.447  11.158  -4.486
  664    HA   ILE  85           HA       ILE  85  -0.358  13.896  -4.752
  665    HB   ILE  85           HB       ILE  85  -0.832  12.309  -2.241
  666   1HG1  ILE  85          2HG1      ILE  85  -2.879  11.673  -4.069
  667   2HG1  ILE  85          1HG1      ILE  85  -1.374  11.432  -4.956
  668   1HG2  ILE  85          1HG2      ILE  85  -1.954  14.345  -2.123
  669   2HG2  ILE  85          2HG2      ILE  85  -3.190  13.326  -2.858
  670   3HG2  ILE  85          3HG2      ILE  85  -2.229  14.411  -3.863
  671   1HD1  ILE  85          1HD1      ILE  85  -1.699   9.357  -3.897
  672   2HD1  ILE  85          2HD1      ILE  85  -2.294  10.104  -2.413
  673   3HD1  ILE  85          3HD1      ILE  85  -0.578  10.183  -2.814
  674    H    LYS  86           H        LYS  86  -0.106  15.609  -3.116
  675    HA   LYS  86           HA       LYS  86   2.565  15.433  -1.807
  676   1HB   LYS  86          2HB       LYS  86   0.839  17.792  -2.599
  677   2HB   LYS  86          1HB       LYS  86   2.330  17.947  -1.669
  678   1HG   LYS  86          2HG       LYS  86   2.175  16.571  -4.365
  679   2HG   LYS  86          1HG       LYS  86   2.628  18.263  -4.155
  680   1HD   LYS  86          2HD       LYS  86   4.113  16.535  -2.344
  681   2HD   LYS  86          1HD       LYS  86   4.352  16.067  -4.027
  682   1HE   LYS  86          2HE       LYS  86   4.420  18.924  -3.871
  683   2HE   LYS  86          1HE       LYS  86   5.508  18.275  -2.645
  684   1HZ   LYS  86          1HZ       LYS  86   6.818  18.362  -4.531
  685   2HZ   LYS  86          2HZ       LYS  86   5.563  17.875  -5.567
  686   3HZ   LYS  86          3HZ       LYS  86   6.297  16.747  -4.529
  687    H    LYS  87           H        LYS  87  -0.739  15.296  -1.058
  688    HA   LYS  87           HA       LYS  87  -0.402  16.472   1.633
  689   1HB   LYS  87          2HB       LYS  87  -2.529  16.503   0.000
  690   2HB   LYS  87          1HB       LYS  87  -2.887  15.013   0.874
  691   1HG   LYS  87          2HG       LYS  87  -3.875  16.518   2.315
  692   2HG   LYS  87          1HG       LYS  87  -2.237  16.539   2.972
  693   1HD   LYS  87          2HD       LYS  87  -2.019  18.401   0.987
  694   2HD   LYS  87          1HD       LYS  87  -3.694  18.637   1.485
  695   1HE   LYS  87          2HE       LYS  87  -3.111  19.271   3.642
  696   2HE   LYS  87          1HE       LYS  87  -1.586  18.387   3.600
  697   1HZ   LYS  87          1HZ       LYS  87  -2.087  21.086   2.943
  698   2HZ   LYS  87          2HZ       LYS  87  -1.463  20.281   1.583
  699   3HZ   LYS  87          3HZ       LYS  87  -0.601  20.274   3.047
  700    H    LYS  88           H        LYS  88   0.250  15.232   3.314
  701    HA   LYS  88           HA       LYS  88   0.797  12.448   3.106
  702   1HB   LYS  88          2HB       LYS  88   1.200  14.465   5.016
  703   2HB   LYS  88          1HB       LYS  88   0.217  13.252   5.837
  704   1HG   LYS  88          2HG       LYS  88   1.803  11.507   5.296
  705   2HG   LYS  88          1HG       LYS  88   2.731  12.605   4.274
  706   1HD   LYS  88          2HD       LYS  88   2.925  14.054   6.444
  707   2HD   LYS  88          1HD       LYS  88   2.508  12.555   7.274
  708   1HE   LYS  88          2HE       LYS  88   4.788  12.267   7.203
  709   2HE   LYS  88          1HE       LYS  88   4.397  11.599   5.618
  710   1HZ   LYS  88          1HZ       LYS  88   6.007  13.790   6.186
  711   2HZ   LYS  88          2HZ       LYS  88   4.611  14.400   5.432
  712   3HZ   LYS  88          3HZ       LYS  88   5.545  13.210   4.660
  713    H    GLU  89           H        GLU  89  -2.076  14.193   4.177
  714    HA   GLU  89           HA       GLU  89  -3.441  11.959   5.329
  715   1HB   GLU  89          2HB       GLU  89  -3.998  14.506   5.437
  716   2HB   GLU  89          1HB       GLU  89  -4.872  14.210   3.933
  717   1HG   GLU  89          2HG       GLU  89  -5.849  12.160   5.335
  718   2HG   GLU  89          1HG       GLU  89  -5.452  13.218   6.690
  719    H    GLU  90           H        GLU  90  -2.999  13.042   2.030
  720    HA   GLU  90           HA       GLU  90  -5.146  11.449   0.905
  721   1HB   GLU  90          2HB       GLU  90  -3.613  13.467  -0.065
  722   2HB   GLU  90          1HB       GLU  90  -2.793  12.083  -0.787
  723   1HG   GLU  90          2HG       GLU  90  -4.427  11.913  -2.322
  724   2HG   GLU  90          1HG       GLU  90  -5.609  11.663  -1.036
  725    H    ARG  91           H        ARG  91  -1.636  10.975   1.298
  726    HA   ARG  91           HA       ARG  91  -1.555   8.426  -0.032
  727   1HB   ARG  91          2HB       ARG  91   0.262   9.613   2.088
  728   2HB   ARG  91          1HB       ARG  91   0.628   8.166   1.151
  729   1HG   ARG  91          2HG       ARG  91   1.539   9.530  -0.399
  730   2HG   ARG  91          1HG       ARG  91  -0.101  10.064  -0.768
  731   1HD   ARG  91          2HD       ARG  91   0.824  12.106  -0.236
  732   2HD   ARG  91          1HD       ARG  91   0.330  11.602   1.379
  733    HE   ARG  91           HE       ARG  91   2.766  10.676   1.519
  734   1HH1  ARG  91          1HH1      ARG  91   2.295  13.673   1.988
  735   2HH1  ARG  91          2HH1      ARG  91   3.571  14.355   1.036
  736   1HH2  ARG  91          1HH2      ARG  91   4.188  11.425  -0.716
  737   2HH2  ARG  91          2HH2      ARG  91   4.650  13.078  -0.490
  738    H    ALA  92           H        ALA  92  -1.469   9.210   3.463
  739    HA   ALA  92           HA       ALA  92  -1.642   6.613   4.483
  740   1HB   ALA  92          1HB       ALA  92  -1.453   8.072   6.231
  741   2HB   ALA  92          2HB       ALA  92  -3.213   7.963   6.246
  742   3HB   ALA  92          3HB       ALA  92  -2.420   9.310   5.430
  743    H    ASP  93           H        ASP  93  -4.219   8.657   3.198
  744    HA   ASP  93           HA       ASP  93  -6.420   7.031   3.991
  745   1HB   ASP  93          2HB       ASP  93  -6.187   9.433   2.746
  746   2HB   ASP  93          1HB       ASP  93  -6.631   8.410   1.379
  747    H    LEU  94           H        LEU  94  -4.420   6.984   1.037
  748    HA   LEU  94           HA       LEU  94  -5.879   5.044  -0.409
  749   1HB   LEU  94          2HB       LEU  94  -2.862   5.115  -0.381
  750   2HB   LEU  94          1HB       LEU  94  -3.937   4.751  -1.730
  751    HG   LEU  94           HG       LEU  94  -3.391   7.432  -0.451
  752   1HD1  LEU  94          1HD1      LEU  94  -2.251   6.170  -2.596
  753   2HD1  LEU  94          2HD1      LEU  94  -2.331   7.921  -2.401
  754   3HD1  LEU  94          3HD1      LEU  94  -3.540   7.086  -3.377
  755   1HD2  LEU  94          1HD2      LEU  94  -5.641   7.786  -0.715
  756   2HD2  LEU  94          2HD2      LEU  94  -5.821   6.442  -1.843
  757   3HD2  LEU  94          3HD2      LEU  94  -5.194   7.990  -2.408
  758    H    ILE  95           H        ILE  95  -3.292   4.592   2.004
  759    HA   ILE  95           HA       ILE  95  -3.262   1.722   1.837
  760    HB   ILE  95           HB       ILE  95  -2.647   3.246   4.366
  761   1HG1  ILE  95          2HG1      ILE  95  -1.571   4.606   2.728
  762   2HG1  ILE  95          1HG1      ILE  95  -0.317   3.519   3.323
  763   1HG2  ILE  95          1HG2      ILE  95  -0.640   1.480   3.978
  764   2HG2  ILE  95          2HG2      ILE  95  -1.928   0.654   3.103
  765   3HG2  ILE  95          3HG2      ILE  95  -2.138   1.058   4.807
  766   1HD1  ILE  95          1HD1      ILE  95  -0.624   2.048   1.405
  767   2HD1  ILE  95          2HD1      ILE  95  -0.332   3.691   0.836
  768   3HD1  ILE  95          3HD1      ILE  95  -1.967   3.033   0.829
  769    H    ALA  96           H        ALA  96  -5.000   3.990   3.932
  770    HA   ALA  96           HA       ALA  96  -6.212   2.260   5.742
  771   1HB   ALA  96          1HB       ALA  96  -7.370   4.674   4.331
  772   2HB   ALA  96          2HB       ALA  96  -6.625   4.616   5.928
  773   3HB   ALA  96          3HB       ALA  96  -8.190   3.850   5.658
  774    H    TYR  97           H        TYR  97  -7.189   2.853   2.370
  775    HA   TYR  97           HA       TYR  97  -9.526   1.165   2.559
  776   1HB   TYR  97          2HB       TYR  97  -9.527   2.827   0.828
  777   2HB   TYR  97          1HB       TYR  97  -7.972   2.267   0.208
  778    HD1  TYR  97           HD1      TYR  97  -8.148   1.128  -1.811
  779    HD2  TYR  97           HD2      TYR  97 -11.215   0.627   1.153
  780    HE1  TYR  97           HE1      TYR  97  -9.305  -0.501  -3.280
  781    HE2  TYR  97           HE2      TYR  97 -12.376  -0.994  -0.319
  782    HH   TYR  97           HH       TYR  97 -10.930  -2.070  -3.364
  783    H    LEU  98           H        LEU  98  -6.251   0.729   1.228
  784    HA   LEU  98           HA       LEU  98  -6.714  -2.015   0.462
  785   1HB   LEU  98          2HB       LEU  98  -4.488  -0.111   0.440
  786   2HB   LEU  98          1HB       LEU  98  -3.969  -1.752   0.817
  787    HG   LEU  98           HG       LEU  98  -3.888  -1.545  -1.571
  788   1HD1  LEU  98          1HD1      LEU  98  -5.550  -3.384  -0.264
  789   2HD1  LEU  98          2HD1      LEU  98  -4.884  -3.540  -1.890
  790   3HD1  LEU  98          3HD1      LEU  98  -6.486  -2.841  -1.656
  791   1HD2  LEU  98          1HD2      LEU  98  -5.210  -0.084  -2.659
  792   2HD2  LEU  98          2HD2      LEU  98  -6.053   0.252  -1.147
  793   3HD2  LEU  98          3HD2      LEU  98  -6.638  -1.021  -2.221
  794    H    LYS  99           H        LYS  99  -6.472  -0.623   3.482
  795    HA   LYS  99           HA       LYS  99  -5.033  -2.863   4.721
  796   1HB   LYS  99          2HB       LYS  99  -5.205  -0.217   5.381
  797   2HB   LYS  99          1HB       LYS  99  -6.405  -0.922   6.465
  798   1HG   LYS  99          2HG       LYS  99  -4.083  -2.612   6.429
  799   2HG   LYS  99          1HG       LYS  99  -3.577  -0.953   6.752
  800   1HD   LYS  99          2HD       LYS  99  -5.690  -1.015   8.380
  801   2HD   LYS  99          1HD       LYS  99  -5.341  -2.744   8.364
  802   1HE   LYS  99          2HE       LYS  99  -2.885  -1.249   8.643
  803   2HE   LYS  99          1HE       LYS  99  -4.035  -0.757   9.888
  804   1HZ   LYS  99          1HZ       LYS  99  -4.063  -2.810  10.813
  805   2HZ   LYS  99          2HZ       LYS  99  -2.492  -2.859  10.168
  806   3HZ   LYS  99          3HZ       LYS  99  -3.774  -3.614   9.347
  807    H    LYS 100           H        LYS 100  -8.294  -1.421   4.808
  808    HA   LYS 100           HA       LYS 100  -9.330  -3.601   6.457
  809   1HB   LYS 100          2HB       LYS 100 -10.321  -1.367   6.623
  810   2HB   LYS 100          1HB       LYS 100 -10.747  -1.408   4.913
  811   1HG   LYS 100          2HG       LYS 100 -11.701  -3.630   6.685
  812   2HG   LYS 100          1HG       LYS 100 -12.533  -2.075   6.750
  813   1HD   LYS 100          2HD       LYS 100 -12.465  -2.306   4.107
  814   2HD   LYS 100          1HD       LYS 100 -12.333  -4.023   4.486
  815   1HE   LYS 100          2HE       LYS 100 -14.341  -3.083   6.193
  816   2HE   LYS 100          1HE       LYS 100 -14.656  -2.284   4.653
  817   1HZ   LYS 100          1HZ       LYS 100 -15.610  -4.195   4.076
  818   2HZ   LYS 100          2HZ       LYS 100 -14.910  -5.054   5.363
  819   3HZ   LYS 100          3HZ       LYS 100 -14.039  -4.816   3.923
  820    H    ALA 101           H        ALA 101  -9.264  -2.770   3.033
  821    HA   ALA 101           HA       ALA 101 -11.162  -4.748   2.192
  822   1HB   ALA 101          1HB       ALA 101 -10.889  -3.376   0.410
  823   2HB   ALA 101          2HB       ALA 101  -9.506  -4.401   0.024
  824   3HB   ALA 101          3HB       ALA 101  -9.268  -2.900   0.917
  825    H    THR 102           H        THR 102  -7.570  -4.759   2.048
  826    HA   THR 102           HA       THR 102  -7.721  -7.708   1.676
  827    HB   THR 102           HB       THR 102  -5.264  -7.416   1.075
  828    HG1  THR 102           HG1      THR 102  -4.534  -5.526   1.592
  829   1HG2  THR 102          1HG2      THR 102  -5.784  -6.835  -1.154
  830   2HG2  THR 102          2HG2      THR 102  -7.075  -5.743  -0.657
  831   3HG2  THR 102          3HG2      THR 102  -7.295  -7.488  -0.519
  832    H    ASN 103           H        ASN 103  -6.227  -5.243   3.774
  833    HA   ASN 103           HA       ASN 103  -4.918  -7.309   5.372
  834   1HB   ASN 103          2HB       ASN 103  -4.236  -4.755   4.901
  835   2HB   ASN 103          1HB       ASN 103  -5.136  -4.528   6.400
  836   1HD2  ASN 103          1HD2      ASN 103  -3.003  -4.004   7.438
  837   2HD2  ASN 103          2HD2      ASN 103  -1.968  -5.270   7.892
  838    H    GLU 104           HN       GLU 104  -7.987  -6.967   5.148
  839    HA   GLU 104           HA       GLU 104  -8.495  -7.571   7.963
  840   1HB   GLU 104          2HB       GLU 104  -8.554  -4.984   7.647
  841   2HB   GLU 104          1HB       GLU 104 -10.084  -5.283   6.819
  842   1HG   GLU 104          2HG       GLU 104 -10.649  -6.722   8.931
  843   2HG   GLU 104          1HG       GLU 104  -9.366  -5.785   9.695
  844    HHA  HEC 105           HHA      HEC 105   4.073  -2.773  -9.255
  845    HHB  HEC 105           HHB      HEC 105   0.990   0.925  -5.176
  846    HHC  HEC 105           HHC      HEC 105  -2.153   3.615  -9.961
  847    HHD  HEC 105           HHD      HEC 105   0.759  -0.249 -14.023
  848   1HMA  HEC 105          1HMA      HEC 105   3.791  -1.490  -4.269
  849   2HMA  HEC 105          2HMA      HEC 105   2.043  -1.363  -4.073
  850   3HMA  HEC 105          3HMA      HEC 105   3.025   0.097  -4.197
  851   1HAA  HEC 105          1HAA      HEC 105   4.596  -2.773  -5.536
  852   2HAA  HEC 105          2HAA      HEC 105   5.372  -2.432  -7.069
  853   1HBA  HEC 105          1HBA      HEC 105   4.915  -4.581  -7.578
  854   2HBA  HEC 105          2HBA      HEC 105   3.255  -4.035  -7.806
  855   1HMB  HEC 105          1HMB      HEC 105  -0.679   1.918  -4.383
  856   2HMB  HEC 105          2HMB      HEC 105  -2.023   2.998  -4.753
  857   3HMB  HEC 105          3HMB      HEC 105  -0.387   3.639  -4.624
  858    HAB  HEC 105           HAB      HEC 105  -2.609   4.688  -8.260
  859   1HBB  HEC 105          1HBB      HEC 105  -2.233   5.006  -5.328
  860   2HBB  HEC 105          2HBB      HEC 105  -2.680   6.203  -6.545
  861   3HBB  HEC 105          3HBB      HEC 105  -1.030   5.579  -6.485
  862   1HMC  HEC 105          1HMC      HEC 105  -2.087   4.524 -12.680
  863   2HMC  HEC 105          2HMC      HEC 105  -2.954   3.338 -13.657
  864   3HMC  HEC 105          3HMC      HEC 105  -3.335   3.517 -11.943
  865    HAC  HEC 105           HAC      HEC 105  -0.285   1.140 -15.149
  866   1HBC  HEC 105          1HBC      HEC 105  -2.361   2.942 -15.780
  867   2HBC  HEC 105          2HBC      HEC 105  -0.637   3.043 -16.135
  868   3HBC  HEC 105          3HBC      HEC 105  -1.267   3.710 -14.629
  869   1HMD  HEC 105          1HMD      HEC 105   2.183  -1.376 -14.834
  870   2HMD  HEC 105          2HMD      HEC 105   3.738  -2.149 -14.528
  871   3HMD  HEC 105          3HMD      HEC 105   2.255  -3.102 -14.474
  872   1HAD  HEC 105          1HAD      HEC 105   4.061  -4.189 -11.068
  873   2HAD  HEC 105          2HAD      HEC 105   4.024  -4.068 -12.820
  874   1HBD  HEC 105          1HBD      HEC 105   6.219  -3.599 -11.144
  875   2HBD  HEC 105          2HBD      HEC 105   5.711  -2.007 -11.699
  Start of MODEL   17
    1   1H    GLY   1          1HT       GLY   1 -11.697  11.404   6.277
    2   2H    GLY   1          2HT       GLY   1 -10.004  11.542   6.331
    3   3H    GLY   1          3HT       GLY   1 -10.853  10.933   7.671
    4   1HA   GLY   1          1HA       GLY   1 -10.551   9.639   5.016
    5   2HA   GLY   1          2HA       GLY   1  -9.839   9.103   6.540
    6    H    ASP   2           H        ASP   2 -12.407   8.595   4.478
    7    HA   ASP   2           HA       ASP   2 -14.017   7.408   6.702
    8   1HB   ASP   2          2HB       ASP   2 -14.849   9.474   5.084
    9   2HB   ASP   2          1HB       ASP   2 -15.493   8.065   4.244
   10    H    VAL   3           H        VAL   3 -15.528   5.637   5.764
   11    HA   VAL   3           HA       VAL   3 -13.836   3.735   4.336
   12    HB   VAL   3           HB       VAL   3 -16.727   3.535   5.233
   13   1HG1  VAL   3          1HG1      VAL   3 -15.757   1.972   3.362
   14   2HG1  VAL   3          2HG1      VAL   3 -16.649   1.257   4.705
   15   3HG1  VAL   3          3HG1      VAL   3 -14.886   1.218   4.697
   16   1HG2  VAL   3          1HG2      VAL   3 -15.964   2.786   7.267
   17   2HG2  VAL   3          2HG2      VAL   3 -14.587   3.809   6.857
   18   3HG2  VAL   3          3HG2      VAL   3 -14.508   2.070   6.574
   19    H    GLU   4           H        GLU   4 -16.994   5.280   3.658
   20    HA   GLU   4           HA       GLU   4 -17.286   4.196   1.033
   21   1HB   GLU   4          2HB       GLU   4 -18.370   6.696   2.347
   22   2HB   GLU   4          1HB       GLU   4 -18.798   6.237   0.698
   23   1HG   GLU   4          2HG       GLU   4 -20.456   5.033   1.677
   24   2HG   GLU   4          1HG       GLU   4 -19.176   3.876   2.048
   25    H    LYS   5           H        LYS   5 -15.854   7.260   2.156
   26    HA   LYS   5           HA       LYS   5 -15.181   8.177  -0.503
   27   1HB   LYS   5          2HB       LYS   5 -14.990   9.161   2.184
   28   2HB   LYS   5          1HB       LYS   5 -13.412   9.322   1.413
   29   1HG   LYS   5          2HG       LYS   5 -14.949  10.192  -0.613
   30   2HG   LYS   5          1HG       LYS   5 -15.997  10.638   0.734
   31   1HD   LYS   5          2HD       LYS   5 -13.675  11.541   1.725
   32   2HD   LYS   5          1HD       LYS   5 -13.298  11.677   0.007
   33   1HE   LYS   5          2HE       LYS   5 -15.951  12.653   0.394
   34   2HE   LYS   5          1HE       LYS   5 -14.916  13.415   1.600
   35   1HZ   LYS   5          1HZ       LYS   5 -14.726  13.512  -1.334
   36   2HZ   LYS   5          2HZ       LYS   5 -13.330  13.733  -0.392
   37   3HZ   LYS   5          3HZ       LYS   5 -14.654  14.783  -0.213
   38    H    GLY   6           H        GLY   6 -13.523   6.241   1.937
   39   1HA   GLY   6          1HA       GLY   6 -10.901   6.359   0.801
   40   2HA   GLY   6          2HA       GLY   6 -11.497   5.063   1.838
   41    H    LYS   7           H        LYS   7 -13.384   3.790   0.478
   42    HA   LYS   7           HA       LYS   7 -12.040   2.253  -1.464
   43   1HB   LYS   7          2HB       LYS   7 -14.238   1.730  -0.229
   44   2HB   LYS   7          1HB       LYS   7 -15.031   2.670  -1.496
   45   1HG   LYS   7          2HG       LYS   7 -13.780   1.182  -3.169
   46   2HG   LYS   7          1HG       LYS   7 -13.413   0.135  -1.797
   47   1HD   LYS   7          2HD       LYS   7 -16.198   0.798  -1.706
   48   2HD   LYS   7          1HD       LYS   7 -15.813   0.230  -3.332
   49   1HE   LYS   7          2HE       LYS   7 -14.932  -1.832  -2.509
   50   2HE   LYS   7          1HE       LYS   7 -14.913  -1.241  -0.847
   51   1HZ   LYS   7          1HZ       LYS   7 -17.466  -1.263  -2.277
   52   2HZ   LYS   7          2HZ       LYS   7 -17.147  -1.496  -0.624
   53   3HZ   LYS   7          3HZ       LYS   7 -16.850  -2.747  -1.736
   54    H    LYS   8           H        LYS   8 -13.733   5.293  -1.793
   55    HA   LYS   8           HA       LYS   8 -13.998   5.167  -4.679
   56   1HB   LYS   8          2HB       LYS   8 -14.600   7.071  -2.542
   57   2HB   LYS   8          1HB       LYS   8 -13.945   7.864  -3.977
   58   1HG   LYS   8          2HG       LYS   8 -15.742   7.293  -5.282
   59   2HG   LYS   8          1HG       LYS   8 -15.991   5.759  -4.448
   60   1HD   LYS   8          2HD       LYS   8 -16.451   7.940  -2.619
   61   2HD   LYS   8          1HD       LYS   8 -17.428   8.166  -4.069
   62   1HE   LYS   8          2HE       LYS   8 -17.767   5.493  -3.636
   63   2HE   LYS   8          1HE       LYS   8 -17.612   6.082  -1.980
   64   1HZ   LYS   8          1HZ       LYS   8 -19.381   7.595  -2.310
   65   2HZ   LYS   8          2HZ       LYS   8 -19.917   6.093  -2.894
   66   3HZ   LYS   8          3HZ       LYS   8 -19.428   7.304  -3.980
   67    H    ILE   9           H        ILE   9 -11.591   6.409  -2.404
   68    HA   ILE   9           HA       ILE   9  -9.975   7.841  -4.250
   69    HB   ILE   9           HB       ILE   9  -9.136   6.237  -1.813
   70   1HG1  ILE   9          2HG1      ILE   9 -10.816   8.031  -1.389
   71   2HG1  ILE   9          1HG1      ILE   9  -9.254   8.389  -0.649
   72   1HG2  ILE   9          1HG2      ILE   9  -7.561   7.462  -3.818
   73   2HG2  ILE   9          2HG2      ILE   9  -7.017   6.859  -2.252
   74   3HG2  ILE   9          3HG2      ILE   9  -7.510   8.543  -2.426
   75   1HD1  ILE   9          1HD1      ILE   9  -9.093   9.438  -3.254
   76   2HD1  ILE   9          2HD1      ILE   9  -9.268  10.351  -1.755
   77   3HD1  ILE   9          3HD1      ILE   9 -10.699   9.880  -2.673
   78    H    PHE  10           H        PHE  10  -9.493   4.481  -3.070
   79    HA   PHE  10           HA       PHE  10  -7.504   3.802  -4.988
   80   1HB   PHE  10          2HB       PHE  10  -8.220   2.469  -2.914
   81   2HB   PHE  10          1HB       PHE  10  -9.540   1.847  -3.903
   82    HD1  PHE  10           HD1      PHE  10  -9.067   0.492  -5.932
   83    HD2  PHE  10           HD2      PHE  10  -5.937   1.777  -3.287
   84    HE1  PHE  10           HE1      PHE  10  -7.522  -1.163  -6.951
   85    HE2  PHE  10           HE2      PHE  10  -4.395   0.123  -4.308
   86    HZ   PHE  10           HZ       PHE  10  -5.193  -1.348  -6.142
   87    H    ILE  11           H        ILE  11 -11.047   3.536  -5.116
   88    HA   ILE  11           HA       ILE  11 -11.286   2.163  -7.561
   89    HB   ILE  11           HB       ILE  11 -13.061   3.300  -5.800
   90   1HG1  ILE  11          2HG1      ILE  11 -14.398   2.737  -8.291
   91   2HG1  ILE  11          1HG1      ILE  11 -13.085   1.585  -8.042
   92   1HG2  ILE  11          1HG2      ILE  11 -14.280   5.043  -6.755
   93   2HG2  ILE  11          2HG2      ILE  11 -13.697   4.693  -8.382
   94   3HG2  ILE  11          3HG2      ILE  11 -12.635   5.479  -7.216
   95   1HD1  ILE  11          1HD1      ILE  11 -14.319   0.502  -6.507
   96   2HD1  ILE  11          2HD1      ILE  11 -15.637   1.645  -6.762
   97   3HD1  ILE  11          3HD1      ILE  11 -14.410   1.972  -5.538
   98    H    MET  12           H        MET  12 -10.455   5.519  -6.920
   99    HA   MET  12           HA       MET  12 -10.286   5.955  -9.880
  100   1HB   MET  12          2HB       MET  12 -11.837   7.425  -8.443
  101   2HB   MET  12          1HB       MET  12 -10.357   8.150  -7.814
  102   1HG   MET  12          2HG       MET  12  -9.885   9.217  -9.778
  103   2HG   MET  12          1HG       MET  12 -10.497   7.889 -10.763
  104   1HE   MET  12          1HE       MET  12 -11.068   9.401 -12.233
  105   2HE   MET  12          2HE       MET  12 -12.188  10.756 -12.126
  106   3HE   MET  12          3HE       MET  12 -12.802   9.139 -12.461
  107    H    LYS  13           H        LYS  13  -8.265   5.104  -7.471
  108    HA   LYS  13           HA       LYS  13  -6.099   6.918  -8.458
  109   1HB   LYS  13          2HB       LYS  13  -6.870   6.551  -5.851
  110   2HB   LYS  13          1HB       LYS  13  -5.547   5.396  -6.000
  111   1HG   LYS  13          2HG       LYS  13  -4.156   7.148  -5.690
  112   2HG   LYS  13          1HG       LYS  13  -4.598   7.653  -7.322
  113   1HD   LYS  13          2HD       LYS  13  -6.163   8.430  -4.845
  114   2HD   LYS  13          1HD       LYS  13  -4.912   9.442  -5.570
  115   1HE   LYS  13          2HE       LYS  13  -6.191   9.941  -7.421
  116   2HE   LYS  13          1HE       LYS  13  -7.054   8.404  -7.371
  117   1HZ   LYS  13          1HZ       LYS  13  -8.701   9.562  -6.454
  118   2HZ   LYS  13          2HZ       LYS  13  -7.713  10.909  -6.144
  119   3HZ   LYS  13          3HZ       LYS  13  -7.758   9.615  -5.045
  120    H    CYS  14           H        CYS  14  -6.377   3.611  -7.050
  121    HA   CYS  14           HA       CYS  14  -4.517   2.732  -9.222
  122   1HB   CYS  14          2HB       CYS  14  -4.327   1.111  -6.791
  123   2HB   CYS  14          1HB       CYS  14  -3.041   1.826  -7.755
  124    H    SER  15           H        SER  15  -7.527   2.582  -8.852
  125    HA   SER  15           HA       SER  15  -7.973  -0.317  -8.523
  126   1HB   SER  15          2HB       SER  15  -9.633   1.293  -7.644
  127   2HB   SER  15          1HB       SER  15  -9.906   1.893  -9.277
  128    HG   SER  15           HG       SER  15 -11.402   0.238  -8.517
  129    H    GLN  16           H        GLN  16  -6.778   1.491 -10.961
  130    HA   GLN  16           HA       GLN  16  -8.244   0.067 -13.116
  131   1HB   GLN  16          2HB       GLN  16  -6.183   2.291 -13.277
  132   2HB   GLN  16          1HB       GLN  16  -7.115   1.642 -14.623
  133   1HG   GLN  16          2HG       GLN  16  -8.327   2.950 -12.173
  134   2HG   GLN  16          1HG       GLN  16  -8.083   3.760 -13.721
  135   1HE2  GLN  16          1HE2      GLN  16  -9.113   2.469 -15.669
  136   2HE2  GLN  16          2HE2      GLN  16 -10.639   1.784 -15.379
  137    H    CYS  17           H        CYS  17  -4.884   0.859 -12.177
  138    HA   CYS  17           HA       CYS  17  -3.853  -1.343 -13.807
  139   1HB   CYS  17          2HB       CYS  17  -2.601   0.704 -11.972
  140   2HB   CYS  17          1HB       CYS  17  -1.660  -0.648 -12.603
  141    H    HIS  18           H        HIS  18  -4.808  -0.810 -10.482
  142    HA   HIS  18           HA       HIS  18  -3.846  -3.576  -9.840
  143   1HB   HIS  18          2HB       HIS  18  -4.245  -1.238  -7.956
  144   2HB   HIS  18          1HB       HIS  18  -3.850  -2.878  -7.454
  145    HD1  HIS  18           HD1      HIS  18  -1.431  -3.608  -7.631
  146    HD2  HIS  18           HD2      HIS  18  -2.154   0.059  -9.454
  147    HE1  HIS  18           HE1      HIS  18   0.837  -2.638  -8.207
  148    H    THR  19           H        THR  19  -5.844  -4.520 -10.539
  149    HA   THR  19           HA       THR  19  -8.357  -3.580  -9.378
  150    HB   THR  19           HB       THR  19  -9.334  -5.569 -10.469
  151    HG1  THR  19           HG1      THR  19  -8.053  -7.209 -10.624
  152   1HG2  THR  19          1HG2      THR  19  -7.998  -5.064 -12.809
  153   2HG2  THR  19          2HG2      THR  19  -7.618  -3.623 -11.866
  154   3HG2  THR  19          3HG2      THR  19  -9.299  -4.062 -12.168
  155    H    VAL  20           H        VAL  20  -7.732  -3.684  -7.115
  156    HA   VAL  20           HA       VAL  20  -6.992  -6.251  -5.935
  157    HB   VAL  20           HB       VAL  20  -6.917  -5.059  -3.855
  158   1HG1  VAL  20          1HG1      VAL  20  -5.159  -4.490  -5.533
  159   2HG1  VAL  20          2HG1      VAL  20  -5.481  -3.173  -4.405
  160   3HG1  VAL  20          3HG1      VAL  20  -6.136  -3.112  -6.042
  161   1HG2  VAL  20          1HG2      VAL  20  -8.959  -3.413  -5.194
  162   2HG2  VAL  20          2HG2      VAL  20  -7.770  -2.469  -4.296
  163   3HG2  VAL  20          3HG2      VAL  20  -8.713  -3.712  -3.473
  164    H    GLU  21           H        GLU  21  -9.536  -6.302  -7.347
  165    HA   GLU  21           HA       GLU  21 -11.166  -7.468  -5.232
  166   1HB   GLU  21          2HB       GLU  21 -11.831  -4.815  -6.446
  167   2HB   GLU  21          1HB       GLU  21 -13.155  -5.938  -6.133
  168   1HG   GLU  21          2HG       GLU  21 -11.487  -5.993  -3.841
  169   2HG   GLU  21          1HG       GLU  21 -11.719  -4.295  -4.259
  170    H    LYS  22           H        LYS  22  -9.883  -7.982  -7.978
  171    HA   LYS  22           HA       LYS  22 -12.318  -8.745  -9.506
  172   1HB   LYS  22          2HB       LYS  22 -10.310  -7.484 -10.550
  173   2HB   LYS  22          1HB       LYS  22  -9.473  -9.035 -10.472
  174   1HG   LYS  22          2HG       LYS  22 -10.449  -9.034 -12.623
  175   2HG   LYS  22          1HG       LYS  22 -11.566  -9.997 -11.655
  176   1HD   LYS  22          2HD       LYS  22 -13.117  -8.574 -12.559
  177   2HD   LYS  22          1HD       LYS  22 -12.605  -7.536 -11.229
  178   1HE   LYS  22          2HE       LYS  22 -10.803  -7.269 -13.484
  179   2HE   LYS  22          1HE       LYS  22 -12.467  -6.941 -13.971
  180   1HZ   LYS  22          1HZ       LYS  22 -12.467  -5.043 -12.850
  181   2HZ   LYS  22          2HZ       LYS  22 -10.789  -5.227 -12.654
  182   3HZ   LYS  22          3HZ       LYS  22 -11.853  -5.772 -11.446
  183    H    GLY  23           H        GLY  23  -9.116 -10.317  -9.171
  184   1HA   GLY  23          2HA       GLY  23  -9.833 -12.545  -7.657
  185   2HA   GLY  23          1HA       GLY  23 -10.317 -12.951  -9.303
  186    H    GLY  24           H        GLY  24  -7.471 -11.309  -7.852
  187   1HA   GLY  24          1HA       GLY  24  -5.182 -11.767  -8.110
  188   2HA   GLY  24          2HA       GLY  24  -5.643 -13.407  -8.563
  189    H    LYS  25           H        LYS  25  -7.086 -10.873 -10.399
  190    HA   LYS  25           HA       LYS  25  -5.391 -11.650 -12.720
  191   1HB   LYS  25          2HB       LYS  25  -8.033 -11.621 -12.642
  192   2HB   LYS  25          1HB       LYS  25  -7.816  -9.896 -12.938
  193   1HG   LYS  25          2HG       LYS  25  -6.229 -10.632 -14.850
  194   2HG   LYS  25          1HG       LYS  25  -6.983 -12.217 -14.673
  195   1HD   LYS  25          2HD       LYS  25  -8.665  -9.732 -14.963
  196   2HD   LYS  25          1HD       LYS  25  -8.025 -10.564 -16.382
  197   1HE   LYS  25          2HE       LYS  25  -9.045 -12.700 -15.435
  198   2HE   LYS  25          1HE       LYS  25  -9.886 -11.676 -14.270
  199   1HZ   LYS  25          1HZ       LYS  25 -11.420 -11.382 -15.824
  200   2HZ   LYS  25          2HZ       LYS  25 -10.474 -12.141 -17.015
  201   3HZ   LYS  25          3HZ       LYS  25 -10.287 -10.479 -16.707
  202    H    HIS  26           H        HIS  26  -3.970 -10.184 -13.606
  203    HA   HIS  26           HA       HIS  26  -4.242  -7.345 -12.727
  204   1HB   HIS  26          2HB       HIS  26  -1.576  -7.498 -13.118
  205   2HB   HIS  26          1HB       HIS  26  -2.332  -7.747 -11.554
  206    HD1  HIS  26           HD1      HIS  26  -2.281 -10.226 -14.433
  207    HD2  HIS  26           HD2      HIS  26  -0.681  -9.804 -10.602
  208    HE1  HIS  26           HE1      HIS  26  -1.156 -12.425 -13.879
  209    H    LYS  27           H        LYS  27  -5.030  -6.476 -14.599
  210    HA   LYS  27           HA       LYS  27  -4.146  -7.267 -17.227
  211   1HB   LYS  27          2HB       LYS  27  -5.745  -4.949 -16.146
  212   2HB   LYS  27          1HB       LYS  27  -5.252  -4.990 -17.839
  213   1HG   LYS  27          2HG       LYS  27  -6.323  -7.559 -17.067
  214   2HG   LYS  27          1HG       LYS  27  -7.481  -6.283 -16.685
  215   1HD   LYS  27          2HD       LYS  27  -6.952  -5.390 -19.068
  216   2HD   LYS  27          1HD       LYS  27  -6.285  -6.997 -19.357
  217   1HE   LYS  27          2HE       LYS  27  -8.688  -7.587 -18.152
  218   2HE   LYS  27          1HE       LYS  27  -9.092  -6.154 -19.099
  219   1HZ   LYS  27          1HZ       LYS  27  -7.489  -8.256 -20.362
  220   2HZ   LYS  27          2HZ       LYS  27  -8.617  -7.190 -21.054
  221   3HZ   LYS  27          3HZ       LYS  27  -9.151  -8.531 -20.157
  222    H    THR  28           H        THR  28  -3.720  -4.157 -15.515
  223    HA   THR  28           HA       THR  28  -1.152  -3.801 -16.995
  224    HB   THR  28           HB       THR  28  -2.983  -1.831 -15.594
  225    HG1  THR  28           HG1      THR  28  -3.029  -0.978 -17.740
  226   1HG2  THR  28          1HG2      THR  28  -0.184  -1.523 -16.677
  227   2HG2  THR  28          2HG2      THR  28  -0.818  -1.014 -15.112
  228   3HG2  THR  28          3HG2      THR  28  -1.289  -0.151 -16.577
  229    H    GLY  29           H        GLY  29  -2.273  -2.507 -13.870
  230   1HA   GLY  29          2HA       GLY  29   0.322  -2.906 -12.652
  231   2HA   GLY  29          1HA       GLY  29  -1.141  -2.409 -11.811
  232    HA   PRO  30           HA       PRO  30  -0.083  -7.022 -11.178
  233   1HB   PRO  30          2HB       PRO  30   1.121  -6.808  -8.710
  234   2HB   PRO  30          1HB       PRO  30   2.006  -6.847 -10.246
  235   1HG   PRO  30          2HG       PRO  30   1.363  -4.490  -8.502
  236   2HG   PRO  30          1HG       PRO  30   2.800  -4.793  -9.497
  237   1HD   PRO  30          2HD       PRO  30   0.742  -3.106 -10.267
  238   2HD   PRO  30          1HD       PRO  30   1.824  -3.937 -11.400
  239    H    ASN  31           H        ASN  31  -1.541  -8.264  -9.996
  240    HA   ASN  31           HA       ASN  31  -3.842  -7.053  -8.869
  241   1HB   ASN  31          2HB       ASN  31  -4.030  -9.297  -9.654
  242   2HB   ASN  31          1HB       ASN  31  -2.694  -9.841  -8.639
  243   1HD2  ASN  31          1HD2      ASN  31  -5.798  -8.058  -8.089
  244   2HD2  ASN  31          2HD2      ASN  31  -6.253  -8.982  -6.740
  245    H    LEU  32           H        LEU  32  -3.422  -5.610  -7.199
  246    HA   LEU  32           HA       LEU  32  -1.682  -6.342  -4.982
  247   1HB   LEU  32          2HB       LEU  32  -3.060  -3.938  -5.935
  248   2HB   LEU  32          1HB       LEU  32  -3.089  -4.099  -4.180
  249    HG   LEU  32           HG       LEU  32  -0.749  -4.042  -4.008
  250   1HD1  LEU  32          1HD1      LEU  32   0.251  -5.540  -5.408
  251   2HD1  LEU  32          2HD1      LEU  32   0.475  -4.131  -6.444
  252   3HD1  LEU  32          3HD1      LEU  32  -0.886  -5.220  -6.718
  253   1HD2  LEU  32          1HD2      LEU  32  -0.957  -1.842  -4.558
  254   2HD2  LEU  32          2HD2      LEU  32  -1.916  -2.198  -5.995
  255   3HD2  LEU  32          3HD2      LEU  32  -0.159  -2.317  -6.056
  256    H    HIS  33           H        HIS  33  -3.033  -8.342  -4.518
  257    HA   HIS  33           HA       HIS  33  -5.567  -7.740  -3.080
  258   1HB   HIS  33          2HB       HIS  33  -5.660  -9.593  -4.670
  259   2HB   HIS  33          1HB       HIS  33  -4.283 -10.368  -3.888
  260    HD1  HIS  33           HD1      HIS  33  -4.706 -10.997  -1.253
  261    HD2  HIS  33           HD2      HIS  33  -8.101 -10.318  -3.576
  262    HE1  HIS  33           HE1      HIS  33  -6.656 -11.994   0.021
  263    H    GLY  34           H        GLY  34  -2.736  -9.861  -2.503
  264   1HA   GLY  34          2HA       GLY  34  -3.006  -9.219   0.404
  265   2HA   GLY  34          1HA       GLY  34  -2.297 -10.710  -0.222
  266    H    LEU  35           H        LEU  35  -1.618  -7.619  -1.702
  267    HA   LEU  35           HA       LEU  35   1.161  -7.877  -1.744
  268   1HB   LEU  35          2HB       LEU  35  -0.145  -6.122  -2.950
  269   2HB   LEU  35          1HB       LEU  35  -0.351  -5.270  -1.418
  270    HG   LEU  35           HG       LEU  35   2.120  -5.141  -1.183
  271   1HD1  LEU  35          1HD1      LEU  35   3.292  -5.594  -3.516
  272   2HD1  LEU  35          2HD1      LEU  35   1.943  -6.709  -3.732
  273   3HD1  LEU  35          3HD1      LEU  35   3.045  -6.911  -2.370
  274   1HD2  LEU  35          1HD2      LEU  35   0.509  -3.544  -2.657
  275   2HD2  LEU  35          2HD2      LEU  35   1.643  -4.050  -3.910
  276   3HD2  LEU  35          3HD2      LEU  35   2.236  -3.237  -2.461
  277    H    PHE  36           H        PHE  36  -0.889  -6.928   0.926
  278    HA   PHE  36           HA       PHE  36   1.220  -5.750   2.524
  279   1HB   PHE  36          2HB       PHE  36  -1.566  -6.745   3.096
  280   2HB   PHE  36          1HB       PHE  36  -0.493  -6.270   4.413
  281    HD1  PHE  36           HD1      PHE  36  -0.616  -4.060   5.122
  282    HD2  PHE  36           HD2      PHE  36  -1.510  -4.997   1.026
  283    HE1  PHE  36           HE1      PHE  36  -1.136  -1.674   4.690
  284    HE2  PHE  36           HE2      PHE  36  -2.031  -2.610   0.594
  285    HZ   PHE  36           HZ       PHE  36  -1.843  -0.949   2.426
  286    H    GLY  37           H        GLY  37   2.715  -6.777   3.773
  287   1HA   GLY  37          2HA       GLY  37   3.764  -8.491   5.000
  288   2HA   GLY  37          1HA       GLY  37   2.246  -9.388   4.948
  289    H    ARG  38           H        ARG  38   3.355  -8.329   1.884
  290    HA   ARG  38           HA       ARG  38   4.675 -10.959   1.387
  291   1HB   ARG  38          2HB       ARG  38   2.143 -10.612   0.608
  292   2HB   ARG  38          1HB       ARG  38   2.933  -9.810  -0.750
  293   1HG   ARG  38          2HG       ARG  38   4.407 -11.871  -0.962
  294   2HG   ARG  38          1HG       ARG  38   3.333 -12.659   0.196
  295   1HD   ARG  38          2HD       ARG  38   2.864 -12.925  -2.372
  296   2HD   ARG  38          1HD       ARG  38   1.514 -12.634  -1.273
  297    HE   ARG  38           HE       ARG  38   1.172 -10.609  -2.408
  298   1HH1  ARG  38          1HH2      ARG  38   4.345 -11.824  -2.950
  299   2HH1  ARG  38          2HH2      ARG  38   4.873 -10.429  -3.830
  300   1HH2  ARG  38          1HH1      ARG  38   1.888  -8.715  -3.432
  301   2HH2  ARG  38          2HH1      ARG  38   3.483  -8.671  -4.105
  302    H    LYS  39           H        LYS  39   6.601 -10.686   0.382
  303    HA   LYS  39           HA       LYS  39   7.624  -8.113  -0.312
  304   1HB   LYS  39          2HB       LYS  39   8.499 -10.941  -0.680
  305   2HB   LYS  39          1HB       LYS  39   9.266  -9.723  -1.701
  306   1HG   LYS  39          2HG       LYS  39  10.331  -8.721   0.061
  307   2HG   LYS  39          1HG       LYS  39   8.999  -9.034   1.175
  308   1HD   LYS  39          2HD       LYS  39  10.446 -10.589   2.026
  309   2HD   LYS  39          1HD       LYS  39   9.818 -11.574   0.704
  310   1HE   LYS  39          2HE       LYS  39  11.676 -10.953  -0.723
  311   2HE   LYS  39          1HE       LYS  39  12.262  -9.798   0.474
  312   1HZ   LYS  39          1HZ       LYS  39  11.901 -12.446   1.523
  313   2HZ   LYS  39          2HZ       LYS  39  13.236 -11.403   1.647
  314   3HZ   LYS  39          3HZ       LYS  39  13.045 -12.381   0.271
  315    H    THR  40           H        THR  40   8.765  -8.306  -2.820
  316    HA   THR  40           HA       THR  40   6.354  -8.092  -4.547
  317    HB   THR  40           HB       THR  40   7.412  -6.374  -5.568
  318    HG1  THR  40           HG1      THR  40   9.206  -6.716  -6.687
  319   1HG2  THR  40          1HG2      THR  40   8.173  -6.142  -3.124
  320   2HG2  THR  40          2HG2      THR  40   9.091  -5.242  -4.332
  321   3HG2  THR  40          3HG2      THR  40   9.735  -6.747  -3.677
  322    H    GLY  41           H        GLY  41   7.062  -8.647  -7.007
  323   1HA   GLY  41          2HA       GLY  41   7.440 -10.404  -8.510
  324   2HA   GLY  41          1HA       GLY  41   8.874 -10.743  -7.545
  325    H    GLN  42           H        GLN  42   5.596 -11.710  -8.216
  326    HA   GLN  42           HA       GLN  42   6.071 -14.246  -6.851
  327   1HB   GLN  42          2HB       GLN  42   4.435 -14.118  -5.161
  328   2HB   GLN  42          1HB       GLN  42   5.260 -12.566  -5.062
  329   1HG   GLN  42          2HG       GLN  42   2.688 -13.058  -6.590
  330   2HG   GLN  42          1HG       GLN  42   2.780 -12.331  -4.987
  331   1HE2  GLN  42          1HE2      GLN  42   5.276 -10.809  -5.605
  332   2HE2  GLN  42          2HE2      GLN  42   4.805  -9.555  -6.644
  333    H    ALA  43           H        ALA  43   3.839 -12.135  -8.620
  334    HA   ALA  43           HA       ALA  43   1.928 -14.166  -9.278
  335   1HB   ALA  43          1HB       ALA  43   2.431 -12.006 -11.257
  336   2HB   ALA  43          2HB       ALA  43   1.991 -11.488  -9.630
  337   3HB   ALA  43          3HB       ALA  43   0.912 -12.544 -10.542
  338    HA   PRO  44           HA       PRO  44   4.328 -16.386 -12.265
  339   1HB   PRO  44          2HB       PRO  44   2.273 -17.949 -13.209
  340   2HB   PRO  44          1HB       PRO  44   3.088 -18.235 -11.661
  341   1HG   PRO  44          2HG       PRO  44   0.381 -17.101 -12.173
  342   2HG   PRO  44          1HG       PRO  44   0.989 -17.950 -10.743
  343   1HD   PRO  44          2HD       PRO  44   0.654 -15.144 -11.003
  344   2HD   PRO  44          1HD       PRO  44   1.527 -15.983  -9.703
  345    H    GLY  45           H        GLY  45   1.246 -14.853 -13.167
  346   1HA   GLY  45          1HA       GLY  45   2.149 -14.753 -16.005
  347   2HA   GLY  45          2HA       GLY  45   0.497 -14.473 -15.457
  348    H    TYR  46           H        TYR  46   3.620 -13.088 -14.402
  349    HA   TYR  46           HA       TYR  46   2.933 -10.455 -15.493
  350   1HB   TYR  46          2HB       TYR  46   1.682 -10.805 -13.215
  351   2HB   TYR  46          1HB       TYR  46   3.282 -10.611 -12.506
  352    HD1  TYR  46           HD1      TYR  46   0.492  -8.838 -12.784
  353    HD2  TYR  46           HD2      TYR  46   4.532  -8.524 -14.169
  354    HE1  TYR  46           HE1      TYR  46   0.244  -6.384 -12.946
  355    HE2  TYR  46           HE2      TYR  46   4.288  -6.072 -14.335
  356    HH   TYR  46           HH       TYR  46   1.387  -4.434 -13.177
  357    H    SER  47           H        SER  47   4.860  -9.507 -16.016
  358    HA   SER  47           HA       SER  47   7.349 -10.668 -14.929
  359   1HB   SER  47          2HB       SER  47   6.605  -8.933 -17.223
  360   2HB   SER  47          1HB       SER  47   8.165  -8.584 -16.484
  361    HG   SER  47           HG       SER  47   7.288 -10.821 -17.879
  362    H    TYR  48           H        TYR  48   6.040  -9.630 -12.860
  363    HA   TYR  48           HA       TYR  48   5.860  -7.084 -12.050
  364   1HB   TYR  48          2HB       TYR  48   7.048  -9.467 -10.695
  365   2HB   TYR  48          1HB       TYR  48   7.213  -7.904  -9.903
  366    HD1  TYR  48           HD1      TYR  48   4.385  -9.187 -12.006
  367    HD2  TYR  48           HD2      TYR  48   5.703  -7.991  -8.110
  368    HE1  TYR  48           HE1      TYR  48   2.055  -9.364 -11.151
  369    HE2  TYR  48           HE2      TYR  48   3.391  -8.175  -7.257
  370    HH   TYR  48           HH       TYR  48   0.685  -8.766  -9.417
  371    H    THR  49           H        THR  49   7.240  -5.377 -11.364
  372    HA   THR  49           HA       THR  49   9.602  -4.965 -12.879
  373    HB   THR  49           HB       THR  49  10.031  -3.231 -10.912
  374    HG1  THR  49           HG1      THR  49   7.849  -2.773 -10.052
  375   1HG2  THR  49          1HG2      THR  49   9.413  -2.270 -12.926
  376   2HG2  THR  49          2HG2      THR  49   7.983  -1.908 -11.958
  377   3HG2  THR  49          3HG2      THR  49   7.968  -3.270 -13.079
  378    H    ALA  50           H        ALA  50  10.945  -6.787 -12.618
  379    HA   ALA  50           HA       ALA  50  11.779  -8.198 -10.439
  380   1HB   ALA  50          1HB       ALA  50  14.200  -7.497 -11.727
  381   2HB   ALA  50          2HB       ALA  50  12.951  -7.479 -12.972
  382   3HB   ALA  50          3HB       ALA  50  13.217  -8.934 -12.009
  383    H    ALA  51           H        ALA  51  12.674  -4.875 -11.185
  384    HA   ALA  51           HA       ALA  51  14.723  -4.508  -9.279
  385   1HB   ALA  51          1HB       ALA  51  14.140  -2.813 -10.962
  386   2HB   ALA  51          2HB       ALA  51  14.107  -2.117  -9.344
  387   3HB   ALA  51          3HB       ALA  51  12.598  -2.535 -10.156
  388    H    ASN  52           H        ASN  52  11.286  -3.509  -8.787
  389    HA   ASN  52           HA       ASN  52  11.234  -2.918  -6.132
  390   1HB   ASN  52          2HB       ASN  52   9.263  -4.806  -7.464
  391   2HB   ASN  52          1HB       ASN  52   8.969  -3.884  -5.995
  392   1HD2  ASN  52          1HD2      ASN  52   7.604  -2.161  -6.503
  393   2HD2  ASN  52          2HD2      ASN  52   7.743  -1.187  -7.884
  394    H    LYS  53           H        LYS  53  11.426  -6.224  -7.433
  395    HA   LYS  53           HA       LYS  53  11.298  -7.517  -4.870
  396   1HB   LYS  53          2HB       LYS  53  10.829  -8.659  -7.039
  397   2HB   LYS  53          1HB       LYS  53  12.544  -8.543  -7.433
  398   1HG   LYS  53          2HG       LYS  53  12.683  -9.640  -4.947
  399   2HG   LYS  53          1HG       LYS  53  11.166 -10.332  -5.521
  400   1HD   LYS  53          2HD       LYS  53  12.992 -11.815  -6.148
  401   2HD   LYS  53          1HD       LYS  53  12.340 -11.064  -7.606
  402   1HE   LYS  53          2HE       LYS  53  14.319  -9.295  -6.647
  403   2HE   LYS  53          1HE       LYS  53  15.019 -10.909  -6.532
  404   1HZ   LYS  53          1HZ       LYS  53  14.631  -9.353  -8.822
  405   2HZ   LYS  53          2HZ       LYS  53  13.625 -10.715  -8.952
  406   3HZ   LYS  53          3HZ       LYS  53  15.296 -10.910  -8.713
  407    H    ASN  54           H        ASN  54  14.037  -6.667  -6.999
  408    HA   ASN  54           HA       ASN  54  16.056  -7.698  -5.271
  409   1HB   ASN  54          2HB       ASN  54  15.972  -6.436  -7.783
  410   2HB   ASN  54          1HB       ASN  54  16.970  -5.394  -6.769
  411   1HD2  ASN  54          1HD2      ASN  54  18.152  -6.890  -8.891
  412   2HD2  ASN  54          2HD2      ASN  54  19.146  -8.093  -8.222
  413    H    LYS  55           H        LYS  55  14.093  -4.884  -5.043
  414    HA   LYS  55           HA       LYS  55  15.894  -3.200  -3.586
  415   1HB   LYS  55          2HB       LYS  55  13.577  -2.651  -4.650
  416   2HB   LYS  55          1HB       LYS  55  12.923  -3.218  -3.114
  417   1HG   LYS  55          2HG       LYS  55  13.222  -0.993  -2.584
  418   2HG   LYS  55          1HG       LYS  55  14.816  -1.606  -2.139
  419   1HD   LYS  55          2HD       LYS  55  15.084  -1.121  -4.849
  420   2HD   LYS  55          1HD       LYS  55  14.061   0.211  -4.312
  421   1HE   LYS  55          2HE       LYS  55  15.713   0.613  -2.444
  422   2HE   LYS  55          1HE       LYS  55  16.772  -0.570  -3.212
  423   1HZ   LYS  55          1HZ       LYS  55  15.792   1.978  -4.373
  424   2HZ   LYS  55          2HZ       LYS  55  16.628   0.794  -5.260
  425   3HZ   LYS  55          3HZ       LYS  55  17.390   1.586  -3.965
  426    H    GLY  56           H        GLY  56  14.573  -6.185  -2.757
  427   1HA   GLY  56          1HA       GLY  56  14.309  -7.308  -0.706
  428   2HA   GLY  56          2HA       GLY  56  15.690  -6.334  -0.197
  429    H    ILE  57           H        ILE  57  12.337  -5.460  -1.051
  430    HA   ILE  57           HA       ILE  57  12.154  -4.096   1.608
  431    HB   ILE  57           HB       ILE  57  12.155  -2.564  -0.346
  432   1HG1  ILE  57          2HG1      ILE  57  10.718  -2.262   1.816
  433   2HG1  ILE  57          1HG1      ILE  57  10.403  -1.214   0.435
  434   1HG2  ILE  57          1HG2      ILE  57   9.947  -4.403  -1.186
  435   2HG2  ILE  57          2HG2      ILE  57  11.233  -3.682  -2.152
  436   3HG2  ILE  57          3HG2      ILE  57   9.853  -2.705  -1.649
  437   1HD1  ILE  57          1HD1      ILE  57   8.860  -3.665   0.228
  438   2HD1  ILE  57          2HD1      ILE  57   8.302  -1.994   0.235
  439   3HD1  ILE  57          3HD1      ILE  57   8.542  -2.850   1.757
  440    H    ILE  58           H        ILE  58  10.256  -4.381   2.809
  441    HA   ILE  58           HA       ILE  58   8.522  -6.636   1.912
  442    HB   ILE  58           HB       ILE  58   9.431  -7.052   4.091
  443   1HG1  ILE  58          2HG1      ILE  58   7.464  -7.179   5.463
  444   2HG1  ILE  58          1HG1      ILE  58   6.723  -5.808   4.638
  445   1HG2  ILE  58          1HG2      ILE  58  10.309  -5.104   4.950
  446   2HG2  ILE  58          2HG2      ILE  58   8.803  -5.138   5.865
  447   3HG2  ILE  58          3HG2      ILE  58   8.936  -4.129   4.425
  448   1HD1  ILE  58          1HD1      ILE  58   6.116  -7.058   2.808
  449   2HD1  ILE  58          2HD1      ILE  58   6.115  -8.348   4.011
  450   3HD1  ILE  58          3HD1      ILE  58   7.507  -8.132   2.949
  451    H    TRP  59           H        TRP  59   7.052  -5.556   0.575
  452    HA   TRP  59           HA       TRP  59   5.973  -3.052   0.733
  453   1HB   TRP  59          2HB       TRP  59   4.585  -5.645   0.054
  454   2HB   TRP  59          1HB       TRP  59   3.821  -4.070  -0.164
  455    HD1  TRP  59           HD1      TRP  59   5.306  -6.378  -2.282
  456    HE1  TRP  59           HE1      TRP  59   6.694  -5.324  -4.181
  457    HE3  TRP  59           HE3      TRP  59   5.906  -1.652  -0.431
  458    HZ2  TRP  59           HZ2      TRP  59   7.909  -2.821  -4.818
  459    HZ3  TRP  59           HZ3      TRP  59   7.184   0.041  -1.706
  460    HH2  TRP  59           HH2      TRP  59   8.180  -0.536  -3.898
  461    H    GLY  60           H        GLY  60   5.701  -2.210   2.774
  462   1HA   GLY  60          1HA       GLY  60   3.457  -3.392   4.366
  463   2HA   GLY  60          2HA       GLY  60   4.875  -2.675   5.134
  464    H    GLU  61           H        GLU  61   3.495  -1.106   6.187
  465    HA   GLU  61           HA       GLU  61   1.834   0.701   4.624
  466   1HB   GLU  61          2HB       GLU  61   2.271   0.126   7.394
  467   2HB   GLU  61          1HB       GLU  61   2.522   1.854   7.146
  468   1HG   GLU  61          2HG       GLU  61   0.344   2.180   6.323
  469   2HG   GLU  61          1HG       GLU  61   0.132   0.470   5.943
  470    H    ASP  62           H        ASP  62   4.591   1.538   6.743
  471    HA   ASP  62           HA       ASP  62   5.128   3.996   5.408
  472   1HB   ASP  62          2HB       ASP  62   6.157   2.560   7.640
  473   2HB   ASP  62          1HB       ASP  62   7.523   2.983   6.607
  474    H    THR  63           H        THR  63   6.462   0.736   4.952
  475    HA   THR  63           HA       THR  63   8.597   1.437   3.220
  476    HB   THR  63           HB       THR  63   7.677  -0.997   2.245
  477    HG1  THR  63           HG1      THR  63   7.361  -1.870   4.588
  478   1HG2  THR  63          1HG2      THR  63   9.439  -0.471   4.654
  479   2HG2  THR  63          2HG2      THR  63   9.970  -0.429   2.973
  480   3HG2  THR  63          3HG2      THR  63   9.425  -1.946   3.689
  481    H    LEU  64           H        LEU  64   5.234   0.526   2.426
  482    HA   LEU  64           HA       LEU  64   5.549   0.948  -0.405
  483   1HB   LEU  64          2HB       LEU  64   3.591  -0.118   1.190
  484   2HB   LEU  64          1HB       LEU  64   2.866   1.420   0.723
  485    HG   LEU  64           HG       LEU  64   4.065  -0.576  -1.215
  486   1HD1  LEU  64          1HD1      LEU  64   1.145   0.061  -1.042
  487   2HD1  LEU  64          2HD1      LEU  64   1.830  -1.072   0.123
  488   3HD1  LEU  64          3HD1      LEU  64   1.937  -1.411  -1.604
  489   1HD2  LEU  64          1HD2      LEU  64   2.559   0.948  -2.755
  490   2HD2  LEU  64          2HD2      LEU  64   4.175   1.487  -2.301
  491   3HD2  LEU  64          3HD2      LEU  64   2.763   2.121  -1.455
  492    H    MET  65           H        MET  65   4.720   3.046   2.295
  493    HA   MET  65           HA       MET  65   3.663   5.250   0.873
  494   1HB   MET  65          2HB       MET  65   3.653   5.128   3.330
  495   2HB   MET  65          1HB       MET  65   5.411   5.260   3.353
  496   1HG   MET  65          2HG       MET  65   4.510   7.405   1.764
  497   2HG   MET  65          1HG       MET  65   3.438   7.365   3.163
  498   1HE   MET  65          1HE       MET  65   5.124   7.828   6.126
  499   2HE   MET  65          2HE       MET  65   3.694   7.785   5.099
  500   3HE   MET  65          3HE       MET  65   4.584   9.293   5.294
  501    H    GLU  66           H        GLU  66   6.984   4.170   1.307
  502    HA   GLU  66           HA       GLU  66   8.138   6.597   0.214
  503   1HB   GLU  66          2HB       GLU  66   9.287   4.940   1.794
  504   2HB   GLU  66          1HB       GLU  66   9.496   3.906   0.380
  505   1HG   GLU  66          2HG       GLU  66  10.881   5.474  -0.711
  506   2HG   GLU  66          1HG       GLU  66  10.354   6.795   0.331
  507    H    TYR  67           H        TYR  67   7.863   3.242  -1.024
  508    HA   TYR  67           HA       TYR  67   8.808   3.801  -3.641
  509   1HB   TYR  67          2HB       TYR  67   8.571   1.508  -2.955
  510   2HB   TYR  67          1HB       TYR  67   6.851   1.720  -2.631
  511    HD1  TYR  67           HD1      TYR  67   5.923   0.130  -4.156
  512    HD2  TYR  67           HD2      TYR  67   8.721   3.072  -5.551
  513    HE1  TYR  67           HE1      TYR  67   5.391  -0.477  -6.499
  514    HE2  TYR  67           HE2      TYR  67   8.186   2.467  -7.895
  515    HH   TYR  67           HH       TYR  67   7.271   0.325  -9.074
  516    H    LEU  68           H        LEU  68   5.810   4.637  -2.131
  517    HA   LEU  68           HA       LEU  68   4.492   5.094  -4.743
  518   1HB   LEU  68          2HB       LEU  68   3.530   4.423  -2.205
  519   2HB   LEU  68          1HB       LEU  68   3.047   6.105  -2.434
  520    HG   LEU  68           HG       LEU  68   2.252   5.379  -4.771
  521   1HD1  LEU  68          1HD1      LEU  68   1.910   3.079  -5.193
  522   2HD1  LEU  68          2HD1      LEU  68   2.139   2.644  -3.500
  523   3HD1  LEU  68          3HD1      LEU  68   3.521   3.134  -4.478
  524   1HD2  LEU  68          1HD2      LEU  68   0.871   4.254  -2.311
  525   2HD2  LEU  68          2HD2      LEU  68   0.099   4.588  -3.861
  526   3HD2  LEU  68          3HD2      LEU  68   0.734   5.915  -2.889
  527    H    GLU  69           H        GLU  69   5.890   6.919  -2.055
  528    HA   GLU  69           HA       GLU  69   4.985   9.505  -2.809
  529   1HB   GLU  69          2HB       GLU  69   6.425   8.639  -0.761
  530   2HB   GLU  69          1HB       GLU  69   7.775   9.066  -1.803
  531   1HG   GLU  69          2HG       GLU  69   6.792  11.350  -2.074
  532   2HG   GLU  69          1HG       GLU  69   5.541  10.911  -0.909
  533    H    ASN  70           H        ASN  70   7.304   7.321  -4.105
  534    HA   ASN  70           HA       ASN  70   7.572   8.789  -6.570
  535   1HB   ASN  70          2HB       ASN  70   9.110  10.014  -4.857
  536   2HB   ASN  70          1HB       ASN  70  10.146   8.597  -5.013
  537   1HD2  ASN  70          1HD2      ASN  70  10.365  11.532  -6.050
  538   2HD2  ASN  70          2HD2      ASN  70  10.756  11.336  -7.689
  539    HA   PRO  71           HA       PRO  71   8.352   4.331  -6.856
  540   1HB   PRO  71          2HB       PRO  71   7.090   4.078  -9.293
  541   2HB   PRO  71          1HB       PRO  71   6.254   3.991  -7.734
  542   1HG   PRO  71          2HG       PRO  71   6.275   6.206  -9.727
  543   2HG   PRO  71          1HG       PRO  71   5.049   5.796  -8.517
  544   1HD   PRO  71          2HD       PRO  71   6.951   7.881  -8.295
  545   2HD   PRO  71          1HD       PRO  71   5.954   7.234  -6.974
  546    H    LYS  72           H        LYS  72   8.721   6.754  -9.440
  547    HA   LYS  72           HA       LYS  72  10.682   5.251 -10.915
  548   1HB   LYS  72          2HB       LYS  72   9.268   7.267 -11.711
  549   2HB   LYS  72          1HB       LYS  72  10.484   8.261 -10.908
  550   1HG   LYS  72          2HG       LYS  72  11.819   8.048 -12.703
  551   2HG   LYS  72          1HG       LYS  72  11.877   6.307 -12.432
  552   1HD   LYS  72          2HD       LYS  72   9.346   6.868 -13.585
  553   2HD   LYS  72          1HD       LYS  72  10.544   7.746 -14.536
  554   1HE   LYS  72          2HE       LYS  72  11.031   4.879 -13.759
  555   2HE   LYS  72          1HE       LYS  72  10.029   5.263 -15.159
  556   1HZ   LYS  72          1HZ       LYS  72  12.145   6.875 -15.521
  557   2HZ   LYS  72          2HZ       LYS  72  11.975   5.340 -16.229
  558   3HZ   LYS  72          3HZ       LYS  72  12.883   5.527 -14.805
  559    H    LYS  73           H        LYS  73  10.789   6.752  -7.910
  560    HA   LYS  73           HA       LYS  73  13.712   7.298  -8.091
  561   1HB   LYS  73          2HB       LYS  73  12.575   9.168  -7.155
  562   2HB   LYS  73          1HB       LYS  73  11.555   8.140  -6.149
  563   1HG   LYS  73          2HG       LYS  73  13.089   8.089  -4.497
  564   2HG   LYS  73          1HG       LYS  73  14.383   7.681  -5.626
  565   1HD   LYS  73          2HD       LYS  73  14.053  10.249  -6.319
  566   2HD   LYS  73          1HD       LYS  73  13.494  10.354  -4.648
  567   1HE   LYS  73          2HE       LYS  73  15.808   8.763  -4.552
  568   2HE   LYS  73          1HE       LYS  73  16.200  10.086  -5.651
  569   1HZ   LYS  73          1HZ       LYS  73  15.610  11.671  -4.016
  570   2HZ   LYS  73          2HZ       LYS  73  16.624  10.543  -3.251
  571   3HZ   LYS  73          3HZ       LYS  73  14.945  10.491  -2.996
  572    H    TYR  74           H        TYR  74  11.284   5.355  -6.404
  573    HA   TYR  74           HA       TYR  74  13.210   4.142  -4.581
  574   1HB   TYR  74          2HB       TYR  74  10.615   4.355  -4.326
  575   2HB   TYR  74          1HB       TYR  74  10.565   2.913  -5.338
  576    HD1  TYR  74           HD1      TYR  74  10.190   1.010  -4.048
  577    HD2  TYR  74           HD2      TYR  74  12.839   4.053  -2.572
  578    HE1  TYR  74           HE1      TYR  74  10.702  -0.398  -2.071
  579    HE2  TYR  74           HE2      TYR  74  13.351   2.644  -0.594
  580    HH   TYR  74           HH       TYR  74  13.272   0.383   0.119
  581    H    ILE  75           H        ILE  75  11.178   2.587  -7.068
  582    HA   ILE  75           HA       ILE  75  13.226   0.549  -7.493
  583    HB   ILE  75           HB       ILE  75  10.779   0.777  -9.195
  584   1HG1  ILE  75          2HG1      ILE  75   9.922   1.353  -6.962
  585   2HG1  ILE  75          1HG1      ILE  75   9.437  -0.282  -7.385
  586   1HG2  ILE  75          1HG2      ILE  75  12.759  -1.119  -8.611
  587   2HG2  ILE  75          2HG2      ILE  75  11.293  -1.372  -9.560
  588   3HG2  ILE  75          3HG2      ILE  75  11.295  -1.708  -7.829
  589   1HD1  ILE  75          1HD1      ILE  75  11.589  -1.033  -6.169
  590   2HD1  ILE  75          2HD1      ILE  75  10.238  -0.491  -5.174
  591   3HD1  ILE  75          3HD1      ILE  75  11.599   0.589  -5.476
  592    HA   PRO  76           HA       PRO  76  14.814   3.143 -10.785
  593   1HB   PRO  76          2HB       PRO  76  17.037   1.590 -11.250
  594   2HB   PRO  76          1HB       PRO  76  16.925   2.781  -9.944
  595   1HG   PRO  76          2HG       PRO  76  16.794  -0.195  -9.787
  596   2HG   PRO  76          1HG       PRO  76  17.309   0.972  -8.557
  597   1HD   PRO  76          2HD       PRO  76  14.802  -0.335  -8.649
  598   2HD   PRO  76          1HD       PRO  76  15.209   1.071  -7.641
  599    H    GLY  77           H        GLY  77  12.935   2.376 -12.134
  600   1HA   GLY  77          2HA       GLY  77  13.286   1.580 -14.613
  601   2HA   GLY  77          1HA       GLY  77  13.582   0.025 -13.839
  602    H    THR  78           H        THR  78  11.348   1.414 -11.873
  603    HA   THR  78           HA       THR  78   9.239  -0.307 -12.611
  604    HB   THR  78           HB       THR  78   9.377   0.979 -10.440
  605    HG1  THR  78           HG1      THR  78   7.453  -0.038 -11.076
  606   1HG2  THR  78          1HG2      THR  78   8.132   3.224 -12.038
  607   2HG2  THR  78          2HG2      THR  78   9.849   3.184 -11.637
  608   3HG2  THR  78          3HG2      THR  78   8.644   3.253 -10.351
  609    H    LYS  79           H        LYS  79   7.094   0.339 -13.511
  610    HA   LYS  79           HA       LYS  79   7.371   2.454 -15.601
  611   1HB   LYS  79          2HB       LYS  79   6.234   1.067 -17.191
  612   2HB   LYS  79          1HB       LYS  79   7.490   0.056 -16.475
  613   1HG   LYS  79          2HG       LYS  79   5.920  -1.412 -15.822
  614   2HG   LYS  79          1HG       LYS  79   5.181  -0.162 -14.821
  615   1HD   LYS  79          2HD       LYS  79   3.440  -0.790 -16.281
  616   2HD   LYS  79          1HD       LYS  79   4.100   0.665 -17.030
  617   1HE   LYS  79          2HE       LYS  79   5.370  -0.626 -18.612
  618   2HE   LYS  79          1HE       LYS  79   5.003  -2.129 -17.766
  619   1HZ   LYS  79          1HZ       LYS  79   2.669  -0.631 -18.524
  620   2HZ   LYS  79          2HZ       LYS  79   3.022  -2.279 -18.744
  621   3HZ   LYS  79          3HZ       LYS  79   3.602  -1.126 -19.850
  622    H    MET  80           H        MET  80   6.105   2.226 -12.813
  623    HA   MET  80           HA       MET  80   3.272   2.163 -13.021
  624   1HB   MET  80          2HB       MET  80   5.128   3.664 -11.180
  625   2HB   MET  80          1HB       MET  80   3.381   3.756 -11.019
  626   1HG   MET  80          2HG       MET  80   3.955   1.026 -11.250
  627   2HG   MET  80          1HG       MET  80   5.208   1.649 -10.185
  628   1HE   MET  80          1HE       MET  80   2.907   3.746  -7.766
  629   2HE   MET  80          2HE       MET  80   2.060   4.029  -9.282
  630   3HE   MET  80          3HE       MET  80   3.818   4.093  -9.241
  631    H    ILE  81           H        ILE  81   2.170   3.395 -14.516
  632    HA   ILE  81           HA       ILE  81   3.099   6.152 -15.089
  633    HB   ILE  81           HB       ILE  81   0.588   4.927 -16.218
  634   1HG1  ILE  81          2HG1      ILE  81   2.582   4.355 -18.062
  635   2HG1  ILE  81          1HG1      ILE  81   3.329   3.927 -16.522
  636   1HG2  ILE  81          1HG2      ILE  81   2.130   6.234 -18.167
  637   2HG2  ILE  81          2HG2      ILE  81   2.303   7.219 -16.716
  638   3HG2  ILE  81          3HG2      ILE  81   0.699   6.872 -17.359
  639   1HD1  ILE  81          1HD1      ILE  81   0.705   2.901 -17.634
  640   2HD1  ILE  81          2HD1      ILE  81   1.230   2.624 -15.973
  641   3HD1  ILE  81          3HD1      ILE  81   2.169   1.970 -17.314
  642    H    PHE  82           H        PHE  82   2.300   5.725 -12.464
  643    HA   PHE  82           HA       PHE  82  -0.432   6.890 -12.274
  644   1HB   PHE  82          2HB       PHE  82  -0.387   4.956 -10.965
  645   2HB   PHE  82          1HB       PHE  82   1.285   5.203 -10.481
  646    HD1  PHE  82           HD1      PHE  82   1.765   6.136  -8.390
  647    HD2  PHE  82           HD2      PHE  82  -2.105   6.740 -10.149
  648    HE1  PHE  82           HE1      PHE  82   0.990   7.245  -6.307
  649    HE2  PHE  82           HE2      PHE  82  -2.881   7.848  -8.069
  650    HZ   PHE  82           HZ       PHE  82  -1.333   8.100  -6.147
  651    H    VAL  83           H        VAL  83   2.862   7.259 -10.936
  652    HA   VAL  83           HA       VAL  83   2.898   9.237  -9.190
  653    HB   VAL  83           HB       VAL  83   4.719  10.407 -10.681
  654   1HG1  VAL  83          1HG1      VAL  83   6.035   8.051 -10.336
  655   2HG1  VAL  83          2HG1      VAL  83   4.643   7.799  -9.283
  656   3HG1  VAL  83          3HG1      VAL  83   5.705   9.183  -9.024
  657   1HG2  VAL  83          1HG2      VAL  83   3.980   9.491 -12.815
  658   2HG2  VAL  83          2HG2      VAL  83   4.106   7.848 -12.188
  659   3HG2  VAL  83          3HG2      VAL  83   5.561   8.814 -12.423
  660    H    GLY  84           H        GLY  84   1.376  10.797  -8.935
  661   1HA   GLY  84          2HA       GLY  84   1.376  13.110 -10.644
  662   2HA   GLY  84          1HA       GLY  84  -0.075  12.146 -10.925
  663    H    ILE  85           H        ILE  85   1.509  12.280  -7.793
  664    HA   ILE  85           HA       ILE  85  -0.409  14.271  -6.765
  665    HB   ILE  85           HB       ILE  85  -0.351  11.577  -5.423
  666   1HG1  ILE  85          2HG1      ILE  85  -2.164  12.469  -7.688
  667   2HG1  ILE  85          1HG1      ILE  85  -1.045  11.105  -7.711
  668   1HG2  ILE  85          1HG2      ILE  85  -2.589  12.374  -4.649
  669   2HG2  ILE  85          2HG2      ILE  85  -2.321  13.881  -5.525
  670   3HG2  ILE  85          3HG2      ILE  85  -1.279  13.452  -4.168
  671   1HD1  ILE  85          1HD1      ILE  85  -3.555  11.407  -6.049
  672   2HD1  ILE  85          2HD1      ILE  85  -2.343  10.166  -5.729
  673   3HD1  ILE  85          3HD1      ILE  85  -3.208  10.178  -7.266
  674    H    LYS  86           H        LYS  86   0.067  14.777  -4.448
  675    HA   LYS  86           HA       LYS  86   2.506  13.742  -3.250
  676   1HB   LYS  86          2HB       LYS  86   3.705  15.952  -3.301
  677   2HB   LYS  86          1HB       LYS  86   3.571  15.185  -4.885
  678   1HG   LYS  86          2HG       LYS  86   2.377  16.912  -5.697
  679   2HG   LYS  86          1HG       LYS  86   1.245  16.828  -4.347
  680   1HD   LYS  86          2HD       LYS  86   2.145  18.914  -3.940
  681   2HD   LYS  86          1HD       LYS  86   3.299  17.928  -3.041
  682   1HE   LYS  86          2HE       LYS  86   4.925  18.061  -4.739
  683   2HE   LYS  86          1HE       LYS  86   3.742  18.535  -5.959
  684   1HZ   LYS  86          1HZ       LYS  86   3.671  20.408  -3.882
  685   2HZ   LYS  86          2HZ       LYS  86   4.153  20.642  -5.494
  686   3HZ   LYS  86          3HZ       LYS  86   5.295  20.186  -4.321
  687    H    LYS  87           H        LYS  87  -0.259  14.107  -2.476
  688    HA   LYS  87           HA       LYS  87  -0.036  16.247  -0.406
  689   1HB   LYS  87          2HB       LYS  87  -2.021  16.175  -2.033
  690   2HB   LYS  87          1HB       LYS  87  -2.540  14.732  -1.161
  691   1HG   LYS  87          2HG       LYS  87  -2.981  15.903   0.798
  692   2HG   LYS  87          1HG       LYS  87  -1.851  17.199   0.399
  693   1HD   LYS  87          2HD       LYS  87  -3.344  18.205  -1.116
  694   2HD   LYS  87          1HD       LYS  87  -4.311  16.738  -1.278
  695   1HE   LYS  87          2HE       LYS  87  -5.447  17.099   0.697
  696   2HE   LYS  87          1HE       LYS  87  -4.098  17.959   1.439
  697   1HZ   LYS  87          1HZ       LYS  87  -6.324  19.040   0.157
  698   2HZ   LYS  87          2HZ       LYS  87  -4.972  19.395  -0.810
  699   3HZ   LYS  87          3HZ       LYS  87  -5.001  19.867   0.822
  700    H    LYS  88           H        LYS  88  -0.462  15.709   1.793
  701    HA   LYS  88           HA       LYS  88   0.281  12.994   2.537
  702   1HB   LYS  88          2HB       LYS  88  -0.318  15.543   3.977
  703   2HB   LYS  88          1HB       LYS  88  -0.464  14.038   4.885
  704   1HG   LYS  88          2HG       LYS  88   1.773  13.891   5.068
  705   2HG   LYS  88          1HG       LYS  88   1.946  13.960   3.315
  706   1HD   LYS  88          2HD       LYS  88   2.966  15.953   3.670
  707   2HD   LYS  88          1HD       LYS  88   1.340  16.577   3.953
  708   1HE   LYS  88          2HE       LYS  88   2.091  17.147   6.011
  709   2HE   LYS  88          1HE       LYS  88   1.988  15.427   6.387
  710   1HZ   LYS  88          1HZ       LYS  88   4.285  15.206   5.533
  711   2HZ   LYS  88          2HZ       LYS  88   4.170  16.192   6.913
  712   3HZ   LYS  88          3HZ       LYS  88   4.362  16.894   5.378
  713    H    GLU  89           H        GLU  89  -2.706  14.879   2.447
  714    HA   GLU  89           HA       GLU  89  -4.334  13.021   3.891
  715   1HB   GLU  89          2HB       GLU  89  -4.701  15.455   2.363
  716   2HB   GLU  89          1HB       GLU  89  -5.971  14.290   1.987
  717   1HG   GLU  89          2HG       GLU  89  -6.730  15.565   3.881
  718   2HG   GLU  89          1HG       GLU  89  -6.277  13.970   4.483
  719    H    GLU  90           H        GLU  90  -3.255  13.166   0.553
  720    HA   GLU  90           HA       GLU  90  -5.171  11.210  -0.425
  721   1HB   GLU  90          2HB       GLU  90  -2.968  12.793  -1.504
  722   2HB   GLU  90          1HB       GLU  90  -2.979  11.150  -2.144
  723   1HG   GLU  90          2HG       GLU  90  -4.546  11.926  -3.589
  724   2HG   GLU  90          1HG       GLU  90  -5.649  11.811  -2.217
  725    H    ARG  91           H        ARG  91  -1.633  11.013   0.130
  726    HA   ARG  91           HA       ARG  91  -1.368   8.236  -0.253
  727   1HB   ARG  91          2HB       ARG  91   0.606   8.462   1.348
  728   2HB   ARG  91          1HB       ARG  91   0.617   9.560  -0.033
  729   1HG   ARG  91          2HG       ARG  91   0.911  11.186   1.528
  730   2HG   ARG  91          1HG       ARG  91  -0.821  11.003   1.808
  731   1HD   ARG  91          2HD       ARG  91  -0.454  10.208   3.877
  732   2HD   ARG  91          1HD       ARG  91   0.619   8.959   3.246
  733    HE   ARG  91           HE       ARG  91   2.219  11.188   3.204
  734   1HH1  ARG  91          1HH1      ARG  91   0.187   9.671   5.549
  735   2HH1  ARG  91          2HH1      ARG  91   1.108  10.235   6.901
  736   1HH2  ARG  91          1HH2      ARG  91   3.414  11.949   4.963
  737   2HH2  ARG  91          2HH2      ARG  91   2.934  11.519   6.571
  738    H    ALA  92           H        ALA  92  -2.256  10.025   2.689
  739    HA   ALA  92           HA       ALA  92  -2.270   7.810   4.469
  740   1HB   ALA  92          1HB       ALA  92  -3.535  10.511   4.416
  741   2HB   ALA  92          2HB       ALA  92  -2.489   9.785   5.636
  742   3HB   ALA  92          3HB       ALA  92  -4.191   9.331   5.552
  743    H    ASP  93           H        ASP  93  -4.821   9.098   2.346
  744    HA   ASP  93           HA       ASP  93  -6.853   7.292   3.266
  745   1HB   ASP  93          2HB       ASP  93  -6.634   9.400   1.353
  746   2HB   ASP  93          1HB       ASP  93  -7.313   7.992   0.535
  747    H    LEU  94           H        LEU  94  -4.388   7.081   0.742
  748    HA   LEU  94           HA       LEU  94  -5.401   4.791  -0.614
  749   1HB   LEU  94          2HB       LEU  94  -2.552   5.734  -0.180
  750   2HB   LEU  94          1HB       LEU  94  -2.999   4.429  -1.278
  751    HG   LEU  94           HG       LEU  94  -4.175   7.214  -1.446
  752   1HD1  LEU  94          1HD1      LEU  94  -1.841   5.979  -2.936
  753   2HD1  LEU  94          2HD1      LEU  94  -1.790   7.388  -1.877
  754   3HD1  LEU  94          3HD1      LEU  94  -2.643   7.475  -3.417
  755   1HD2  LEU  94          1HD2      LEU  94  -4.047   5.533  -3.840
  756   2HD2  LEU  94          2HD2      LEU  94  -5.425   6.388  -3.146
  757   3HD2  LEU  94          3HD2      LEU  94  -4.983   4.791  -2.544
  758    H    ILE  95           H        ILE  95  -3.012   4.994   2.040
  759    HA   ILE  95           HA       ILE  95  -2.808   2.144   2.376
  760    HB   ILE  95           HB       ILE  95  -2.351   4.187   4.556
  761   1HG1  ILE  95          2HG1      ILE  95  -1.187   5.184   2.761
  762   2HG1  ILE  95          1HG1      ILE  95   0.043   4.195   3.547
  763   1HG2  ILE  95          1HG2      ILE  95  -1.963   1.403   4.334
  764   2HG2  ILE  95          2HG2      ILE  95  -1.364   2.463   5.611
  765   3HG2  ILE  95          3HG2      ILE  95  -0.357   2.119   4.204
  766   1HD1  ILE  95          1HD1      ILE  95  -1.382   3.736   0.948
  767   2HD1  ILE  95          2HD1      ILE  95  -0.803   2.346   1.866
  768   3HD1  ILE  95          3HD1      ILE  95   0.335   3.579   1.322
  769    H    ALA  96           H        ALA  96  -4.853   4.621   3.818
  770    HA   ALA  96           HA       ALA  96  -5.999   3.197   5.943
  771   1HB   ALA  96          1HB       ALA  96  -7.991   4.714   4.431
  772   2HB   ALA  96          2HB       ALA  96  -6.497   5.618   4.681
  773   3HB   ALA  96          3HB       ALA  96  -7.382   4.979   6.065
  774    H    TYR  97           H        TYR  97  -7.179   3.277   2.555
  775    HA   TYR  97           HA       TYR  97  -9.193   1.277   3.071
  776   1HB   TYR  97          2HB       TYR  97  -9.595   2.779   1.249
  777   2HB   TYR  97          1HB       TYR  97  -8.033   2.411   0.519
  778    HD1  TYR  97           HD1      TYR  97  -8.282   1.182  -1.447
  779    HD2  TYR  97           HD2      TYR  97 -10.819   0.311   1.906
  780    HE1  TYR  97           HE1      TYR  97  -9.304  -0.696  -2.706
  781    HE2  TYR  97           HE2      TYR  97 -11.843  -1.563   0.646
  782    HH   TYR  97           HH       TYR  97 -11.936  -1.935  -2.331
  783    H    LEU  98           H        LEU  98  -5.967   1.207   1.560
  784    HA   LEU  98           HA       LEU  98  -6.086  -1.576   0.878
  785   1HB   LEU  98          2HB       LEU  98  -4.075   0.554   0.868
  786   2HB   LEU  98          1HB       LEU  98  -3.395  -1.026   1.257
  787    HG   LEU  98           HG       LEU  98  -3.324  -0.805  -1.137
  788   1HD1  LEU  98          1HD1      LEU  98  -4.576  -2.874   0.139
  789   2HD1  LEU  98          2HD1      LEU  98  -4.193  -2.860  -1.582
  790   3HD1  LEU  98          3HD1      LEU  98  -5.805  -2.402  -1.034
  791   1HD2  LEU  98          1HD2      LEU  98  -4.777   0.801  -1.883
  792   2HD2  LEU  98          2HD2      LEU  98  -6.014   0.377  -0.700
  793   3HD2  LEU  98          3HD2      LEU  98  -5.823  -0.591  -2.161
  794    H    LYS  99           H        LYS  99  -5.959  -0.105   3.895
  795    HA   LYS  99           HA       LYS  99  -4.423  -2.301   5.122
  796   1HB   LYS  99          2HB       LYS  99  -4.330   0.278   5.741
  797   2HB   LYS  99          1HB       LYS  99  -5.721  -0.147   6.740
  798   1HG   LYS  99          2HG       LYS  99  -3.854  -2.203   7.168
  799   2HG   LYS  99          1HG       LYS  99  -2.913  -0.712   7.191
  800   1HD   LYS  99          2HD       LYS  99  -3.690  -1.094   9.439
  801   2HD   LYS  99          1HD       LYS  99  -4.636   0.241   8.780
  802   1HE   LYS  99          2HE       LYS  99  -6.564  -1.031   8.593
  803   2HE   LYS  99          1HE       LYS  99  -5.673  -2.545   8.427
  804   1HZ   LYS  99          1HZ       LYS  99  -5.009  -1.556  10.908
  805   2HZ   LYS  99          2HZ       LYS  99  -6.035  -2.868  10.574
  806   3HZ   LYS  99          3HZ       LYS  99  -6.682  -1.309  10.774
  807    H    LYS 100           H        LYS 100  -7.701  -0.971   5.004
  808    HA   LYS 100           HA       LYS 100  -8.707  -2.916   6.952
  809   1HB   LYS 100          2HB       LYS 100  -9.736  -0.671   6.691
  810   2HB   LYS 100          1HB       LYS 100 -10.219  -1.101   5.050
  811   1HG   LYS 100          2HG       LYS 100 -11.527  -3.008   5.963
  812   2HG   LYS 100          1HG       LYS 100 -11.098  -2.497   7.595
  813   1HD   LYS 100          2HD       LYS 100 -12.746  -0.967   7.596
  814   2HD   LYS 100          1HD       LYS 100 -12.115  -0.243   6.117
  815   1HE   LYS 100          2HE       LYS 100 -13.868  -2.716   6.191
  816   2HE   LYS 100          1HE       LYS 100 -14.461  -1.085   5.873
  817   1HZ   LYS 100          1HZ       LYS 100 -12.743  -2.796   4.215
  818   2HZ   LYS 100          2HZ       LYS 100 -12.587  -1.108   4.093
  819   3HZ   LYS 100          3HZ       LYS 100 -14.079  -1.851   3.765
  820    H    ALA 101           H        ALA 101  -8.510  -2.633   3.453
  821    HA   ALA 101           HA       ALA 101 -10.317  -4.807   2.893
  822   1HB   ALA 101          1HB       ALA 101  -9.412  -2.876   1.336
  823   2HB   ALA 101          2HB       ALA 101  -9.804  -4.455   0.655
  824   3HB   ALA 101          3HB       ALA 101  -8.126  -4.035   1.001
  825    H    THR 102           H        THR 102  -6.746  -4.614   2.534
  826    HA   THR 102           HA       THR 102  -6.693  -7.583   2.780
  827    HB   THR 102           HB       THR 102  -5.579  -6.360   0.824
  828    HG1  THR 102           HG1      THR 102  -4.481  -8.268   2.513
  829   1HG2  THR 102          1HG2      THR 102  -4.447  -4.879   2.897
  830   2HG2  THR 102          2HG2      THR 102  -3.950  -4.852   1.206
  831   3HG2  THR 102          3HG2      THR 102  -3.136  -5.922   2.348
  832    H    ASN 103           H        ASN 103  -6.919  -5.609   5.084
  833    HA   ASN 103           HA       ASN 103  -4.968  -6.935   6.777
  834   1HB   ASN 103          2HB       ASN 103  -4.278  -4.416   5.617
  835   2HB   ASN 103          1HB       ASN 103  -4.549  -4.169   7.343
  836   1HD2  ASN 103          1HD2      ASN 103  -2.643  -6.091   5.009
  837   2HD2  ASN 103          2HD2      ASN 103  -1.424  -6.518   6.111
  838    H    GLU 104           HN       GLU 104  -7.497  -7.303   7.196
  839    HA   GLU 104           HA       GLU 104  -8.350  -5.286   9.234
  840   1HB   GLU 104          2HB       GLU 104  -9.754  -6.418   7.028
  841   2HB   GLU 104          1HB       GLU 104 -10.488  -7.052   8.502
  842   1HG   GLU 104          2HG       GLU 104 -10.269  -4.507   9.272
  843   2HG   GLU 104          1HG       GLU 104 -10.320  -4.230   7.530
  844    HHA  HEC 105           HHA      HEC 105   4.193  -2.994  -9.051
  845    HHB  HEC 105           HHB      HEC 105   1.293   0.424  -4.605
  846    HHC  HEC 105           HHC      HEC 105  -1.834   3.594  -9.099
  847    HHD  HEC 105           HHD      HEC 105   1.033   0.139 -13.535
  848   1HMA  HEC 105          1HMA      HEC 105   2.167  -1.515  -3.677
  849   2HMA  HEC 105          2HMA      HEC 105   3.760  -0.766  -3.796
  850   3HMA  HEC 105          3HMA      HEC 105   3.596  -2.517  -3.931
  851   1HAA  HEC 105          1HAA      HEC 105   4.951  -3.557  -7.362
  852   2HAA  HEC 105          2HAA      HEC 105   5.433  -2.840  -5.832
  853   1HBA  HEC 105          1HBA      HEC 105   3.032  -4.656  -6.015
  854   2HBA  HEC 105          2HBA      HEC 105   3.996  -4.243  -4.594
  855   1HMB  HEC 105          1HMB      HEC 105  -0.868   1.370  -3.768
  856   2HMB  HEC 105          2HMB      HEC 105  -1.424   3.031  -3.976
  857   3HMB  HEC 105          3HMB      HEC 105   0.288   2.697  -3.732
  858    HAB  HEC 105           HAB      HEC 105  -2.320   4.465  -7.363
  859   1HBB  HEC 105          1HBB      HEC 105  -2.218   5.988  -5.689
  860   2HBB  HEC 105          2HBB      HEC 105  -0.601   5.284  -5.649
  861   3HBB  HEC 105          3HBB      HEC 105  -1.809   4.787  -4.464
  862   1HMC  HEC 105          1HMC      HEC 105  -3.000   3.426 -12.487
  863   2HMC  HEC 105          2HMC      HEC 105  -2.731   4.026 -10.851
  864   3HMC  HEC 105          3HMC      HEC 105  -1.782   4.667 -12.192
  865    HAC  HEC 105           HAC      HEC 105  -0.105   1.556 -14.525
  866   1HBC  HEC 105          1HBC      HEC 105  -0.270   4.022 -14.212
  867   2HBC  HEC 105          2HBC      HEC 105  -2.022   3.819 -14.211
  868   3HBC  HEC 105          3HBC      HEC 105  -1.081   3.351 -15.627
  869   1HMD  HEC 105          1HMD      HEC 105   3.199  -0.841 -14.393
  870   2HMD  HEC 105          2HMD      HEC 105   3.672  -2.526 -14.167
  871   3HMD  HEC 105          3HMD      HEC 105   1.972  -2.108 -14.383
  872   1HAD  HEC 105          1HAD      HEC 105   3.883  -4.364 -11.569
  873   2HAD  HEC 105          2HAD      HEC 105   4.719  -3.412 -12.786
  874   1HBD  HEC 105          1HBD      HEC 105   5.552  -2.432 -10.254
  875   2HBD  HEC 105          2HBD      HEC 105   6.503  -3.309 -11.448
  Start of MODEL   18
    1   1H    GLY   1          1HT       GLY   1  -9.189   8.754   9.319
    2   2H    GLY   1          2HT       GLY   1  -9.829   7.216   9.653
    3   3H    GLY   1          3HT       GLY   1 -10.794   8.601   9.845
    4   1HA   GLY   1          1HA       GLY   1 -10.753   9.021   7.483
    5   2HA   GLY   1          2HA       GLY   1  -9.697   7.625   7.264
    6    H    ASP   2           H        ASP   2 -11.604   7.001   5.814
    7    HA   ASP   2           HA       ASP   2 -13.413   5.264   7.393
    8   1HB   ASP   2          2HB       ASP   2 -14.460   7.600   6.776
    9   2HB   ASP   2          1HB       ASP   2 -14.609   6.889   5.168
   10    H    VAL   3           H        VAL   3 -14.315   3.526   6.090
   11    HA   VAL   3           HA       VAL   3 -12.521   2.724   3.923
   12    HB   VAL   3           HB       VAL   3 -13.388   1.074   5.556
   13   1HG1  VAL   3          1HG1      VAL   3 -16.078   1.271   4.226
   14   2HG1  VAL   3          2HG1      VAL   3 -15.690   2.338   5.577
   15   3HG1  VAL   3          3HG1      VAL   3 -15.663   0.589   5.799
   16   1HG2  VAL   3          1HG2      VAL   3 -13.520   0.876   2.666
   17   2HG2  VAL   3          2HG2      VAL   3 -14.705  -0.195   3.415
   18   3HG2  VAL   3          3HG2      VAL   3 -12.999  -0.334   3.838
   19    H    GLU   4           H        GLU   4 -15.712   4.119   4.232
   20    HA   GLU   4           HA       GLU   4 -16.630   3.485   1.572
   21   1HB   GLU   4          2HB       GLU   4 -17.402   5.646   3.550
   22   2HB   GLU   4          1HB       GLU   4 -18.210   5.434   1.996
   23   1HG   GLU   4          2HG       GLU   4 -19.132   3.384   2.598
   24   2HG   GLU   4          1HG       GLU   4 -17.883   3.061   3.800
   25    H    LYS   5           H        LYS   5 -14.491   5.894   2.889
   26    HA   LYS   5           HA       LYS   5 -14.564   7.483   0.389
   27   1HB   LYS   5          2HB       LYS   5 -13.702   7.929   3.158
   28   2HB   LYS   5          1HB       LYS   5 -12.540   8.520   1.971
   29   1HG   LYS   5          2HG       LYS   5 -14.923   9.353   0.884
   30   2HG   LYS   5          1HG       LYS   5 -15.233   9.520   2.613
   31   1HD   LYS   5          2HD       LYS   5 -12.636  10.522   1.494
   32   2HD   LYS   5          1HD       LYS   5 -14.094  11.494   1.286
   33   1HE   LYS   5          2HE       LYS   5 -13.446  12.309   3.335
   34   2HE   LYS   5          1HE       LYS   5 -14.360  10.908   3.895
   35   1HZ   LYS   5          1HZ       LYS   5 -12.515   9.898   4.592
   36   2HZ   LYS   5          2HZ       LYS   5 -11.770  11.420   4.477
   37   3HZ   LYS   5          3HZ       LYS   5 -11.637  10.307   3.200
   38    H    GLY   6           H        GLY   6 -12.207   5.646   2.352
   39   1HA   GLY   6          1HA       GLY   6  -9.997   5.894   0.597
   40   2HA   GLY   6          2HA       GLY   6 -10.243   4.541   1.700
   41    H    LYS   7           H        LYS   7 -12.756   3.691   0.537
   42    HA   LYS   7           HA       LYS   7 -11.759   1.968  -1.533
   43   1HB   LYS   7          2HB       LYS   7 -13.630   1.250  -0.174
   44   2HB   LYS   7          1HB       LYS   7 -14.582   2.651  -0.664
   45   1HG   LYS   7          2HG       LYS   7 -15.396   1.396  -2.349
   46   2HG   LYS   7          1HG       LYS   7 -13.787   1.451  -3.070
   47   1HD   LYS   7          2HD       LYS   7 -14.240  -0.859  -2.896
   48   2HD   LYS   7          1HD       LYS   7 -13.233  -0.523  -1.487
   49   1HE   LYS   7          2HE       LYS   7 -14.922  -0.945  -0.028
   50   2HE   LYS   7          1HE       LYS   7 -16.114  -0.113  -1.026
   51   1HZ   LYS   7          1HZ       LYS   7 -15.511  -2.897  -0.875
   52   2HZ   LYS   7          2HZ       LYS   7 -15.422  -2.327  -2.473
   53   3HZ   LYS   7          3HZ       LYS   7 -16.848  -2.120  -1.573
   54    H    LYS   8           H        LYS   8 -13.811   4.885  -1.614
   55    HA   LYS   8           HA       LYS   8 -14.206   4.876  -4.453
   56   1HB   LYS   8          2HB       LYS   8 -14.991   6.484  -2.274
   57   2HB   LYS   8          1HB       LYS   8 -14.114   7.557  -3.364
   58   1HG   LYS   8          2HG       LYS   8 -15.533   6.494  -5.245
   59   2HG   LYS   8          1HG       LYS   8 -16.562   5.892  -3.945
   60   1HD   LYS   8          2HD       LYS   8 -15.796   8.808  -4.198
   61   2HD   LYS   8          1HD       LYS   8 -17.251   8.138  -4.937
   62   1HE   LYS   8          2HE       LYS   8 -16.625   7.801  -1.997
   63   2HE   LYS   8          1HE       LYS   8 -17.554   9.165  -2.617
   64   1HZ   LYS   8          1HZ       LYS   8 -18.235   6.308  -3.057
   65   2HZ   LYS   8          2HZ       LYS   8 -19.152   7.651  -3.549
   66   3HZ   LYS   8          3HZ       LYS   8 -18.963   7.310  -1.897
   67    H    ILE   9           H        ILE   9 -11.554   5.908  -2.426
   68    HA   ILE   9           HA       ILE   9 -10.286   7.577  -4.433
   69    HB   ILE   9           HB       ILE   9  -9.281   6.275  -1.891
   70   1HG1  ILE   9          2HG1      ILE   9  -9.314   9.211  -2.300
   71   2HG1  ILE   9          1HG1      ILE   9 -10.899   8.440  -2.241
   72   1HG2  ILE   9          1HG2      ILE   9  -7.201   7.442  -2.172
   73   2HG2  ILE   9          2HG2      ILE   9  -7.802   8.297  -3.593
   74   3HG2  ILE   9          3HG2      ILE   9  -7.486   6.565  -3.675
   75   1HD1  ILE   9          1HD1      ILE   9 -10.508   7.553  -0.072
   76   2HD1  ILE   9          2HD1      ILE   9  -9.913   9.211   0.003
   77   3HD1  ILE   9          3HD1      ILE   9  -8.776   7.873  -0.168
   78    H    PHE  10           H        PHE  10  -9.172   4.437  -3.079
   79    HA   PHE  10           HA       PHE  10  -7.354   3.864  -5.170
   80   1HB   PHE  10          2HB       PHE  10  -7.584   2.607  -2.974
   81   2HB   PHE  10          1HB       PHE  10  -8.980   1.787  -3.677
   82    HD1  PHE  10           HD1      PHE  10  -5.325   2.152  -3.763
   83    HD2  PHE  10           HD2      PHE  10  -8.719   0.241  -5.580
   84    HE1  PHE  10           HE1      PHE  10  -3.814   0.556  -4.913
   85    HE2  PHE  10           HE2      PHE  10  -7.195  -1.355  -6.727
   86    HZ   PHE  10           HZ       PHE  10  -4.760  -1.196  -6.398
   87    H    ILE  11           H        ILE  11 -10.822   3.636  -5.049
   88    HA   ILE  11           HA       ILE  11 -11.134   1.847  -7.299
   89    HB   ILE  11           HB       ILE  11 -12.935   3.726  -5.790
   90   1HG1  ILE  11          2HG1      ILE  11 -13.010   0.761  -6.436
   91   2HG1  ILE  11          1HG1      ILE  11 -12.490   1.470  -4.908
   92   1HG2  ILE  11          1HG2      ILE  11 -13.550   3.996  -8.174
   93   2HG2  ILE  11          2HG2      ILE  11 -14.799   3.123  -7.285
   94   3HG2  ILE  11          3HG2      ILE  11 -13.685   2.244  -8.331
   95   1HD1  ILE  11          1HD1      ILE  11 -14.788   2.551  -4.761
   96   2HD1  ILE  11          2HD1      ILE  11 -14.769   0.795  -4.595
   97   3HD1  ILE  11          3HD1      ILE  11 -15.263   1.531  -6.119
   98    H    MET  12           H        MET  12 -11.031   5.388  -6.937
   99    HA   MET  12           HA       MET  12 -11.064   5.595  -9.917
  100   1HB   MET  12          2HB       MET  12 -11.851   7.823  -9.685
  101   2HB   MET  12          1HB       MET  12 -12.742   6.914  -8.465
  102   1HG   MET  12          2HG       MET  12 -10.784   7.576  -6.878
  103   2HG   MET  12          1HG       MET  12 -10.432   8.809  -8.088
  104   1HE   MET  12          1HE       MET  12 -13.642  10.718  -8.499
  105   2HE   MET  12          2HE       MET  12 -12.296   9.900  -9.286
  106   3HE   MET  12          3HE       MET  12 -11.981  11.230  -8.175
  107    H    LYS  13           H        LYS  13  -8.769   4.994  -7.905
  108    HA   LYS  13           HA       LYS  13  -6.947   7.143  -8.916
  109   1HB   LYS  13          2HB       LYS  13  -7.416   6.925  -6.351
  110   2HB   LYS  13          1HB       LYS  13  -6.349   5.523  -6.452
  111   1HG   LYS  13          2HG       LYS  13  -4.916   7.347  -5.929
  112   2HG   LYS  13          1HG       LYS  13  -4.693   7.073  -7.657
  113   1HD   LYS  13          2HD       LYS  13  -6.912   8.861  -7.268
  114   2HD   LYS  13          1HD       LYS  13  -5.514   9.471  -6.382
  115   1HE   LYS  13          2HE       LYS  13  -4.162   9.037  -8.514
  116   2HE   LYS  13          1HE       LYS  13  -5.711   8.830  -9.330
  117   1HZ   LYS  13          1HZ       LYS  13  -4.476  11.183  -9.016
  118   2HZ   LYS  13          2HZ       LYS  13  -5.504  11.187  -7.662
  119   3HZ   LYS  13          3HZ       LYS  13  -6.151  11.011  -9.224
  120    H    CYS  14           H        CYS  14  -6.706   3.819  -7.578
  121    HA   CYS  14           HA       CYS  14  -4.927   3.194  -9.901
  122   1HB   CYS  14          2HB       CYS  14  -4.482   1.516  -7.536
  123   2HB   CYS  14          1HB       CYS  14  -3.308   2.349  -8.547
  124    H    SER  15           H        SER  15  -7.842   2.812  -9.562
  125    HA   SER  15           HA       SER  15  -8.177  -0.086  -9.172
  126   1HB   SER  15          2HB       SER  15  -9.854   1.909  -8.654
  127   2HB   SER  15          1HB       SER  15 -10.312   1.661 -10.335
  128    HG   SER  15           HG       SER  15 -11.555   0.240  -9.286
  129    H    GLN  16           H        GLN  16  -6.824   1.578 -11.575
  130    HA   GLN  16           HA       GLN  16  -8.200   0.127 -13.781
  131   1HB   GLN  16          2HB       GLN  16  -7.892   2.466 -14.271
  132   2HB   GLN  16          1HB       GLN  16  -6.202   2.406 -13.766
  133   1HG   GLN  16          2HG       GLN  16  -6.524   2.359 -16.265
  134   2HG   GLN  16          1HG       GLN  16  -5.625   0.981 -15.631
  135   1HE2  GLN  16          1HE2      GLN  16  -8.792   1.974 -16.924
  136   2HE2  GLN  16          2HE2      GLN  16  -9.343   0.399 -17.241
  137    H    CYS  17           H        CYS  17  -4.891   0.840 -12.635
  138    HA   CYS  17           HA       CYS  17  -3.856  -1.482 -14.109
  139   1HB   CYS  17          2HB       CYS  17  -2.666   0.756 -12.504
  140   2HB   CYS  17          1HB       CYS  17  -1.721  -0.718 -12.714
  141    H    HIS  18           H        HIS  18  -4.709  -0.585 -10.800
  142    HA   HIS  18           HA       HIS  18  -3.983  -3.362  -9.934
  143   1HB   HIS  18          2HB       HIS  18  -4.363  -0.887  -8.227
  144   2HB   HIS  18          1HB       HIS  18  -3.948  -2.491  -7.634
  145    HD1  HIS  18           HD1      HIS  18  -1.512  -3.158  -7.706
  146    HD2  HIS  18           HD2      HIS  18  -2.283   0.334  -9.822
  147    HE1  HIS  18           HE1      HIS  18   0.743  -2.184  -8.320
  148    H    THR  19           H        THR  19  -6.007  -4.335 -10.495
  149    HA   THR  19           HA       THR  19  -8.443  -3.121  -9.337
  150    HB   THR  19           HB       THR  19  -9.669  -4.817 -10.569
  151    HG1  THR  19           HG1      THR  19  -8.525  -6.632 -10.382
  152   1HG2  THR  19          1HG2      THR  19  -7.341  -3.726 -12.175
  153   2HG2  THR  19          2HG2      THR  19  -8.898  -2.939 -11.915
  154   3HG2  THR  19          3HG2      THR  19  -8.805  -4.414 -12.877
  155    H    VAL  20           H        VAL  20  -8.266  -3.449  -7.110
  156    HA   VAL  20           HA       VAL  20  -7.459  -6.063  -6.059
  157    HB   VAL  20           HB       VAL  20  -7.552  -5.040  -3.915
  158   1HG1  VAL  20          1HG1      VAL  20  -6.753  -3.064  -6.056
  159   2HG1  VAL  20          2HG1      VAL  20  -5.709  -4.134  -5.122
  160   3HG1  VAL  20          3HG1      VAL  20  -6.484  -2.756  -4.341
  161   1HG2  VAL  20          1HG2      VAL  20  -9.596  -4.005  -3.629
  162   2HG2  VAL  20          2HG2      VAL  20  -9.580  -3.301  -5.246
  163   3HG2  VAL  20          3HG2      VAL  20  -8.618  -2.574  -3.959
  164    H    GLU  21           H        GLU  21  -9.710  -6.439  -7.650
  165    HA   GLU  21           HA       GLU  21 -11.509  -7.705  -5.799
  166   1HB   GLU  21          2HB       GLU  21 -12.143  -4.953  -6.696
  167   2HB   GLU  21          1HB       GLU  21 -13.463  -6.116  -6.810
  168   1HG   GLU  21          2HG       GLU  21 -12.484  -6.735  -4.352
  169   2HG   GLU  21          1HG       GLU  21 -12.128  -5.009  -4.410
  170    H    LYS  22           H        LYS  22 -10.044  -8.107  -8.398
  171    HA   LYS  22           HA       LYS  22 -12.332  -8.684 -10.213
  172   1HB   LYS  22          2HB       LYS  22 -10.097  -7.495 -10.915
  173   2HB   LYS  22          1HB       LYS  22  -9.451  -9.137 -10.938
  174   1HG   LYS  22          2HG       LYS  22 -10.264  -9.195 -13.061
  175   2HG   LYS  22          1HG       LYS  22 -11.819  -9.467 -12.276
  176   1HD   LYS  22          2HD       LYS  22 -12.592  -7.487 -13.012
  177   2HD   LYS  22          1HD       LYS  22 -11.222  -6.645 -12.286
  178   1HE   LYS  22          2HE       LYS  22  -9.924  -6.810 -14.235
  179   2HE   LYS  22          1HE       LYS  22 -10.880  -8.148 -14.872
  180   1HZ   LYS  22          1HZ       LYS  22 -12.028  -5.454 -14.456
  181   2HZ   LYS  22          2HZ       LYS  22 -12.643  -6.728 -15.397
  182   3HZ   LYS  22          3HZ       LYS  22 -11.256  -5.887 -15.902
  183    H    GLY  23           H        GLY  23 -10.723 -10.207  -7.773
  184   1HA   GLY  23          2HA       GLY  23 -11.317 -12.541  -7.270
  185   2HA   GLY  23          1HA       GLY  23 -11.242 -12.879  -9.000
  186    H    GLY  24           H        GLY  24  -8.722 -10.937  -8.737
  187   1HA   GLY  24          1HA       GLY  24  -6.517 -11.426  -7.603
  188   2HA   GLY  24          2HA       GLY  24  -6.856 -13.129  -7.915
  189    H    LYS  25           H        LYS  25  -7.932 -11.145 -10.443
  190    HA   LYS  25           HA       LYS  25  -5.724 -12.106 -12.153
  191   1HB   LYS  25          2HB       LYS  25  -8.239 -12.157 -12.764
  192   2HB   LYS  25          1HB       LYS  25  -8.063 -10.427 -13.058
  193   1HG   LYS  25          2HG       LYS  25  -6.277 -10.853 -14.679
  194   2HG   LYS  25          1HG       LYS  25  -6.372 -12.585 -14.355
  195   1HD   LYS  25          2HD       LYS  25  -8.937 -11.295 -15.077
  196   2HD   LYS  25          1HD       LYS  25  -7.734 -11.353 -16.366
  197   1HE   LYS  25          2HE       LYS  25  -7.947 -13.863 -14.853
  198   2HE   LYS  25          1HE       LYS  25  -9.431 -13.421 -15.698
  199   1HZ   LYS  25          1HZ       LYS  25  -6.861 -13.216 -17.105
  200   2HZ   LYS  25          2HZ       LYS  25  -8.414 -13.508 -17.731
  201   3HZ   LYS  25          3HZ       LYS  25  -7.576 -14.743 -16.917
  202    H    HIS  26           H        HIS  26  -4.641 -10.557 -13.634
  203    HA   HIS  26           HA       HIS  26  -4.648  -7.749 -12.655
  204   1HB   HIS  26          2HB       HIS  26  -1.983  -8.139 -13.216
  205   2HB   HIS  26          1HB       HIS  26  -2.674  -8.147 -11.597
  206    HD1  HIS  26           HD1      HIS  26  -2.931 -10.869 -14.255
  207    HD2  HIS  26           HD2      HIS  26  -1.340 -10.291 -10.444
  208    HE1  HIS  26           HE1      HIS  26  -2.079 -13.126 -13.484
  209    H    LYS  27           H        LYS  27  -3.383  -6.328 -14.219
  210    HA   LYS  27           HA       LYS  27  -3.322  -7.389 -16.971
  211   1HB   LYS  27          2HB       LYS  27  -5.517  -6.415 -16.886
  212   2HB   LYS  27          1HB       LYS  27  -4.913  -4.988 -16.042
  213   1HG   LYS  27          2HG       LYS  27  -4.317  -3.988 -17.976
  214   2HG   LYS  27          1HG       LYS  27  -3.491  -5.439 -18.545
  215   1HD   LYS  27          2HD       LYS  27  -5.173  -5.501 -20.083
  216   2HD   LYS  27          1HD       LYS  27  -6.094  -6.222 -18.763
  217   1HE   LYS  27          2HE       LYS  27  -7.000  -4.056 -18.140
  218   2HE   LYS  27          1HE       LYS  27  -5.975  -3.245 -19.325
  219   1HZ   LYS  27          1HZ       LYS  27  -8.471  -4.596 -19.698
  220   2HZ   LYS  27          2HZ       LYS  27  -7.274  -5.149 -20.770
  221   3HZ   LYS  27          3HZ       LYS  27  -7.673  -3.500 -20.717
  222    H    THR  28           H        THR  28  -3.236  -3.997 -16.000
  223    HA   THR  28           HA       THR  28  -0.435  -3.876 -16.973
  224    HB   THR  28           HB       THR  28  -2.431  -1.699 -16.278
  225    HG1  THR  28           HG1      THR  28  -2.945  -2.451 -18.228
  226   1HG2  THR  28          1HG2      THR  28  -0.705  -0.168 -17.239
  227   2HG2  THR  28          2HG2      THR  28   0.421  -1.526 -17.290
  228   3HG2  THR  28          3HG2      THR  28  -0.179  -0.937 -15.740
  229    H    GLY  29           H        GLY  29  -2.319  -3.697 -14.054
  230   1HA   GLY  29          2HA       GLY  29   0.156  -2.980 -12.534
  231   2HA   GLY  29          1HA       GLY  29  -1.466  -2.596 -11.973
  232    HA   PRO  30           HA       PRO  30   0.051  -7.006 -10.775
  233   1HB   PRO  30          2HB       PRO  30   1.126  -6.457  -8.319
  234   2HB   PRO  30          1HB       PRO  30   2.071  -6.569  -9.806
  235   1HG   PRO  30          2HG       PRO  30   1.158  -4.109  -8.345
  236   2HG   PRO  30          1HG       PRO  30   2.668  -4.394  -9.231
  237   1HD   PRO  30          2HD       PRO  30   0.558  -2.965 -10.291
  238   2HD   PRO  30          1HD       PRO  30   1.732  -3.861 -11.275
  239    H    ASN  31           H        ASN  31  -1.542  -8.161  -9.873
  240    HA   ASN  31           HA       ASN  31  -3.922  -7.100  -8.887
  241   1HB   ASN  31          2HB       ASN  31  -3.832  -9.411  -9.543
  242   2HB   ASN  31          1HB       ASN  31  -2.621  -9.772  -8.314
  243   1HD2  ASN  31          1HD2      ASN  31  -5.827  -8.095  -8.274
  244   2HD2  ASN  31          2HD2      ASN  31  -6.423  -8.968  -6.946
  245    H    LEU  32           H        LEU  32  -3.839  -5.577  -7.276
  246    HA   LEU  32           HA       LEU  32  -2.206  -5.947  -4.888
  247   1HB   LEU  32          2HB       LEU  32  -3.773  -3.799  -6.114
  248   2HB   LEU  32          1HB       LEU  32  -3.987  -3.876  -4.368
  249    HG   LEU  32           HG       LEU  32  -1.731  -3.440  -3.935
  250   1HD1  LEU  32          1HD1      LEU  32  -0.445  -4.970  -5.076
  251   2HD1  LEU  32          2HD1      LEU  32  -0.126  -3.551  -6.074
  252   3HD1  LEU  32          3HD1      LEU  32  -1.326  -4.738  -6.584
  253   1HD2  LEU  32          1HD2      LEU  32  -2.432  -1.383  -4.798
  254   2HD2  LEU  32          2HD2      LEU  32  -2.631  -2.025  -6.426
  255   3HD2  LEU  32          3HD2      LEU  32  -1.016  -1.724  -5.790
  256    H    HIS  33           H        HIS  33  -3.553  -8.144  -4.674
  257    HA   HIS  33           HA       HIS  33  -6.138  -7.701  -3.298
  258   1HB   HIS  33          2HB       HIS  33  -5.881  -9.523  -5.001
  259   2HB   HIS  33          1HB       HIS  33  -4.713 -10.301  -3.934
  260    HD1  HIS  33           HD1      HIS  33  -7.522  -8.615  -2.226
  261    HD2  HIS  33           HD2      HIS  33  -6.686 -12.440  -3.655
  262    HE1  HIS  33           HE1      HIS  33  -9.237 -10.160  -1.184
  263    H    GLY  34           H        GLY  34  -2.805  -8.356  -2.565
  264   1HA   GLY  34          2HA       GLY  34  -3.409  -8.226   0.304
  265   2HA   GLY  34          1HA       GLY  34  -2.710  -9.754  -0.232
  266    H    LEU  35           H        LEU  35  -1.836  -6.859  -1.916
  267    HA   LEU  35           HA       LEU  35   0.896  -7.116  -1.833
  268   1HB   LEU  35          2HB       LEU  35  -0.186  -5.346  -3.106
  269   2HB   LEU  35          1HB       LEU  35  -0.681  -4.538  -1.618
  270    HG   LEU  35           HG       LEU  35   2.208  -5.121  -1.810
  271   1HD1  LEU  35          1HD1      LEU  35   2.539  -3.094  -3.291
  272   2HD1  LEU  35          2HD1      LEU  35   0.820  -3.179  -3.674
  273   3HD1  LEU  35          3HD1      LEU  35   1.890  -4.510  -4.118
  274   1HD2  LEU  35          1HD2      LEU  35   1.702  -3.778   0.004
  275   2HD2  LEU  35          2HD2      LEU  35   0.359  -2.990  -0.822
  276   3HD2  LEU  35          3HD2      LEU  35   2.018  -2.527  -1.198
  277    H    PHE  36           H        PHE  36  -1.135  -5.818   0.760
  278    HA   PHE  36           HA       PHE  36   1.052  -4.864   2.382
  279   1HB   PHE  36          2HB       PHE  36  -1.844  -5.499   2.900
  280   2HB   PHE  36          1HB       PHE  36  -0.764  -5.110   4.239
  281    HD1  PHE  36           HD1      PHE  36  -0.153  -3.683   0.919
  282    HD2  PHE  36           HD2      PHE  36  -2.014  -3.036   4.737
  283    HE1  PHE  36           HE1      PHE  36  -0.380  -1.269   0.401
  284    HE2  PHE  36           HE2      PHE  36  -2.241  -0.623   4.217
  285    HZ   PHE  36           HZ       PHE  36  -1.425   0.260   2.049
  286    H    GLY  37           H        GLY  37   2.371  -5.973   3.751
  287   1HA   GLY  37          2HA       GLY  37   2.972  -7.685   5.301
  288   2HA   GLY  37          1HA       GLY  37   1.527  -8.578   4.838
  289    H    ARG  38           H        ARG  38   2.591  -7.928   1.913
  290    HA   ARG  38           HA       ARG  38   4.599 -10.136   1.895
  291   1HB   ARG  38          2HB       ARG  38   3.550 -10.618  -0.441
  292   2HB   ARG  38          1HB       ARG  38   2.719 -11.204   0.996
  293   1HG   ARG  38          2HG       ARG  38   0.924  -9.901   0.586
  294   2HG   ARG  38          1HG       ARG  38   1.933  -8.478   0.327
  295   1HD   ARG  38          2HD       ARG  38   1.442 -10.659  -1.717
  296   2HD   ARG  38          1HD       ARG  38   0.679  -9.070  -1.721
  297    HE   ARG  38           HE       ARG  38   3.569  -8.864  -1.660
  298   1HH1  ARG  38          1HH2      ARG  38   1.549 -10.414  -3.840
  299   2HH1  ARG  38          2HH2      ARG  38   1.979  -9.435  -5.204
  300   1HH2  ARG  38          1HH1      ARG  38   3.822  -7.171  -3.333
  301   2HH2  ARG  38          2HH1      ARG  38   3.265  -7.598  -4.917
  302    H    LYS  39           H        LYS  39   6.196  -9.992   0.221
  303    HA   LYS  39           HA       LYS  39   6.733  -7.213  -0.608
  304   1HB   LYS  39          2HB       LYS  39   8.914  -8.099  -1.332
  305   2HB   LYS  39          1HB       LYS  39   8.561  -8.602   0.322
  306   1HG   LYS  39          2HG       LYS  39   7.421 -10.640  -1.101
  307   2HG   LYS  39          1HG       LYS  39   8.795 -10.233  -2.130
  308   1HD   LYS  39          2HD       LYS  39   9.959 -10.177   0.344
  309   2HD   LYS  39          1HD       LYS  39   8.756 -11.449   0.561
  310   1HE   LYS  39          2HE       LYS  39  10.145 -12.859  -0.510
  311   2HE   LYS  39          1HE       LYS  39   9.896 -11.910  -1.976
  312   1HZ   LYS  39          1HZ       LYS  39  12.271 -12.235  -0.949
  313   2HZ   LYS  39          2HZ       LYS  39  11.802 -10.913   0.009
  314   3HZ   LYS  39          3HZ       LYS  39  11.827 -10.773  -1.684
  315    H    THR  40           H        THR  40   7.779  -7.137  -2.961
  316    HA   THR  40           HA       THR  40   5.654  -7.648  -4.817
  317    HB   THR  40           HB       THR  40   7.030  -6.649  -6.424
  318    HG1  THR  40           HG1      THR  40   9.262  -6.872  -6.399
  319   1HG2  THR  40          1HG2      THR  40   8.764  -5.469  -4.433
  320   2HG2  THR  40          2HG2      THR  40   7.124  -5.619  -3.803
  321   3HG2  THR  40          3HG2      THR  40   7.415  -4.738  -5.303
  322    H    GLY  41           H        GLY  41   6.877  -8.750  -7.069
  323   1HA   GLY  41          2HA       GLY  41   7.280 -10.834  -8.062
  324   2HA   GLY  41          1HA       GLY  41   8.301 -11.164  -6.663
  325    H    GLN  42           H        GLN  42   5.135 -11.620  -8.065
  326    HA   GLN  42           HA       GLN  42   4.639 -13.807  -6.150
  327   1HB   GLN  42          2HB       GLN  42   3.456 -11.254  -5.769
  328   2HB   GLN  42          1HB       GLN  42   2.187 -12.320  -6.373
  329   1HG   GLN  42          2HG       GLN  42   2.221 -12.519  -3.966
  330   2HG   GLN  42          1HG       GLN  42   2.891 -14.008  -4.636
  331   1HE2  GLN  42          1HE2      GLN  42   4.130 -10.743  -3.690
  332   2HE2  GLN  42          2HE2      GLN  42   5.529 -11.337  -2.933
  333    H    ALA  43           H        ALA  43   3.260 -11.877  -8.829
  334    HA   ALA  43           HA       ALA  43   1.739 -14.170  -9.816
  335   1HB   ALA  43          1HB       ALA  43   0.744 -12.049 -10.235
  336   2HB   ALA  43          2HB       ALA  43   1.357 -12.583 -11.800
  337   3HB   ALA  43          3HB       ALA  43   2.250 -11.382 -10.866
  338    HA   PRO  44           HA       PRO  44   5.009 -15.798 -12.291
  339   1HB   PRO  44          2HB       PRO  44   3.463 -17.463 -13.838
  340   2HB   PRO  44          1HB       PRO  44   3.898 -17.812 -12.156
  341   1HG   PRO  44          2HG       PRO  44   1.284 -16.909 -13.269
  342   2HG   PRO  44          1HG       PRO  44   1.616 -17.838 -11.798
  343   1HD   PRO  44          2HD       PRO  44   1.011 -15.072 -11.919
  344   2HD   PRO  44          1HD       PRO  44   1.648 -15.945 -10.508
  345    H    GLY  45           H        GLY  45   2.501 -16.106 -14.715
  346   1HA   GLY  45          2HA       GLY  45   3.865 -15.117 -16.887
  347   2HA   GLY  45          1HA       GLY  45   2.119 -14.924 -16.725
  348    H    TYR  46           H        TYR  46   2.328 -13.226 -14.348
  349    HA   TYR  46           HA       TYR  46   2.813 -10.680 -15.727
  350   1HB   TYR  46          2HB       TYR  46   0.893 -11.089 -14.128
  351   2HB   TYR  46          1HB       TYR  46   2.071 -11.166 -12.826
  352    HD1  TYR  46           HD1      TYR  46   3.743  -8.835 -14.539
  353    HD2  TYR  46           HD2      TYR  46  -0.132  -9.229 -12.766
  354    HE1  TYR  46           HE1      TYR  46   3.626  -6.399 -14.304
  355    HE2  TYR  46           HE2      TYR  46  -0.223  -6.775 -12.516
  356    HH   TYR  46           HH       TYR  46   1.717  -4.670 -14.131
  357    H    SER  47           H        SER  47   4.895 -10.016 -15.880
  358    HA   SER  47           HA       SER  47   6.916 -10.773 -13.905
  359   1HB   SER  47          2HB       SER  47   8.204  -8.919 -15.291
  360   2HB   SER  47          1HB       SER  47   7.886 -10.493 -16.014
  361    HG   SER  47           HG       SER  47   7.084  -9.159 -17.495
  362    H    TYR  48           H        TYR  48   5.678  -9.858 -12.063
  363    HA   TYR  48           HA       TYR  48   4.813  -7.257 -11.652
  364   1HB   TYR  48          2HB       TYR  48   5.946  -9.394  -9.966
  365   2HB   TYR  48          1HB       TYR  48   6.025  -7.787  -9.270
  366    HD1  TYR  48           HD1      TYR  48   3.388  -9.074 -11.564
  367    HD2  TYR  48           HD2      TYR  48   4.450  -7.973  -7.570
  368    HE1  TYR  48           HE1      TYR  48   1.017  -9.306 -10.867
  369    HE2  TYR  48           HE2      TYR  48   2.080  -8.196  -6.862
  370    HH   TYR  48           HH       TYR  48  -0.257  -9.725  -8.784
  371    H    THR  49           H        THR  49   6.120  -5.689 -10.034
  372    HA   THR  49           HA       THR  49   8.250  -4.520 -11.510
  373    HB   THR  49           HB       THR  49   8.209  -4.148  -8.555
  374    HG1  THR  49           HG1      THR  49   6.213  -2.753  -9.709
  375   1HG2  THR  49          1HG2      THR  49   8.403  -1.813  -9.193
  376   2HG2  THR  49          2HG2      THR  49   8.032  -2.206 -10.872
  377   3HG2  THR  49          3HG2      THR  49   9.545  -2.755 -10.152
  378    H    ALA  50           H        ALA  50   9.721  -6.220 -11.994
  379    HA   ALA  50           HA       ALA  50  10.943  -7.997 -10.192
  380   1HB   ALA  50          1HB       ALA  50  11.200  -7.956 -12.719
  381   2HB   ALA  50          2HB       ALA  50  12.691  -8.252 -11.824
  382   3HB   ALA  50          3HB       ALA  50  12.371  -6.655 -12.502
  383    H    ALA  51           H        ALA  51  11.869  -4.662 -11.036
  384    HA   ALA  51           HA       ALA  51  14.262  -4.514  -9.549
  385   1HB   ALA  51          1HB       ALA  51  13.665  -2.049  -9.314
  386   2HB   ALA  51          2HB       ALA  51  12.144  -2.432 -10.121
  387   3HB   ALA  51          3HB       ALA  51  13.673  -2.671 -10.962
  388    H    ASN  52           H        ASN  52  11.210  -3.054  -8.354
  389    HA   ASN  52           HA       ASN  52  11.700  -2.800  -5.684
  390   1HB   ASN  52          2HB       ASN  52   9.331  -3.423  -7.271
  391   2HB   ASN  52          1HB       ASN  52   9.228  -4.089  -5.644
  392   1HD2  ASN  52          1HD2      ASN  52   7.951  -1.610  -7.043
  393   2HD2  ASN  52          2HD2      ASN  52   8.232  -0.354  -5.936
  394    H    LYS  53           H        LYS  53  10.984  -5.901  -7.286
  395    HA   LYS  53           HA       LYS  53  10.840  -7.555  -5.009
  396   1HB   LYS  53          2HB       LYS  53  10.429  -8.208  -7.438
  397   2HB   LYS  53          1HB       LYS  53  12.178  -8.362  -7.599
  398   1HG   LYS  53          2HG       LYS  53  11.912  -9.834  -5.404
  399   2HG   LYS  53          1HG       LYS  53  10.268 -10.032  -6.011
  400   1HD   LYS  53          2HD       LYS  53  11.082 -11.665  -7.340
  401   2HD   LYS  53          1HD       LYS  53  11.866 -10.387  -8.269
  402   1HE   LYS  53          2HE       LYS  53  13.572 -11.978  -7.646
  403   2HE   LYS  53          1HE       LYS  53  13.813 -10.531  -6.668
  404   1HZ   LYS  53          1HZ       LYS  53  13.603 -11.777  -4.869
  405   2HZ   LYS  53          2HZ       LYS  53  13.305 -13.158  -5.812
  406   3HZ   LYS  53          3HZ       LYS  53  12.015 -12.172  -5.316
  407    H    ASN  54           H        ASN  54  13.756  -7.032  -7.032
  408    HA   ASN  54           HA       ASN  54  15.527  -8.310  -5.196
  409   1HB   ASN  54          2HB       ASN  54  16.281  -8.041  -7.444
  410   2HB   ASN  54          1HB       ASN  54  15.974  -6.305  -7.415
  411   1HD2  ASN  54          1HD2      ASN  54  17.833  -5.080  -7.106
  412   2HD2  ASN  54          2HD2      ASN  54  19.221  -5.600  -6.278
  413    H    LYS  55           H        LYS  55  14.094  -5.168  -5.202
  414    HA   LYS  55           HA       LYS  55  16.060  -3.770  -3.669
  415   1HB   LYS  55          2HB       LYS  55  14.081  -2.757  -4.905
  416   2HB   LYS  55          1HB       LYS  55  13.075  -3.301  -3.562
  417   1HG   LYS  55          2HG       LYS  55  13.628  -1.106  -2.937
  418   2HG   LYS  55          1HG       LYS  55  14.820  -2.071  -2.066
  419   1HD   LYS  55          2HD       LYS  55  15.550  -1.241  -4.827
  420   2HD   LYS  55          1HD       LYS  55  15.510   0.030  -3.606
  421   1HE   LYS  55          2HE       LYS  55  17.451  -0.685  -2.727
  422   2HE   LYS  55          1HE       LYS  55  16.802  -2.312  -2.525
  423   1HZ   LYS  55          1HZ       LYS  55  18.798  -1.733  -4.171
  424   2HZ   LYS  55          2HZ       LYS  55  17.491  -1.532  -5.239
  425   3HZ   LYS  55          3HZ       LYS  55  17.719  -3.014  -4.440
  426    H    GLY  56           H        GLY  56  14.135  -6.408  -2.820
  427   1HA   GLY  56          1HA       GLY  56  13.582  -7.377  -0.751
  428   2HA   GLY  56          2HA       GLY  56  15.045  -6.585  -0.163
  429    H    ILE  57           H        ILE  57  12.020  -5.182  -1.409
  430    HA   ILE  57           HA       ILE  57  11.833  -3.628   1.133
  431    HB   ILE  57           HB       ILE  57  12.066  -2.469  -1.162
  432   1HG1  ILE  57          2HG1      ILE  57  11.294  -1.395   0.986
  433   2HG1  ILE  57          1HG1      ILE  57  10.628  -0.655  -0.469
  434   1HG2  ILE  57          1HG2      ILE  57  10.140  -2.318  -2.551
  435   2HG2  ILE  57          2HG2      ILE  57   9.106  -3.062  -1.330
  436   3HG2  ILE  57          3HG2      ILE  57  10.306  -4.035  -2.182
  437   1HD1  ILE  57          1HD1      ILE  57   8.787  -2.641   0.096
  438   2HD1  ILE  57          2HD1      ILE  57   8.608  -0.937   0.508
  439   3HD1  ILE  57          3HD1      ILE  57   9.251  -2.069   1.697
  440    H    ILE  58           H        ILE  58  10.294  -4.377   2.518
  441    HA   ILE  58           HA       ILE  58   8.120  -6.083   1.505
  442    HB   ILE  58           HB       ILE  58   9.395  -6.441   3.713
  443   1HG1  ILE  58          2HG1      ILE  58   7.263  -7.585   3.070
  444   2HG1  ILE  58          1HG1      ILE  58   7.415  -7.340   4.809
  445   1HG2  ILE  58          1HG2      ILE  58   7.420  -4.583   4.960
  446   2HG2  ILE  58          2HG2      ILE  58   8.862  -3.876   4.233
  447   3HG2  ILE  58          3HG2      ILE  58   9.020  -5.068   5.523
  448   1HD1  ILE  58          1HD1      ILE  58   5.256  -6.568   4.486
  449   2HD1  ILE  58          2HD1      ILE  58   5.596  -5.986   2.856
  450   3HD1  ILE  58          3HD1      ILE  58   6.153  -5.067   4.254
  451    H    TRP  59           H        TRP  59   6.422  -5.033   0.584
  452    HA   TRP  59           HA       TRP  59   5.807  -2.323   0.782
  453   1HB   TRP  59          2HB       TRP  59   3.990  -4.687   0.295
  454   2HB   TRP  59          1HB       TRP  59   3.447  -3.015   0.146
  455    HD1  TRP  59           HD1      TRP  59   4.290  -5.507  -2.108
  456    HE1  TRP  59           HE1      TRP  59   5.574  -4.668  -4.181
  457    HE3  TRP  59           HE3      TRP  59   5.853  -0.949  -0.400
  458    HZ2  TRP  59           HZ2      TRP  59   7.073  -2.377  -4.998
  459    HZ3  TRP  59           HZ3      TRP  59   7.209   0.534  -1.844
  460    HH2  TRP  59           HH2      TRP  59   7.819  -0.173  -4.137
  461    H    GLY  60           H        GLY  60   5.746  -1.358   2.756
  462   1HA   GLY  60          1HA       GLY  60   3.708  -2.389   4.693
  463   2HA   GLY  60          2HA       GLY  60   5.234  -1.680   5.222
  464    H    GLU  61           H        GLU  61   3.620  -0.217   6.393
  465    HA   GLU  61           HA       GLU  61   1.995   1.640   4.930
  466   1HB   GLU  61          2HB       GLU  61   3.275   1.922   7.666
  467   2HB   GLU  61          1HB       GLU  61   1.981   2.942   7.035
  468   1HG   GLU  61          2HG       GLU  61   1.778  -0.066   7.358
  469   2HG   GLU  61          1HG       GLU  61   1.143   1.104   8.514
  470    H    ASP  62           H        ASP  62   4.879   2.574   6.815
  471    HA   ASP  62           HA       ASP  62   5.344   4.944   5.304
  472   1HB   ASP  62          2HB       ASP  62   6.229   4.506   7.604
  473   2HB   ASP  62          1HB       ASP  62   7.373   3.361   6.903
  474    H    THR  63           H        THR  63   6.587   1.651   4.939
  475    HA   THR  63           HA       THR  63   8.664   2.213   3.090
  476    HB   THR  63           HB       THR  63   7.528  -0.235   2.286
  477    HG1  THR  63           HG1      THR  63   6.961  -1.203   4.164
  478   1HG2  THR  63          1HG2      THR  63   9.408  -1.104   3.841
  479   2HG2  THR  63          2HG2      THR  63   9.751   0.601   4.137
  480   3HG2  THR  63          3HG2      THR  63   9.862  -0.051   2.502
  481    H    LEU  64           H        LEU  64   5.204   1.576   2.536
  482    HA   LEU  64           HA       LEU  64   5.441   1.784  -0.347
  483   1HB   LEU  64          2HB       LEU  64   3.493   0.880   1.374
  484   2HB   LEU  64          1HB       LEU  64   2.810   2.405   0.809
  485    HG   LEU  64           HG       LEU  64   3.959   0.311  -1.050
  486   1HD1  LEU  64          1HD1      LEU  64   1.862  -0.306   0.397
  487   2HD1  LEU  64          2HD1      LEU  64   1.829  -0.606  -1.341
  488   3HD1  LEU  64          3HD1      LEU  64   1.021   0.814  -0.675
  489   1HD2  LEU  64          1HD2      LEU  64   2.126   1.768  -2.444
  490   2HD2  LEU  64          2HD2      LEU  64   3.844   2.160  -2.388
  491   3HD2  LEU  64          3HD2      LEU  64   2.716   2.987  -1.315
  492    H    MET  65           H        MET  65   4.727   4.046   2.272
  493    HA   MET  65           HA       MET  65   3.753   6.201   0.704
  494   1HB   MET  65          2HB       MET  65   3.801   6.072   3.235
  495   2HB   MET  65          1HB       MET  65   5.519   6.464   3.151
  496   1HG   MET  65          2HG       MET  65   4.494   8.566   3.441
  497   2HG   MET  65          1HG       MET  65   4.771   8.482   1.702
  498   1HE   MET  65          1HE       MET  65   1.426   6.519   3.551
  499   2HE   MET  65          2HE       MET  65   1.162   8.112   4.255
  500   3HE   MET  65          3HE       MET  65   2.729   7.327   4.434
  501    H    GLU  66           H        GLU  66   6.983   4.950   1.158
  502    HA   GLU  66           HA       GLU  66   8.275   7.301   0.019
  503   1HB   GLU  66          2HB       GLU  66   9.303   5.674   1.718
  504   2HB   GLU  66          1HB       GLU  66   9.515   4.572   0.359
  505   1HG   GLU  66          2HG       GLU  66  11.529   5.673   0.211
  506   2HG   GLU  66          1HG       GLU  66  10.555   6.786  -0.750
  507    H    TYR  67           H        TYR  67   8.230   3.876  -1.044
  508    HA   TYR  67           HA       TYR  67   9.149   4.268  -3.648
  509   1HB   TYR  67          2HB       TYR  67   8.832   2.024  -2.875
  510   2HB   TYR  67          1HB       TYR  67   7.114   2.295  -2.588
  511    HD1  TYR  67           HD1      TYR  67   9.540   2.759  -5.424
  512    HD2  TYR  67           HD2      TYR  67   5.684   1.358  -4.165
  513    HE1  TYR  67           HE1      TYR  67   9.038   2.058  -7.746
  514    HE2  TYR  67           HE2      TYR  67   5.180   0.656  -6.489
  515    HH   TYR  67           HH       TYR  67   6.560  -0.007  -8.543
  516    H    LEU  68           H        LEU  68   5.971   5.012  -2.355
  517    HA   LEU  68           HA       LEU  68   4.854   5.448  -5.039
  518   1HB   LEU  68          2HB       LEU  68   3.731   4.867  -2.567
  519   2HB   LEU  68          1HB       LEU  68   3.325   6.567  -2.812
  520    HG   LEU  68           HG       LEU  68   2.774   5.657  -5.278
  521   1HD1  LEU  68          1HD1      LEU  68   1.565   3.373  -3.908
  522   2HD1  LEU  68          2HD1      LEU  68   3.327   3.292  -3.923
  523   3HD1  LEU  68          3HD1      LEU  68   2.437   3.428  -5.440
  524   1HD2  LEU  68          1HD2      LEU  68   0.876   5.294  -2.940
  525   2HD2  LEU  68          2HD2      LEU  68   0.441   5.629  -4.616
  526   3HD2  LEU  68          3HD2      LEU  68   1.265   6.857  -3.657
  527    H    GLU  69           H        GLU  69   6.181   7.367  -2.394
  528    HA   GLU  69           HA       GLU  69   5.338   9.931  -3.277
  529   1HB   GLU  69          2HB       GLU  69   6.719   9.094  -1.158
  530   2HB   GLU  69          1HB       GLU  69   8.085   9.540  -2.169
  531   1HG   GLU  69          2HG       GLU  69   7.577  11.785  -2.113
  532   2HG   GLU  69          1HG       GLU  69   5.841  11.493  -1.997
  533    H    ASN  70           H        ASN  70   7.676   7.672  -4.427
  534    HA   ASN  70           HA       ASN  70   8.017   8.964  -6.951
  535   1HB   ASN  70          2HB       ASN  70   9.428  10.343  -5.118
  536   2HB   ASN  70          1HB       ASN  70  10.608   9.084  -5.482
  537   1HD2  ASN  70          1HD2      ASN  70   9.661   8.775  -8.302
  538   2HD2  ASN  70          2HD2      ASN  70  10.218  10.150  -9.128
  539    HA   PRO  71           HA       PRO  71   9.215   4.571  -6.708
  540   1HB   PRO  71          2HB       PRO  71   7.858   3.888  -9.011
  541   2HB   PRO  71          1HB       PRO  71   7.130   3.888  -7.396
  542   1HG   PRO  71          2HG       PRO  71   6.766   5.842  -9.617
  543   2HG   PRO  71          1HG       PRO  71   5.670   5.436  -8.289
  544   1HD   PRO  71          2HD       PRO  71   7.298   7.742  -8.423
  545   2HD   PRO  71          1HD       PRO  71   6.475   7.133  -6.971
  546    H    LYS  72           H        LYS  72   9.223   6.790  -9.492
  547    HA   LYS  72           HA       LYS  72  11.196   5.334 -10.996
  548   1HB   LYS  72          2HB       LYS  72   9.802   7.041 -12.076
  549   2HB   LYS  72          1HB       LYS  72  10.482   8.283 -11.025
  550   1HG   LYS  72          2HG       LYS  72  12.668   8.024 -11.995
  551   2HG   LYS  72          1HG       LYS  72  12.166   6.582 -12.878
  552   1HD   LYS  72          2HD       LYS  72  11.089   7.783 -14.501
  553   2HD   LYS  72          1HD       LYS  72  10.564   9.031 -13.371
  554   1HE   LYS  72          2HE       LYS  72  12.201  10.325 -14.235
  555   2HE   LYS  72          1HE       LYS  72  13.337   9.280 -13.384
  556   1HZ   LYS  72          1HZ       LYS  72  13.949   9.350 -15.669
  557   2HZ   LYS  72          2HZ       LYS  72  12.370   8.975 -16.173
  558   3HZ   LYS  72          3HZ       LYS  72  13.305   7.812 -15.360
  559    H    LYS  73           H        LYS  73  11.297   7.263  -8.178
  560    HA   LYS  73           HA       LYS  73  14.215   7.770  -8.442
  561   1HB   LYS  73          2HB       LYS  73  13.289   9.744  -7.649
  562   2HB   LYS  73          1HB       LYS  73  11.979   8.915  -6.813
  563   1HG   LYS  73          2HG       LYS  73  13.334   8.381  -4.962
  564   2HG   LYS  73          1HG       LYS  73  14.828   8.640  -5.862
  565   1HD   LYS  73          2HD       LYS  73  12.893  10.906  -5.421
  566   2HD   LYS  73          1HD       LYS  73  14.068  10.476  -4.179
  567   1HE   LYS  73          2HE       LYS  73  15.749  10.537  -6.238
  568   2HE   LYS  73          1HE       LYS  73  14.523  11.616  -6.906
  569   1HZ   LYS  73          1HZ       LYS  73  14.826  13.143  -5.232
  570   2HZ   LYS  73          2HZ       LYS  73  16.412  12.577  -5.455
  571   3HZ   LYS  73          3HZ       LYS  73  15.480  12.010  -4.152
  572    H    TYR  74           H        TYR  74  11.867   5.815  -6.768
  573    HA   TYR  74           HA       TYR  74  13.821   4.868  -4.771
  574   1HB   TYR  74          2HB       TYR  74  11.342   5.185  -4.297
  575   2HB   TYR  74          1HB       TYR  74  11.049   3.795  -5.336
  576    HD1  TYR  74           HD1      TYR  74  10.390   2.041  -3.919
  577    HD2  TYR  74           HD2      TYR  74  13.801   4.438  -2.877
  578    HE1  TYR  74           HE1      TYR  74  10.871   0.528  -2.015
  579    HE2  TYR  74           HE2      TYR  74  14.281   2.922  -0.972
  580    HH   TYR  74           HH       TYR  74  13.727   0.372  -0.466
  581    H    ILE  75           H        ILE  75  11.660   3.054  -6.981
  582    HA   ILE  75           HA       ILE  75  13.814   1.054  -7.319
  583    HB   ILE  75           HB       ILE  75  11.046   0.750  -8.426
  584   1HG1  ILE  75          2HG1      ILE  75  10.905   1.684  -6.050
  585   2HG1  ILE  75          1HG1      ILE  75  10.145   0.122  -6.296
  586   1HG2  ILE  75          1HG2      ILE  75  11.835  -1.323  -8.707
  587   2HG2  ILE  75          2HG2      ILE  75  12.025  -1.485  -6.965
  588   3HG2  ILE  75          3HG2      ILE  75  13.356  -0.866  -7.943
  589   1HD1  ILE  75          1HD1      ILE  75  12.890   0.622  -5.124
  590   2HD1  ILE  75          2HD1      ILE  75  12.235  -0.977  -5.479
  591   3HD1  ILE  75          3HD1      ILE  75  11.469   0.040  -4.257
  592    HA   PRO  76           HA       PRO  76  14.266   3.154 -11.295
  593   1HB   PRO  76          2HB       PRO  76  16.789   2.171 -11.761
  594   2HB   PRO  76          1HB       PRO  76  16.462   3.593 -10.755
  595   1HG   PRO  76          2HG       PRO  76  17.226   0.835  -9.912
  596   2HG   PRO  76          1HG       PRO  76  17.499   2.378  -9.086
  597   1HD   PRO  76          2HD       PRO  76  15.488   0.494  -8.448
  598   2HD   PRO  76          1HD       PRO  76  15.571   2.171  -7.870
  599    H    GLY  77           H        GLY  77  12.598   1.618 -12.146
  600   1HA   GLY  77          2HA       GLY  77  13.287   0.154 -14.349
  601   2HA   GLY  77          1HA       GLY  77  13.509  -1.017 -13.050
  602    H    THR  78           H        THR  78  11.281   0.156 -11.446
  603    HA   THR  78           HA       THR  78   9.184  -1.512 -12.137
  604    HB   THR  78           HB       THR  78   9.205  -0.147 -10.072
  605    HG1  THR  78           HG1      THR  78   6.879   0.738 -10.649
  606   1HG2  THR  78          1HG2      THR  78   9.242   2.117 -10.083
  607   2HG2  THR  78          2HG2      THR  78   8.016   2.215 -11.347
  608   3HG2  THR  78          3HG2      THR  78   9.708   1.961 -11.778
  609    H    LYS  79           H        LYS  79   7.089  -1.056 -13.191
  610    HA   LYS  79           HA       LYS  79   7.481   0.638 -15.617
  611   1HB   LYS  79          2HB       LYS  79   6.002  -1.894 -15.046
  612   2HB   LYS  79          1HB       LYS  79   5.314  -0.803 -16.249
  613   1HG   LYS  79          2HG       LYS  79   6.736  -2.165 -17.533
  614   2HG   LYS  79          1HG       LYS  79   7.727  -0.737 -17.229
  615   1HD   LYS  79          2HD       LYS  79   9.269  -2.023 -16.221
  616   2HD   LYS  79          1HD       LYS  79   8.070  -2.517 -15.025
  617   1HE   LYS  79          2HE       LYS  79   7.262  -4.099 -17.007
  618   2HE   LYS  79          1HE       LYS  79   8.937  -3.907 -17.526
  619   1HZ   LYS  79          1HZ       LYS  79   8.261  -5.773 -15.851
  620   2HZ   LYS  79          2HZ       LYS  79   8.400  -4.522 -14.711
  621   3HZ   LYS  79          3HZ       LYS  79   9.731  -4.948 -15.676
  622    H    MET  80           H        MET  80   6.392   1.260 -12.740
  623    HA   MET  80           HA       MET  80   3.627   1.890 -12.926
  624   1HB   MET  80          2HB       MET  80   5.907   3.039 -11.346
  625   2HB   MET  80          1HB       MET  80   4.323   3.797 -11.276
  626   1HG   MET  80          2HG       MET  80   4.314   0.867 -10.937
  627   2HG   MET  80          1HG       MET  80   5.116   1.758  -9.646
  628   1HE   MET  80          1HE       MET  80   3.460   3.025  -7.591
  629   2HE   MET  80          2HE       MET  80   2.555   4.273  -8.445
  630   3HE   MET  80          3HE       MET  80   4.236   3.967  -8.872
  631    H    ILE  81           H        ILE  81   2.672   3.244 -14.393
  632    HA   ILE  81           HA       ILE  81   4.304   5.404 -15.610
  633    HB   ILE  81           HB       ILE  81   2.759   3.864 -16.976
  634   1HG1  ILE  81          2HG1      ILE  81   1.709   6.097 -18.076
  635   2HG1  ILE  81          1HG1      ILE  81   2.932   6.834 -17.041
  636   1HG2  ILE  81          1HG2      ILE  81   0.553   3.807 -16.514
  637   2HG2  ILE  81          2HG2      ILE  81   0.450   5.567 -16.534
  638   3HG2  ILE  81          3HG2      ILE  81   0.905   4.728 -15.051
  639   1HD1  ILE  81          1HD1      ILE  81   3.392   4.700 -19.143
  640   2HD1  ILE  81          2HD1      ILE  81   4.629   5.277 -18.025
  641   3HD1  ILE  81          3HD1      ILE  81   3.928   6.379 -19.210
  642    H    PHE  82           H        PHE  82   3.123   5.211 -12.786
  643    HA   PHE  82           HA       PHE  82   1.038   7.092 -12.427
  644   1HB   PHE  82          2HB       PHE  82   2.507   5.450 -10.810
  645   2HB   PHE  82          1HB       PHE  82   3.147   7.023 -10.362
  646    HD1  PHE  82           HD1      PHE  82   2.074   8.184  -8.677
  647    HD2  PHE  82           HD2      PHE  82  -0.166   5.419 -11.080
  648    HE1  PHE  82           HE1      PHE  82   0.065   8.608  -7.291
  649    HE2  PHE  82           HE2      PHE  82  -2.177   5.845  -9.694
  650    HZ   PHE  82           HZ       PHE  82  -2.052   7.436  -7.801
  651    H    VAL  83           H        VAL  83   1.266   9.303 -11.509
  652    HA   VAL  83           HA       VAL  83   3.480  10.758 -12.852
  653    HB   VAL  83           HB       VAL  83   2.068  12.750 -12.505
  654   1HG1  VAL  83          1HG1      VAL  83   0.904  10.302 -13.807
  655   2HG1  VAL  83          2HG1      VAL  83   1.600  11.734 -14.565
  656   3HG1  VAL  83          3HG1      VAL  83   0.006  11.820 -13.815
  657   1HG2  VAL  83          1HG2      VAL  83   0.132  10.784 -11.245
  658   2HG2  VAL  83          2HG2      VAL  83  -0.187  12.492 -11.552
  659   3HG2  VAL  83          3HG2      VAL  83   1.037  12.022 -10.375
  660    H    GLY  84           H        GLY  84   1.883  10.405  -9.690
  661   1HA   GLY  84          2HA       GLY  84   3.460  10.322  -7.732
  662   2HA   GLY  84          1HA       GLY  84   4.296  11.688  -8.470
  663    H    ILE  85           H        ILE  85   1.226  10.712  -6.960
  664    HA   ILE  85           HA       ILE  85   0.103  13.361  -6.876
  665    HB   ILE  85           HB       ILE  85  -0.425  11.026  -5.011
  666   1HG1  ILE  85          2HG1      ILE  85  -0.756  10.360  -7.338
  667   2HG1  ILE  85          1HG1      ILE  85  -2.331  10.584  -6.574
  668   1HG2  ILE  85          1HG2      ILE  85  -2.764  12.362  -5.228
  669   2HG2  ILE  85          2HG2      ILE  85  -1.642  13.708  -5.434
  670   3HG2  ILE  85          3HG2      ILE  85  -1.576  12.720  -3.974
  671   1HD1  ILE  85          1HD1      ILE  85  -2.630  11.775  -8.551
  672   2HD1  ILE  85          2HD1      ILE  85  -0.949  12.306  -8.604
  673   3HD1  ILE  85          3HD1      ILE  85  -2.075  13.054  -7.470
  674    H    LYS  86           H        LYS  86   0.414  14.997  -5.392
  675    HA   LYS  86           HA       LYS  86   2.403  14.448  -3.229
  676   1HB   LYS  86          2HB       LYS  86   2.418  16.392  -5.236
  677   2HB   LYS  86          1HB       LYS  86   1.905  17.265  -3.790
  678   1HG   LYS  86          2HG       LYS  86   4.061  15.428  -3.167
  679   2HG   LYS  86          1HG       LYS  86   4.532  16.529  -4.461
  680   1HD   LYS  86          2HD       LYS  86   3.147  18.122  -2.603
  681   2HD   LYS  86          1HD       LYS  86   4.193  17.080  -1.638
  682   1HE   LYS  86          2HE       LYS  86   6.147  17.866  -2.674
  683   2HE   LYS  86          1HE       LYS  86   5.271  18.474  -4.079
  684   1HZ   LYS  86          1HZ       LYS  86   4.316  20.201  -2.745
  685   2HZ   LYS  86          2HZ       LYS  86   6.003  20.240  -2.552
  686   3HZ   LYS  86          3HZ       LYS  86   5.022  19.578  -1.334
  687    H    LYS  87           H        LYS  87  -0.130  13.706  -2.567
  688    HA   LYS  87           HA       LYS  87  -0.996  15.914  -0.747
  689   1HB   LYS  87          2HB       LYS  87  -2.522  15.107  -2.825
  690   2HB   LYS  87          1HB       LYS  87  -3.028  13.922  -1.621
  691   1HG   LYS  87          2HG       LYS  87  -3.947  15.523  -0.224
  692   2HG   LYS  87          1HG       LYS  87  -2.859  16.791  -0.792
  693   1HD   LYS  87          2HD       LYS  87  -4.099  16.545  -3.058
  694   2HD   LYS  87          1HD       LYS  87  -5.338  15.710  -2.121
  695   1HE   LYS  87          2HE       LYS  87  -6.083  17.634  -1.196
  696   2HE   LYS  87          1HE       LYS  87  -4.446  18.195  -0.855
  697   1HZ   LYS  87          1HZ       LYS  87  -4.723  18.275  -3.597
  698   2HZ   LYS  87          2HZ       LYS  87  -4.683  19.599  -2.532
  699   3HZ   LYS  87          3HZ       LYS  87  -6.172  18.913  -2.985
  700    H    LYS  88           H        LYS  88  -0.258  15.200   1.212
  701    HA   LYS  88           HA       LYS  88   0.152  12.478   1.939
  702   1HB   LYS  88          2HB       LYS  88   0.084  15.085   3.337
  703   2HB   LYS  88          1HB       LYS  88  -0.258  13.682   4.350
  704   1HG   LYS  88          2HG       LYS  88   2.002  13.303   2.499
  705   2HG   LYS  88          1HG       LYS  88   2.264  14.557   3.712
  706   1HD   LYS  88          2HD       LYS  88   2.646  12.974   5.262
  707   2HD   LYS  88          1HD       LYS  88   1.021  12.339   5.009
  708   1HE   LYS  88          2HE       LYS  88   2.163  10.468   4.355
  709   2HE   LYS  88          1HE       LYS  88   2.254  11.331   2.819
  710   1HZ   LYS  88          1HZ       LYS  88   4.438  10.722   3.282
  711   2HZ   LYS  88          2HZ       LYS  88   4.310  11.114   4.930
  712   3HZ   LYS  88          3HZ       LYS  88   4.367  12.347   3.763
  713    H    GLU  89           H        GLU  89  -2.689  14.568   2.262
  714    HA   GLU  89           HA       GLU  89  -4.177  12.861   3.999
  715   1HB   GLU  89          2HB       GLU  89  -4.618  15.328   3.104
  716   2HB   GLU  89          1HB       GLU  89  -5.590  14.466   1.911
  717   1HG   GLU  89          2HG       GLU  89  -7.002  13.531   3.566
  718   2HG   GLU  89          1HG       GLU  89  -5.863  13.895   4.863
  719    H    GLU  90           H        GLU  90  -4.036  13.047   0.439
  720    HA   GLU  90           HA       GLU  90  -5.997  10.988  -0.001
  721   1HB   GLU  90          2HB       GLU  90  -3.770  12.100  -1.722
  722   2HB   GLU  90          1HB       GLU  90  -4.893  10.867  -2.296
  723   1HG   GLU  90          2HG       GLU  90  -5.767  13.530  -1.143
  724   2HG   GLU  90          1HG       GLU  90  -5.581  13.222  -2.871
  725    H    ARG  91           H        ARG  91  -2.442  10.927   0.209
  726    HA   ARG  91           HA       ARG  91  -2.115   8.171  -0.447
  727   1HB   ARG  91          2HB       ARG  91  -0.473  10.327   0.512
  728   2HB   ARG  91          1HB       ARG  91  -0.140   8.882   1.467
  729   1HG   ARG  91          2HG       ARG  91   1.066   8.052  -0.237
  730   2HG   ARG  91          1HG       ARG  91  -0.379   8.065  -1.249
  731   1HD   ARG  91          2HD       ARG  91   0.499  10.751  -1.081
  732   2HD   ARG  91          1HD       ARG  91   1.935   9.777  -1.397
  733    HE   ARG  91           HE       ARG  91   1.089   9.776  -3.600
  734   1HH1  ARG  91          1HH2      ARG  91  -1.584  10.740  -1.965
  735   2HH1  ARG  91          2HH2      ARG  91  -2.727   9.764  -2.827
  736   1HH2  ARG  91          1HH1      ARG  91  -0.302   7.873  -4.431
  737   2HH2  ARG  91          2HH1      ARG  91  -2.001   8.141  -4.223
  738    H    ALA  92           H        ALA  92  -2.765   9.791   2.643
  739    HA   ALA  92           HA       ALA  92  -2.419   7.519   4.323
  740   1HB   ALA  92          1HB       ALA  92  -2.592   9.621   5.411
  741   2HB   ALA  92          2HB       ALA  92  -4.087   8.784   5.826
  742   3HB   ALA  92          3HB       ALA  92  -4.089  10.023   4.572
  743    H    ASP  93           H        ASP  93  -5.394   8.829   2.823
  744    HA   ASP  93           HA       ASP  93  -7.120   6.769   3.755
  745   1HB   ASP  93          2HB       ASP  93  -7.242   8.562   1.320
  746   2HB   ASP  93          1HB       ASP  93  -8.534   7.436   1.739
  747    H    LEU  94           H        LEU  94  -4.795   6.853   1.159
  748    HA   LEU  94           HA       LEU  94  -5.840   4.611  -0.330
  749   1HB   LEU  94          2HB       LEU  94  -3.160   5.983  -0.187
  750   2HB   LEU  94          1HB       LEU  94  -3.365   4.505  -1.128
  751    HG   LEU  94           HG       LEU  94  -5.063   6.995  -1.458
  752   1HD1  LEU  94          1HD1      LEU  94  -3.158   7.754  -2.467
  753   2HD1  LEU  94          2HD1      LEU  94  -3.688   6.711  -3.786
  754   3HD1  LEU  94          3HD1      LEU  94  -2.481   6.134  -2.637
  755   1HD2  LEU  94          1HD2      LEU  94  -5.234   4.240  -2.412
  756   2HD2  LEU  94          2HD2      LEU  94  -5.164   5.393  -3.745
  757   3HD2  LEU  94          3HD2      LEU  94  -6.426   5.536  -2.523
  758    H    ILE  95           H        ILE  95  -3.146   4.864   2.012
  759    HA   ILE  95           HA       ILE  95  -2.583   2.069   2.106
  760    HB   ILE  95           HB       ILE  95  -2.232   3.902   4.474
  761   1HG1  ILE  95          2HG1      ILE  95  -1.472   5.317   2.739
  762   2HG1  ILE  95          1HG1      ILE  95  -0.009   4.493   3.276
  763   1HG2  ILE  95          1HG2      ILE  95  -1.503   1.612   4.782
  764   2HG2  ILE  95          2HG2      ILE  95  -0.067   2.616   4.587
  765   3HG2  ILE  95          3HG2      ILE  95  -0.643   1.633   3.242
  766   1HD1  ILE  95          1HD1      ILE  95  -1.615   4.056   0.774
  767   2HD1  ILE  95          2HD1      ILE  95  -0.651   2.735   1.435
  768   3HD1  ILE  95          3HD1      ILE  95   0.130   4.243   0.957
  769    H    ALA  96           H        ALA  96  -4.614   4.086   4.232
  770    HA   ALA  96           HA       ALA  96  -5.427   2.092   6.039
  771   1HB   ALA  96          1HB       ALA  96  -6.099   4.739   5.586
  772   2HB   ALA  96          2HB       ALA  96  -6.813   3.703   6.822
  773   3HB   ALA  96          3HB       ALA  96  -7.609   3.889   5.260
  774    H    TYR  97           H        TYR  97  -6.878   2.948   2.886
  775    HA   TYR  97           HA       TYR  97  -9.019   1.080   3.024
  776   1HB   TYR  97          2HB       TYR  97  -9.015   2.822   1.328
  777   2HB   TYR  97          1HB       TYR  97  -7.536   2.173   0.616
  778    HD1  TYR  97           HD1      TYR  97  -7.908   1.036  -1.378
  779    HD2  TYR  97           HD2      TYR  97 -10.800   0.722   1.782
  780    HE1  TYR  97           HE1      TYR  97  -9.250  -0.527  -2.762
  781    HE2  TYR  97           HE2      TYR  97 -12.143  -0.839   0.398
  782    HH   TYR  97           HH       TYR  97 -11.631  -1.271  -2.911
  783    H    LEU  98           H        LEU  98  -5.723   0.761   1.696
  784    HA   LEU  98           HA       LEU  98  -6.170  -2.061   1.038
  785   1HB   LEU  98          2HB       LEU  98  -3.893  -0.129   0.803
  786   2HB   LEU  98          1HB       LEU  98  -3.537  -1.855   0.770
  787    HG   LEU  98           HG       LEU  98  -3.895  -1.045  -1.511
  788   1HD1  LEU  98          1HD1      LEU  98  -4.819  -3.312  -0.645
  789   2HD1  LEU  98          2HD1      LEU  98  -5.400  -2.723  -2.203
  790   3HD1  LEU  98          3HD1      LEU  98  -6.403  -2.543  -0.763
  791   1HD2  LEU  98          1HD2      LEU  98  -5.742   0.653  -0.335
  792   2HD2  LEU  98          2HD2      LEU  98  -6.762  -0.504  -1.190
  793   3HD2  LEU  98          3HD2      LEU  98  -5.540   0.412  -2.070
  794    H    LYS  99           H        LYS  99  -5.650  -0.439   3.891
  795    HA   LYS  99           HA       LYS  99  -3.937  -2.531   5.063
  796   1HB   LYS  99          2HB       LYS  99  -3.697   0.029   5.486
  797   2HB   LYS  99          1HB       LYS  99  -5.062  -0.193   6.581
  798   1HG   LYS  99          2HG       LYS  99  -3.113  -2.285   6.999
  799   2HG   LYS  99          1HG       LYS  99  -2.340  -0.705   7.127
  800   1HD   LYS  99          2HD       LYS  99  -4.956  -1.280   8.518
  801   2HD   LYS  99          1HD       LYS  99  -3.411  -1.684   9.268
  802   1HE   LYS  99          2HE       LYS  99  -2.741   0.759   8.733
  803   2HE   LYS  99          1HE       LYS  99  -4.468   1.033   8.502
  804   1HZ   LYS  99          1HZ       LYS  99  -2.987   0.465  10.942
  805   2HZ   LYS  99          2HZ       LYS  99  -4.512  -0.271  10.802
  806   3HZ   LYS  99          3HZ       LYS  99  -4.370   1.420  10.709
  807    H    LYS 100           H        LYS 100  -7.238  -1.748   4.717
  808    HA   LYS 100           HA       LYS 100  -7.913  -3.589   6.982
  809   1HB   LYS 100          2HB       LYS 100  -8.688  -0.998   6.817
  810   2HB   LYS 100          1HB       LYS 100 -10.006  -1.766   5.931
  811   1HG   LYS 100          2HG       LYS 100 -10.620  -3.112   7.777
  812   2HG   LYS 100          1HG       LYS 100  -9.090  -2.820   8.606
  813   1HD   LYS 100          2HD       LYS 100 -11.026  -1.517   9.555
  814   2HD   LYS 100          1HD       LYS 100  -9.681  -0.509   9.016
  815   1HE   LYS 100          2HE       LYS 100 -10.977   0.528   7.491
  816   2HE   LYS 100          1HE       LYS 100 -11.528  -1.013   6.835
  817   1HZ   LYS 100          1HZ       LYS 100 -13.482  -0.357   7.685
  818   2HZ   LYS 100          2HZ       LYS 100 -12.776   0.720   8.792
  819   3HZ   LYS 100          3HZ       LYS 100 -12.849  -0.940   9.147
  820    H    ALA 101           H        ALA 101  -8.767  -2.573   3.687
  821    HA   ALA 101           HA       ALA 101 -10.730  -4.668   3.341
  822   1HB   ALA 101          1HB       ALA 101 -11.116  -2.865   1.917
  823   2HB   ALA 101          2HB       ALA 101 -10.309  -3.999   0.834
  824   3HB   ALA 101          3HB       ALA 101  -9.404  -2.665   1.548
  825    H    THR 102           H        THR 102  -7.275  -4.349   2.654
  826    HA   THR 102           HA       THR 102  -7.315  -7.215   1.794
  827    HB   THR 102           HB       THR 102  -5.093  -6.234   0.550
  828    HG1  THR 102           HG1      THR 102  -7.095  -4.262   0.244
  829   1HG2  THR 102          1HG2      THR 102  -7.825  -6.063  -0.719
  830   2HG2  THR 102          2HG2      THR 102  -7.091  -7.612  -0.306
  831   3HG2  THR 102          3HG2      THR 102  -6.301  -6.543  -1.465
  832    H    ASN 103           H        ASN 103  -6.687  -5.781   4.430
  833    HA   ASN 103           HA       ASN 103  -4.210  -7.278   4.923
  834   1HB   ASN 103          2HB       ASN 103  -3.407  -5.031   4.307
  835   2HB   ASN 103          1HB       ASN 103  -4.449  -4.322   5.540
  836   1HD2  ASN 103          1HD2      ASN 103  -2.602  -7.357   5.907
  837   2HD2  ASN 103          2HD2      ASN 103  -1.591  -6.782   7.142
  838    H    GLU 104           HN       GLU 104  -7.222  -6.957   5.759
  839    HA   GLU 104           HA       GLU 104  -6.756  -7.766   8.526
  840   1HB   GLU 104          2HB       GLU 104  -7.259  -5.024   7.991
  841   2HB   GLU 104          1HB       GLU 104  -8.741  -5.689   8.679
  842   1HG   GLU 104          2HG       GLU 104  -7.077  -6.818  10.391
  843   2HG   GLU 104          1HG       GLU 104  -6.003  -5.511   9.891
  844    HHA  HEC 105           HHA      HEC 105   4.148  -2.515  -9.036
  845    HHB  HEC 105           HHB      HEC 105   1.089   1.255  -4.999
  846    HHC  HEC 105           HHC      HEC 105  -2.052   3.881  -9.819
  847    HHD  HEC 105           HHD      HEC 105   1.088   0.173 -13.858
  848   1HMA  HEC 105          1HMA      HEC 105   2.015  -0.411  -3.872
  849   2HMA  HEC 105          2HMA      HEC 105   3.672   0.162  -4.065
  850   3HMA  HEC 105          3HMA      HEC 105   3.341  -1.568  -3.990
  851   1HAA  HEC 105          1HAA      HEC 105   4.988  -2.216  -5.464
  852   2HAA  HEC 105          2HAA      HEC 105   5.165  -2.575  -7.170
  853   1HBA  HEC 105          1HBA      HEC 105   2.924  -3.953  -6.738
  854   2HBA  HEC 105          2HBA      HEC 105   3.558  -3.986  -5.093
  855   1HMB  HEC 105          1HMB      HEC 105  -1.840   2.812  -4.476
  856   2HMB  HEC 105          2HMB      HEC 105  -0.760   4.201  -4.597
  857   3HMB  HEC 105          3HMB      HEC 105  -0.108   2.608  -4.216
  858    HAB  HEC 105           HAB      HEC 105  -2.624   4.897  -8.122
  859   1HBB  HEC 105          1HBB      HEC 105  -2.756   6.447  -6.415
  860   2HBB  HEC 105          2HBB      HEC 105  -1.059   5.966  -6.463
  861   3HBB  HEC 105          3HBB      HEC 105  -2.124   5.322  -5.215
  862   1HMC  HEC 105          1HMC      HEC 105  -1.989   4.641 -12.987
  863   2HMC  HEC 105          2HMC      HEC 105  -3.144   3.330 -13.221
  864   3HMC  HEC 105          3HMC      HEC 105  -2.964   4.073 -11.632
  865    HAC  HEC 105           HAC      HEC 105  -0.082   1.566 -15.018
  866   1HBC  HEC 105          1HBC      HEC 105  -2.539   3.194 -15.096
  867   2HBC  HEC 105          2HBC      HEC 105  -1.169   3.129 -16.203
  868   3HBC  HEC 105          3HBC      HEC 105  -1.018   3.974 -14.663
  869   1HMD  HEC 105          1HMD      HEC 105   4.089  -1.768 -14.273
  870   2HMD  HEC 105          2HMD      HEC 105   2.581  -2.676 -14.341
  871   3HMD  HEC 105          3HMD      HEC 105   2.578  -0.941 -14.647
  872   1HAD  HEC 105          1HAD      HEC 105   5.444  -2.643 -11.977
  873   2HAD  HEC 105          2HAD      HEC 105   4.654  -3.527 -10.682
  874   1HBD  HEC 105          1HBD      HEC 105   3.339  -3.924 -13.254
  875   2HBD  HEC 105          2HBD      HEC 105   3.913  -5.115 -12.091
  Start of MODEL   19
    1   1H    GLY   1          1HT       GLY   1  -7.221   8.680   8.179
    2   2H    GLY   1          2HT       GLY   1  -7.550   8.311   6.553
    3   3H    GLY   1          3HT       GLY   1  -8.419   7.542   7.795
    4   1HA   GLY   1          1HA       GLY   1  -8.867  10.158   8.320
    5   2HA   GLY   1          2HA       GLY   1  -8.859  10.097   6.555
    6    H    ASP   2           H        ASP   2 -10.451   8.811   5.490
    7    HA   ASP   2           HA       ASP   2 -12.658   7.866   7.276
    8   1HB   ASP   2          2HB       ASP   2 -12.886   9.968   5.596
    9   2HB   ASP   2          1HB       ASP   2 -13.293   8.662   4.482
   10    H    VAL   3           H        VAL   3 -14.083   6.213   6.064
   11    HA   VAL   3           HA       VAL   3 -12.259   4.267   4.746
   12    HB   VAL   3           HB       VAL   3 -14.913   4.004   6.166
   13   1HG1  VAL   3          1HG1      VAL   3 -14.628   1.522   5.649
   14   2HG1  VAL   3          2HG1      VAL   3 -13.452   2.005   4.427
   15   3HG1  VAL   3          3HG1      VAL   3 -15.129   2.530   4.293
   16   1HG2  VAL   3          1HG2      VAL   3 -12.151   3.718   6.878
   17   2HG2  VAL   3          2HG2      VAL   3 -12.913   2.129   6.957
   18   3HG2  VAL   3          3HG2      VAL   3 -13.572   3.470   7.894
   19    H    GLU   4           H        GLU   4 -15.476   5.749   4.352
   20    HA   GLU   4           HA       GLU   4 -16.039   4.507   1.824
   21   1HB   GLU   4          2HB       GLU   4 -17.466   6.066   3.572
   22   2HB   GLU   4          1HB       GLU   4 -17.179   7.193   2.246
   23   1HG   GLU   4          2HG       GLU   4 -18.359   4.413   1.964
   24   2HG   GLU   4          1HG       GLU   4 -19.268   5.923   1.893
   25    H    LYS   5           H        LYS   5 -13.824   6.959   2.674
   26    HA   LYS   5           HA       LYS   5 -13.890   8.204  -0.011
   27   1HB   LYS   5          2HB       LYS   5 -12.740   8.876   2.622
   28   2HB   LYS   5          1HB       LYS   5 -11.709   9.282   1.249
   29   1HG   LYS   5          2HG       LYS   5 -13.818  10.331   0.202
   30   2HG   LYS   5          1HG       LYS   5 -14.521  10.227   1.816
   31   1HD   LYS   5          2HD       LYS   5 -12.790  11.625   2.743
   32   2HD   LYS   5          1HD       LYS   5 -11.866  11.569   1.242
   33   1HE   LYS   5          2HE       LYS   5 -13.341  12.989   0.123
   34   2HE   LYS   5          1HE       LYS   5 -14.685  12.604   1.198
   35   1HZ   LYS   5          1HZ       LYS   5 -14.058  14.683   1.913
   36   2HZ   LYS   5          2HZ       LYS   5 -12.402  14.406   1.651
   37   3HZ   LYS   5          3HZ       LYS   5 -13.188  13.691   2.976
   38    H    GLY   6           H        GLY   6 -11.450   6.562   2.045
   39   1HA   GLY   6          1HA       GLY   6  -9.442   6.331   0.070
   40   2HA   GLY   6          2HA       GLY   6  -9.633   5.210   1.419
   41    H    LYS   7           H        LYS   7 -12.372   4.462   0.559
   42    HA   LYS   7           HA       LYS   7 -11.655   2.276  -1.188
   43   1HB   LYS   7          2HB       LYS   7 -13.442   1.958   0.404
   44   2HB   LYS   7          1HB       LYS   7 -14.331   3.336  -0.246
   45   1HG   LYS   7          2HG       LYS   7 -14.643   2.180  -2.375
   46   2HG   LYS   7          1HG       LYS   7 -13.672   0.823  -1.805
   47   1HD   LYS   7          2HD       LYS   7 -15.425   0.835   0.187
   48   2HD   LYS   7          1HD       LYS   7 -16.443   1.632  -1.011
   49   1HE   LYS   7          2HE       LYS   7 -14.969  -0.940  -1.602
   50   2HE   LYS   7          1HE       LYS   7 -16.598  -0.920  -0.925
   51   1HZ   LYS   7          1HZ       LYS   7 -15.677   0.021  -3.559
   52   2HZ   LYS   7          2HZ       LYS   7 -17.089   0.667  -2.869
   53   3HZ   LYS   7          3HZ       LYS   7 -16.978  -1.000  -3.185
   54    H    LYS   8           H        LYS   8 -13.582   5.246  -1.675
   55    HA   LYS   8           HA       LYS   8 -14.071   4.717  -4.471
   56   1HB   LYS   8          2HB       LYS   8 -14.163   7.307  -2.892
   57   2HB   LYS   8          1HB       LYS   8 -14.766   7.112  -4.538
   58   1HG   LYS   8          2HG       LYS   8 -15.746   5.128  -2.561
   59   2HG   LYS   8          1HG       LYS   8 -16.322   6.781  -2.343
   60   1HD   LYS   8          2HD       LYS   8 -17.541   6.757  -4.278
   61   2HD   LYS   8          1HD       LYS   8 -16.367   5.751  -5.127
   62   1HE   LYS   8          2HE       LYS   8 -17.143   3.771  -3.915
   63   2HE   LYS   8          1HE       LYS   8 -18.267   4.758  -2.982
   64   1HZ   LYS   8          1HZ       LYS   8 -19.045   5.453  -5.371
   65   2HZ   LYS   8          2HZ       LYS   8 -19.634   4.040  -4.633
   66   3HZ   LYS   8          3HZ       LYS   8 -18.394   3.943  -5.791
   67    H    ILE   9           H        ILE   9 -11.374   5.933  -2.702
   68    HA   ILE   9           HA       ILE   9 -10.203   7.477  -4.863
   69    HB   ILE   9           HB       ILE   9  -9.056   6.279  -2.328
   70   1HG1  ILE   9          2HG1      ILE   9 -10.626   8.215  -2.138
   71   2HG1  ILE   9          1HG1      ILE   9  -8.993   8.614  -1.605
   72   1HG2  ILE   9          1HG2      ILE   9  -7.714   8.012  -4.426
   73   2HG2  ILE   9          2HG2      ILE   9  -7.281   6.353  -4.010
   74   3HG2  ILE   9          3HG2      ILE   9  -7.035   7.650  -2.840
   75   1HD1  ILE   9          1HD1      ILE   9  -8.605   9.420  -4.030
   76   2HD1  ILE   9          2HD1      ILE   9  -9.605  10.433  -2.989
   77   3HD1  ILE   9          3HD1      ILE   9 -10.361   9.379  -4.184
   78    H    PHE  10           H        PHE  10  -9.126   4.376  -3.406
   79    HA   PHE  10           HA       PHE  10  -7.370   3.601  -5.445
   80   1HB   PHE  10          2HB       PHE  10  -7.812   2.373  -3.262
   81   2HB   PHE  10          1HB       PHE  10  -9.245   1.687  -4.027
   82    HD1  PHE  10           HD1      PHE  10  -8.874   0.560  -6.367
   83    HD2  PHE  10           HD2      PHE  10  -5.749   1.286  -3.511
   84    HE1  PHE  10           HE1      PHE  10  -7.473  -1.170  -7.460
   85    HE2  PHE  10           HE2      PHE  10  -4.348  -0.444  -4.605
   86    HZ   PHE  10           HZ       PHE  10  -5.210  -1.672  -6.580
   87    H    ILE  11           H        ILE  11 -10.897   3.158  -5.268
   88    HA   ILE  11           HA       ILE  11 -11.251   1.653  -7.636
   89    HB   ILE  11           HB       ILE  11 -13.001   3.737  -6.312
   90   1HG1  ILE  11          2HG1      ILE  11 -13.184   0.712  -6.489
   91   2HG1  ILE  11          1HG1      ILE  11 -12.572   1.604  -5.095
   92   1HG2  ILE  11          1HG2      ILE  11 -13.503   3.598  -8.743
   93   2HG2  ILE  11          2HG2      ILE  11 -14.818   2.953  -7.759
   94   3HG2  ILE  11          3HG2      ILE  11 -13.710   1.855  -8.583
   95   1HD1  ILE  11          1HD1      ILE  11 -15.291   2.244  -6.208
   96   2HD1  ILE  11          2HD1      ILE  11 -14.675   2.491  -4.574
   97   3HD1  ILE  11          3HD1      ILE  11 -15.084   0.866  -5.127
   98    H    MET  12           H        MET  12 -11.010   5.176  -7.165
   99    HA   MET  12           HA       MET  12 -10.902   5.483 -10.135
  100   1HB   MET  12          2HB       MET  12 -11.451   7.830  -9.764
  101   2HB   MET  12          1HB       MET  12 -12.614   6.817  -8.908
  102   1HG   MET  12          2HG       MET  12 -12.106   8.200  -7.160
  103   2HG   MET  12          1HG       MET  12 -10.743   7.097  -6.972
  104   1HE   MET  12          1HE       MET  12 -12.274  10.109  -7.952
  105   2HE   MET  12          2HE       MET  12 -11.356  10.619  -9.368
  106   3HE   MET  12          3HE       MET  12 -11.036  11.365  -7.805
  107    H    LYS  13           H        LYS  13  -8.645   4.731  -8.121
  108    HA   LYS  13           HA       LYS  13  -6.776   6.885  -9.036
  109   1HB   LYS  13          2HB       LYS  13  -7.345   6.476  -6.436
  110   2HB   LYS  13          1HB       LYS  13  -6.058   5.285  -6.629
  111   1HG   LYS  13          2HG       LYS  13  -4.649   7.025  -6.285
  112   2HG   LYS  13          1HG       LYS  13  -5.031   7.477  -7.947
  113   1HD   LYS  13          2HD       LYS  13  -7.149   8.420  -6.282
  114   2HD   LYS  13          1HD       LYS  13  -5.623   8.916  -5.548
  115   1HE   LYS  13          2HE       LYS  13  -6.044  10.662  -7.053
  116   2HE   LYS  13          1HE       LYS  13  -4.969   9.614  -7.980
  117   1HZ   LYS  13          1HZ       LYS  13  -7.682  10.308  -8.484
  118   2HZ   LYS  13          2HZ       LYS  13  -7.485   8.622  -8.419
  119   3HZ   LYS  13          3HZ       LYS  13  -6.560   9.548  -9.503
  120    H    CYS  14           H        CYS  14  -6.798   3.481  -7.889
  121    HA   CYS  14           HA       CYS  14  -4.905   2.874 -10.118
  122   1HB   CYS  14          2HB       CYS  14  -4.390   1.171  -7.824
  123   2HB   CYS  14          1HB       CYS  14  -3.261   2.175  -8.727
  124    H    SER  15           H        SER  15  -7.849   2.453  -9.635
  125    HA   SER  15           HA       SER  15  -8.143  -0.435  -9.260
  126   1HB   SER  15          2HB       SER  15  -9.856   1.533  -8.818
  127   2HB   SER  15          1HB       SER  15 -10.262   1.278 -10.511
  128    HG   SER  15           HG       SER  15 -11.528  -0.041  -9.160
  129    H    GLN  16           H        GLN  16  -6.840   1.286 -11.704
  130    HA   GLN  16           HA       GLN  16  -8.086  -0.310 -13.882
  131   1HB   GLN  16          2HB       GLN  16  -7.934   2.030 -14.418
  132   2HB   GLN  16          1HB       GLN  16  -6.255   2.106 -13.885
  133   1HG   GLN  16          2HG       GLN  16  -5.615   1.632 -15.988
  134   2HG   GLN  16          1HG       GLN  16  -6.375   0.050 -15.823
  135   1HE2  GLN  16          1HE2      GLN  16  -7.045   3.424 -16.821
  136   2HE2  GLN  16          2HE2      GLN  16  -8.359   3.034 -17.822
  137    H    CYS  17           H        CYS  17  -4.810   0.669 -12.808
  138    HA   CYS  17           HA       CYS  17  -3.628  -1.616 -14.218
  139   1HB   CYS  17          2HB       CYS  17  -2.538   0.630 -12.523
  140   2HB   CYS  17          1HB       CYS  17  -1.521  -0.742 -12.958
  141    H    HIS  18           H        HIS  18  -4.935  -0.985 -11.083
  142    HA   HIS  18           HA       HIS  18  -3.754  -3.569 -10.140
  143   1HB   HIS  18          2HB       HIS  18  -4.366  -1.078  -8.535
  144   2HB   HIS  18          1HB       HIS  18  -3.953  -2.636  -7.820
  145    HD1  HIS  18           HD1      HIS  18  -1.501  -3.321  -7.825
  146    HD2  HIS  18           HD2      HIS  18  -2.221   0.112 -10.058
  147    HE1  HIS  18           HE1      HIS  18   0.764  -2.343  -8.399
  148    H    THR  19           H        THR  19  -5.699  -4.617 -10.982
  149    HA   THR  19           HA       THR  19  -8.296  -3.853  -9.866
  150    HB   THR  19           HB       THR  19  -9.000  -6.073 -10.933
  151    HG1  THR  19           HG1      THR  19  -6.472  -5.930 -12.163
  152   1HG2  THR  19          1HG2      THR  19  -8.220  -5.060 -13.314
  153   2HG2  THR  19          2HG2      THR  19  -7.921  -3.662 -12.281
  154   3HG2  THR  19          3HG2      THR  19  -9.534  -4.371 -12.361
  155    H    VAL  20           H        VAL  20  -7.655  -3.977  -7.585
  156    HA   VAL  20           HA       VAL  20  -6.841  -6.543  -6.461
  157    HB   VAL  20           HB       VAL  20  -6.845  -5.411  -4.351
  158   1HG1  VAL  20          1HG1      VAL  20  -5.092  -4.687  -5.963
  159   2HG1  VAL  20          2HG1      VAL  20  -5.529  -3.406  -4.832
  160   3HG1  VAL  20          3HG1      VAL  20  -6.146  -3.372  -6.484
  161   1HG2  VAL  20          1HG2      VAL  20  -8.561  -3.336  -5.749
  162   2HG2  VAL  20          2HG2      VAL  20  -7.888  -3.138  -4.130
  163   3HG2  VAL  20          3HG2      VAL  20  -9.065  -4.412  -4.446
  164    H    GLU  21           H        GLU  21  -9.670  -5.882  -7.810
  165    HA   GLU  21           HA       GLU  21 -11.150  -7.465  -5.766
  166   1HB   GLU  21          2HB       GLU  21 -13.178  -6.067  -6.234
  167   2HB   GLU  21          1HB       GLU  21 -11.881  -5.164  -5.453
  168   1HG   GLU  21          2HG       GLU  21 -11.426  -3.917  -7.330
  169   2HG   GLU  21          1HG       GLU  21 -11.883  -5.216  -8.432
  170    H    LYS  22           H        LYS  22  -9.871  -7.993  -8.476
  171    HA   LYS  22           HA       LYS  22 -12.290  -8.701 -10.055
  172   1HB   LYS  22          2HB       LYS  22 -10.105  -7.566 -10.987
  173   2HB   LYS  22          1HB       LYS  22  -9.479  -9.213 -10.977
  174   1HG   LYS  22          2HG       LYS  22 -12.185  -8.998 -12.100
  175   2HG   LYS  22          1HG       LYS  22 -10.969  -8.103 -13.014
  176   1HD   LYS  22          2HD       LYS  22  -9.652 -10.047 -13.373
  177   2HD   LYS  22          1HD       LYS  22 -10.519 -10.958 -12.137
  178   1HE   LYS  22          2HE       LYS  22 -12.574 -10.275 -13.790
  179   2HE   LYS  22          1HE       LYS  22 -11.256 -10.429 -14.952
  180   1HZ   LYS  22          1HZ       LYS  22 -11.642 -12.501 -12.900
  181   2HZ   LYS  22          2HZ       LYS  22 -10.936 -12.631 -14.440
  182   3HZ   LYS  22          3HZ       LYS  22 -12.623 -12.504 -14.284
  183    H    GLY  23           H        GLY  23  -9.326 -10.208  -8.746
  184   1HA   GLY  23          2HA       GLY  23 -10.075 -12.436  -7.551
  185   2HA   GLY  23          1HA       GLY  23 -10.564 -12.876  -9.188
  186    H    GLY  24           H        GLY  24  -7.702 -11.564  -7.478
  187   1HA   GLY  24          1HA       GLY  24  -5.419 -11.996  -7.808
  188   2HA   GLY  24          2HA       GLY  24  -5.931 -13.630  -8.238
  189    H    LYS  25           H        LYS  25  -7.191 -10.975 -10.083
  190    HA   LYS  25           HA       LYS  25  -5.613 -11.929 -12.416
  191   1HB   LYS  25          2HB       LYS  25  -8.189 -11.691 -12.415
  192   2HB   LYS  25          1HB       LYS  25  -7.891  -9.954 -12.517
  193   1HG   LYS  25          2HG       LYS  25  -8.167 -10.967 -14.765
  194   2HG   LYS  25          1HG       LYS  25  -6.555 -10.283 -14.550
  195   1HD   LYS  25          2HD       LYS  25  -5.583 -12.293 -14.841
  196   2HD   LYS  25          1HD       LYS  25  -6.634 -13.035 -13.635
  197   1HE   LYS  25          2HE       LYS  25  -8.380 -13.381 -15.272
  198   2HE   LYS  25          1HE       LYS  25  -7.494 -12.452 -16.481
  199   1HZ   LYS  25          1HZ       LYS  25  -5.821 -14.096 -16.584
  200   2HZ   LYS  25          2HZ       LYS  25  -7.301 -14.923 -16.674
  201   3HZ   LYS  25          3HZ       LYS  25  -6.419 -14.910 -15.222
  202    H    HIS  26           H        HIS  26  -4.229 -10.560 -13.534
  203    HA   HIS  26           HA       HIS  26  -4.076  -7.718 -12.673
  204   1HB   HIS  26          2HB       HIS  26  -1.434  -8.279 -12.946
  205   2HB   HIS  26          1HB       HIS  26  -2.269  -8.304 -11.395
  206    HD1  HIS  26           HD1      HIS  26  -2.503 -10.926 -14.140
  207    HD2  HIS  26           HD2      HIS  26  -1.078 -10.543 -10.241
  208    HE1  HIS  26           HE1      HIS  26  -1.801 -13.245 -13.403
  209    H    LYS  27           H        LYS  27  -3.893  -6.414 -14.440
  210    HA   LYS  27           HA       LYS  27  -3.134  -7.693 -17.005
  211   1HB   LYS  27          2HB       LYS  27  -5.287  -5.965 -16.271
  212   2HB   LYS  27          1HB       LYS  27  -4.258  -5.101 -17.414
  213   1HG   LYS  27          2HG       LYS  27  -5.895  -6.347 -18.689
  214   2HG   LYS  27          1HG       LYS  27  -4.332  -7.137 -18.900
  215   1HD   LYS  27          2HD       LYS  27  -5.970  -8.860 -18.459
  216   2HD   LYS  27          1HD       LYS  27  -4.960  -8.698 -17.021
  217   1HE   LYS  27          2HE       LYS  27  -6.802  -8.288 -15.801
  218   2HE   LYS  27          1HE       LYS  27  -7.080  -6.828 -16.751
  219   1HZ   LYS  27          1HZ       LYS  27  -8.947  -8.444 -16.780
  220   2HZ   LYS  27          2HZ       LYS  27  -7.938  -9.538 -17.601
  221   3HZ   LYS  27          3HZ       LYS  27  -8.351  -8.056 -18.320
  222    H    THR  28           H        THR  28  -3.077  -4.313 -15.852
  223    HA   THR  28           HA       THR  28  -0.397  -4.014 -17.085
  224    HB   THR  28           HB       THR  28  -2.253  -1.958 -15.843
  225    HG1  THR  28           HG1      THR  28  -1.692  -2.720 -18.513
  226   1HG2  THR  28          1HG2      THR  28   0.162  -1.347 -15.781
  227   2HG2  THR  28          2HG2      THR  28  -0.772  -0.307 -16.858
  228   3HG2  THR  28          3HG2      THR  28   0.240  -1.588 -17.527
  229    H    GLY  29           H        GLY  29  -1.971  -3.241 -13.966
  230   1HA   GLY  29          2HA       GLY  29   0.682  -3.086 -12.671
  231   2HA   GLY  29          1HA       GLY  29  -0.853  -2.673 -11.917
  232    HA   PRO  30           HA       PRO  30   0.536  -7.138 -10.948
  233   1HB   PRO  30          2HB       PRO  30   1.633  -6.703  -8.479
  234   2HB   PRO  30          1HB       PRO  30   2.574  -6.731  -9.974
  235   1HG   PRO  30          2HG       PRO  30   1.674  -4.362  -8.367
  236   2HG   PRO  30          1HG       PRO  30   3.161  -4.582  -9.308
  237   1HD   PRO  30          2HD       PRO  30   0.972  -3.125 -10.202
  238   2HD   PRO  30          1HD       PRO  30   2.178  -3.873 -11.264
  239    H    ASN  31           H        ASN  31  -1.054  -8.340  -9.974
  240    HA   ASN  31           HA       ASN  31  -3.411  -7.273  -8.947
  241   1HB   ASN  31          2HB       ASN  31  -3.194  -9.638  -9.559
  242   2HB   ASN  31          1HB       ASN  31  -2.118  -9.910  -8.188
  243   1HD2  ASN  31          1HD2      ASN  31  -5.283  -8.186  -8.540
  244   2HD2  ASN  31          2HD2      ASN  31  -6.028  -9.001  -7.252
  245    H    LEU  32           H        LEU  32  -3.239  -5.671  -7.403
  246    HA   LEU  32           HA       LEU  32  -1.536  -6.013  -5.062
  247   1HB   LEU  32          2HB       LEU  32  -2.961  -3.844  -6.360
  248   2HB   LEU  32          1HB       LEU  32  -3.256  -3.842  -4.623
  249    HG   LEU  32           HG       LEU  32  -0.972  -3.593  -4.107
  250   1HD1  LEU  32          1HD1      LEU  32   0.324  -5.089  -5.250
  251   2HD1  LEU  32          2HD1      LEU  32   0.616  -3.709  -6.310
  252   3HD1  LEU  32          3HD1      LEU  32  -0.604  -4.907  -6.738
  253   1HD2  LEU  32          1HD2      LEU  32  -2.036  -1.957  -6.298
  254   2HD2  LEU  32          2HD2      LEU  32  -0.274  -1.953  -6.227
  255   3HD2  LEU  32          3HD2      LEU  32  -1.214  -1.455  -4.821
  256    H    HIS  33           H        HIS  33  -3.436  -8.088  -5.193
  257    HA   HIS  33           HA       HIS  33  -5.511  -7.341  -3.198
  258   1HB   HIS  33          2HB       HIS  33  -5.732  -8.886  -5.419
  259   2HB   HIS  33          1HB       HIS  33  -5.357 -10.124  -4.218
  260    HD1  HIS  33           HD1      HIS  33  -7.956 -10.829  -4.718
  261    HD2  HIS  33           HD2      HIS  33  -7.360  -7.261  -2.644
  262    HE1  HIS  33           HE1      HIS  33 -10.166 -10.262  -3.617
  263    H    GLY  34           H        GLY  34  -3.780  -7.117  -1.543
  264   1HA   GLY  34          2HA       GLY  34  -3.383  -8.411   0.561
  265   2HA   GLY  34          1HA       GLY  34  -2.973  -9.789  -0.463
  266    H    LEU  35           H        LEU  35  -1.917  -6.767  -1.656
  267    HA   LEU  35           HA       LEU  35   0.814  -7.434  -1.744
  268   1HB   LEU  35          2HB       LEU  35  -0.121  -5.601  -3.067
  269   2HB   LEU  35          1HB       LEU  35  -0.465  -4.689  -1.597
  270    HG   LEU  35           HG       LEU  35   2.272  -5.446  -1.484
  271   1HD1  LEU  35          1HD1      LEU  35   2.021  -5.759  -3.968
  272   2HD1  LEU  35          2HD1      LEU  35   3.174  -4.502  -3.522
  273   3HD1  LEU  35          3HD1      LEU  35   1.563  -4.060  -4.085
  274   1HD2  LEU  35          1HD2      LEU  35   0.776  -2.854  -1.930
  275   2HD2  LEU  35          2HD2      LEU  35   2.529  -2.906  -1.747
  276   3HD2  LEU  35          3HD2      LEU  35   1.489  -3.452  -0.431
  277    H    PHE  36           H        PHE  36  -1.063  -5.984   0.849
  278    HA   PHE  36           HA       PHE  36   1.137  -5.032   2.418
  279   1HB   PHE  36          2HB       PHE  36  -1.702  -5.819   3.056
  280   2HB   PHE  36          1HB       PHE  36  -0.581  -5.359   4.338
  281    HD1  PHE  36           HD1      PHE  36  -1.047  -4.103   0.836
  282    HD2  PHE  36           HD2      PHE  36  -1.079  -3.184   5.032
  283    HE1  PHE  36           HE1      PHE  36  -1.421  -1.711   0.308
  284    HE2  PHE  36           HE2      PHE  36  -1.453  -0.790   4.504
  285    HZ   PHE  36           HZ       PHE  36  -1.624  -0.054   2.141
  286    H    GLY  37           H        GLY  37   2.341  -6.044   4.027
  287   1HA   GLY  37          2HA       GLY  37   3.306  -7.816   5.225
  288   2HA   GLY  37          1HA       GLY  37   1.761  -8.653   5.079
  289    H    ARG  38           H        ARG  38   3.045  -7.651   2.082
  290    HA   ARG  38           HA       ARG  38   4.405 -10.266   1.664
  291   1HB   ARG  38          2HB       ARG  38   2.059 -10.511   0.899
  292   2HB   ARG  38          1HB       ARG  38   2.274  -9.123  -0.170
  293   1HG   ARG  38          2HG       ARG  38   4.110 -10.325  -1.331
  294   2HG   ARG  38          1HG       ARG  38   3.832 -11.724  -0.292
  295   1HD   ARG  38          2HD       ARG  38   2.653 -12.097  -2.374
  296   2HD   ARG  38          1HD       ARG  38   1.456 -11.776  -1.120
  297    HE   ARG  38           HE       ARG  38   0.788  -9.974  -2.467
  298   1HH1  ARG  38          1HH1      ARG  38   3.387  -8.556  -1.643
  299   2HH1  ARG  38          2HH1      ARG  38   4.012  -8.102  -3.192
  300   1HH2  ARG  38          1HH2      ARG  38   1.930 -10.242  -4.955
  301   2HH2  ARG  38          2HH2      ARG  38   3.188  -9.056  -5.067
  302    H    LYS  39           H        LYS  39   6.291  -9.993   0.562
  303    HA   LYS  39           HA       LYS  39   7.092  -7.333  -0.284
  304   1HB   LYS  39          2HB       LYS  39   8.407 -10.050  -0.570
  305   2HB   LYS  39          1HB       LYS  39   9.166  -8.538  -1.073
  306   1HG   LYS  39          2HG       LYS  39   9.796  -8.108   1.041
  307   2HG   LYS  39          1HG       LYS  39   8.125  -8.234   1.593
  308   1HD   LYS  39          2HD       LYS  39   9.038 -10.875   1.038
  309   2HD   LYS  39          1HD       LYS  39  10.273 -10.081   2.015
  310   1HE   LYS  39          2HE       LYS  39   7.874  -9.289   3.194
  311   2HE   LYS  39          1HE       LYS  39   7.609 -10.985   2.787
  312   1HZ   LYS  39          1HZ       LYS  39   9.637  -9.796   4.556
  313   2HZ   LYS  39          2HZ       LYS  39   9.955 -11.280   3.793
  314   3HZ   LYS  39          3HZ       LYS  39   8.619 -11.124   4.831
  315    H    THR  40           H        THR  40   8.183  -7.180  -2.578
  316    HA   THR  40           HA       THR  40   6.077  -7.575  -4.524
  317    HB   THR  40           HB       THR  40   8.782  -7.034  -5.563
  318    HG1  THR  40           HG1      THR  40   9.150  -5.979  -3.706
  319   1HG2  THR  40          1HG2      THR  40   6.954  -4.884  -5.885
  320   2HG2  THR  40          2HG2      THR  40   6.040  -6.379  -6.076
  321   3HG2  THR  40          3HG2      THR  40   7.449  -6.072  -7.091
  322    H    GLY  41           H        GLY  41   6.804  -8.596  -6.754
  323   1HA   GLY  41          2HA       GLY  41   7.577 -10.462  -7.957
  324   2HA   GLY  41          1HA       GLY  41   8.611 -10.854  -6.586
  325    H    GLN  42           H        GLN  42   5.498 -11.396  -8.064
  326    HA   GLN  42           HA       GLN  42   5.110 -13.736  -6.303
  327   1HB   GLN  42          2HB       GLN  42   3.734 -11.302  -5.835
  328   2HB   GLN  42          1HB       GLN  42   2.570 -12.407  -6.565
  329   1HG   GLN  42          2HG       GLN  42   2.547 -12.707  -4.143
  330   2HG   GLN  42          1HG       GLN  42   3.230 -14.146  -4.902
  331   1HE2  GLN  42          1HE2      GLN  42   4.651 -10.935  -4.040
  332   2HE2  GLN  42          2HE2      GLN  42   5.953 -11.586  -3.166
  333    H    ALA  43           H        ALA  43   2.922 -11.946  -8.491
  334    HA   ALA  43           HA       ALA  43   1.777 -14.102  -9.786
  335   1HB   ALA  43          1HB       ALA  43   1.090 -11.803 -10.248
  336   2HB   ALA  43          2HB       ALA  43   1.490 -12.612 -11.763
  337   3HB   ALA  43          3HB       ALA  43   2.631 -11.479 -11.042
  338    HA   PRO  44           HA       PRO  44   5.125 -16.028 -11.917
  339   1HB   PRO  44          2HB       PRO  44   3.605 -17.730 -13.448
  340   2HB   PRO  44          1HB       PRO  44   3.914 -17.973 -11.721
  341   1HG   PRO  44          2HG       PRO  44   1.417 -17.055 -13.063
  342   2HG   PRO  44          1HG       PRO  44   1.618 -17.873 -11.505
  343   1HD   PRO  44          2HD       PRO  44   1.159 -15.095 -11.897
  344   2HD   PRO  44          1HD       PRO  44   1.630 -15.882 -10.375
  345    H    GLY  45           H        GLY  45   2.833 -16.448 -14.520
  346   1HA   GLY  45          2HA       GLY  45   4.420 -15.624 -16.613
  347   2HA   GLY  45          1HA       GLY  45   2.668 -15.424 -16.643
  348    H    TYR  46           H        TYR  46   2.731 -13.562 -14.343
  349    HA   TYR  46           HA       TYR  46   3.207 -11.104 -15.858
  350   1HB   TYR  46          2HB       TYR  46   1.300 -11.443 -14.252
  351   2HB   TYR  46          1HB       TYR  46   2.467 -11.481 -12.943
  352    HD1  TYR  46           HD1      TYR  46   4.120  -9.148 -14.707
  353    HD2  TYR  46           HD2      TYR  46   0.255  -9.589 -12.915
  354    HE1  TYR  46           HE1      TYR  46   3.956  -6.712 -14.508
  355    HE2  TYR  46           HE2      TYR  46   0.112  -7.134 -12.702
  356    HH   TYR  46           HH       TYR  46   1.965  -5.178 -12.548
  357    H    SER  47           H        SER  47   5.270 -10.375 -16.042
  358    HA   SER  47           HA       SER  47   7.311 -11.013 -14.046
  359   1HB   SER  47          2HB       SER  47   7.206  -9.677 -16.692
  360   2HB   SER  47          1HB       SER  47   8.421  -9.048 -15.584
  361    HG   SER  47           HG       SER  47   8.972 -11.353 -15.265
  362    H    TYR  48           H        TYR  48   6.056 -10.042 -12.249
  363    HA   TYR  48           HA       TYR  48   5.157  -7.439 -11.923
  364   1HB   TYR  48          2HB       TYR  48   6.383  -9.486 -10.173
  365   2HB   TYR  48          1HB       TYR  48   6.409  -7.848  -9.542
  366    HD1  TYR  48           HD1      TYR  48   3.731  -9.114 -11.780
  367    HD2  TYR  48           HD2      TYR  48   4.922  -8.254  -7.762
  368    HE1  TYR  48           HE1      TYR  48   1.386  -9.396 -11.010
  369    HE2  TYR  48           HE2      TYR  48   2.582  -8.532  -6.990
  370    HH   TYR  48           HH       TYR  48   0.167  -9.920  -8.970
  371    H    THR  49           H        THR  49   6.446  -5.764 -10.436
  372    HA   THR  49           HA       THR  49   8.579  -4.680 -11.983
  373    HB   THR  49           HB       THR  49   8.978  -3.676  -9.425
  374    HG1  THR  49           HG1      THR  49   7.073  -3.643  -8.428
  375   1HG2  THR  49          1HG2      THR  49   7.717  -2.887 -11.924
  376   2HG2  THR  49          2HG2      THR  49   8.663  -1.920 -10.794
  377   3HG2  THR  49          3HG2      THR  49   6.932  -2.135 -10.535
  378    H    ALA  50           H        ALA  50  10.078  -6.433 -12.296
  379    HA   ALA  50           HA       ALA  50  11.289  -8.092 -10.447
  380   1HB   ALA  50          1HB       ALA  50  11.963  -8.285 -12.735
  381   2HB   ALA  50          2HB       ALA  50  13.411  -7.803 -11.851
  382   3HB   ALA  50          3HB       ALA  50  12.510  -6.610 -12.787
  383    H    ALA  51           H        ALA  51  12.081  -4.680 -11.085
  384    HA   ALA  51           HA       ALA  51  14.294  -4.430  -9.355
  385   1HB   ALA  51          1HB       ALA  51  12.101  -2.464 -10.059
  386   2HB   ALA  51          2HB       ALA  51  13.711  -2.575 -10.768
  387   3HB   ALA  51          3HB       ALA  51  13.518  -2.021  -9.106
  388    H    ASN  52           H        ASN  52  11.005  -3.296  -8.475
  389    HA   ASN  52           HA       ASN  52  11.259  -3.029  -5.764
  390   1HB   ASN  52          2HB       ASN  52   9.063  -3.790  -7.549
  391   2HB   ASN  52          1HB       ASN  52   8.858  -4.397  -5.906
  392   1HD2  ASN  52          1HD2      ASN  52   9.527  -2.573  -4.174
  393   2HD2  ASN  52          2HD2      ASN  52   8.879  -1.035  -4.487
  394    H    LYS  53           H        LYS  53  10.883  -6.152  -7.443
  395    HA   LYS  53           HA       LYS  53  10.645  -7.806  -5.164
  396   1HB   LYS  53          2HB       LYS  53  10.379  -8.543  -7.553
  397   2HB   LYS  53          1HB       LYS  53  12.136  -8.497  -7.709
  398   1HG   LYS  53          2HG       LYS  53  11.198  -9.972  -5.343
  399   2HG   LYS  53          1HG       LYS  53  10.692 -10.688  -6.874
  400   1HD   LYS  53          2HD       LYS  53  13.004 -10.719  -7.664
  401   2HD   LYS  53          1HD       LYS  53  13.543  -9.905  -6.194
  402   1HE   LYS  53          2HE       LYS  53  12.162 -12.034  -5.160
  403   2HE   LYS  53          1HE       LYS  53  12.847 -12.738  -6.625
  404   1HZ   LYS  53          1HZ       LYS  53  14.982 -11.532  -5.805
  405   2HZ   LYS  53          2HZ       LYS  53  14.545 -13.035  -5.144
  406   3HZ   LYS  53          3HZ       LYS  53  14.220 -11.602  -4.292
  407    H    ASN  54           H        ASN  54  13.670  -7.545  -7.054
  408    HA   ASN  54           HA       ASN  54  15.326  -8.535  -4.975
  409   1HB   ASN  54          2HB       ASN  54  16.149  -8.530  -7.232
  410   2HB   ASN  54          1HB       ASN  54  15.954  -6.781  -7.358
  411   1HD2  ASN  54          1HD2      ASN  54  17.590  -5.430  -6.416
  412   2HD2  ASN  54          2HD2      ASN  54  19.014  -6.054  -5.737
  413    H    LYS  55           H        LYS  55  13.761  -5.527  -5.181
  414    HA   LYS  55           HA       LYS  55  15.715  -3.841  -3.950
  415   1HB   LYS  55          2HB       LYS  55  13.530  -3.149  -5.108
  416   2HB   LYS  55          1HB       LYS  55  12.728  -3.564  -3.593
  417   1HG   LYS  55          2HG       LYS  55  13.223  -1.209  -3.508
  418   2HG   LYS  55          1HG       LYS  55  14.352  -2.016  -2.419
  419   1HD   LYS  55          2HD       LYS  55  15.455  -1.966  -5.082
  420   2HD   LYS  55          1HD       LYS  55  14.984  -0.333  -4.606
  421   1HE   LYS  55          2HE       LYS  55  16.733  -0.189  -3.197
  422   2HE   LYS  55          1HE       LYS  55  16.243  -1.674  -2.381
  423   1HZ   LYS  55          1HZ       LYS  55  17.432  -2.044  -4.992
  424   2HZ   LYS  55          2HZ       LYS  55  17.696  -2.895  -3.545
  425   3HZ   LYS  55          3HZ       LYS  55  18.484  -1.415  -3.819
  426    H    GLY  56           H        GLY  56  14.102  -6.537  -2.725
  427   1HA   GLY  56          1HA       GLY  56  13.756  -7.329  -0.534
  428   2HA   GLY  56          2HA       GLY  56  15.221  -6.419  -0.159
  429    H    ILE  57           H        ILE  57  11.935  -5.407  -1.135
  430    HA   ILE  57           HA       ILE  57  11.892  -3.667   1.298
  431    HB   ILE  57           HB       ILE  57  12.043  -2.594  -1.055
  432   1HG1  ILE  57          2HG1      ILE  57  11.436  -1.379   1.025
  433   2HG1  ILE  57          1HG1      ILE  57  10.561  -0.765  -0.378
  434   1HG2  ILE  57          1HG2      ILE  57   9.088  -3.254  -1.046
  435   2HG2  ILE  57          2HG2      ILE  57  10.276  -4.138  -2.003
  436   3HG2  ILE  57          3HG2      ILE  57   9.997  -2.424  -2.309
  437   1HD1  ILE  57          1HD1      ILE  57   9.545  -2.229   1.990
  438   2HD1  ILE  57          2HD1      ILE  57   8.841  -2.692   0.440
  439   3HD1  ILE  57          3HD1      ILE  57   8.749  -1.016   0.986
  440    H    ILE  58           H        ILE  58  10.387  -4.360   2.746
  441    HA   ILE  58           HA       ILE  58   8.298  -6.237   1.943
  442    HB   ILE  58           HB       ILE  58   9.529  -6.196   4.198
  443   1HG1  ILE  58          2HG1      ILE  58   7.468  -7.530   3.702
  444   2HG1  ILE  58          1HG1      ILE  58   7.565  -7.017   5.386
  445   1HG2  ILE  58          1HG2      ILE  58   8.848  -3.609   4.314
  446   2HG2  ILE  58          2HG2      ILE  58   9.053  -4.582   5.770
  447   3HG2  ILE  58          3HG2      ILE  58   7.438  -4.282   5.130
  448   1HD1  ILE  58          1HD1      ILE  58   6.213  -4.921   4.476
  449   2HD1  ILE  58          2HD1      ILE  58   5.380  -6.414   4.904
  450   3HD1  ILE  58          3HD1      ILE  58   5.739  -6.060   3.215
  451    H    TRP  59           H        TRP  59   6.375  -5.600   1.111
  452    HA   TRP  59           HA       TRP  59   5.629  -2.856   0.890
  453   1HB   TRP  59          2HB       TRP  59   4.153  -5.445   0.434
  454   2HB   TRP  59          1HB       TRP  59   3.352  -3.884   0.237
  455    HD1  TRP  59           HD1      TRP  59   4.741  -6.253  -1.919
  456    HE1  TRP  59           HE1      TRP  59   5.917  -5.223  -3.971
  457    HE3  TRP  59           HE3      TRP  59   5.300  -1.447  -0.291
  458    HZ2  TRP  59           HZ2      TRP  59   6.961  -2.690  -4.805
  459    HZ3  TRP  59           HZ3      TRP  59   6.386   0.251  -1.729
  460    HH2  TRP  59           HH2      TRP  59   7.215  -0.363  -3.983
  461    H    GLY  60           H        GLY  60   5.504  -1.867   2.914
  462   1HA   GLY  60          1HA       GLY  60   3.379  -2.922   4.739
  463   2HA   GLY  60          2HA       GLY  60   4.790  -2.027   5.306
  464    H    GLU  61           H        GLU  61   2.873  -0.711   6.249
  465    HA   GLU  61           HA       GLU  61   1.290   0.919   4.482
  466   1HB   GLU  61          2HB       GLU  61   2.075   1.538   7.343
  467   2HB   GLU  61          1HB       GLU  61   0.668   2.144   6.470
  468   1HG   GLU  61          2HG       GLU  61   0.206  -0.473   6.161
  469   2HG   GLU  61          1HG       GLU  61   1.146  -0.554   7.652
  470    H    ASP  62           H        ASP  62   3.865   2.049   6.714
  471    HA   ASP  62           HA       ASP  62   4.269   4.497   5.312
  472   1HB   ASP  62          2HB       ASP  62   5.233   3.338   7.668
  473   2HB   ASP  62          1HB       ASP  62   6.667   3.562   6.666
  474    H    THR  63           H        THR  63   5.835   1.330   5.015
  475    HA   THR  63           HA       THR  63   7.968   2.115   3.313
  476    HB   THR  63           HB       THR  63   7.177  -0.423   2.424
  477    HG1  THR  63           HG1      THR  63   7.000  -1.223   4.793
  478   1HG2  THR  63          1HG2      THR  63   8.894  -0.951   4.471
  479   2HG2  THR  63          2HG2      THR  63   9.184   0.772   4.233
  480   3HG2  THR  63          3HG2      THR  63   9.402  -0.352   2.893
  481    H    LEU  64           H        LEU  64   4.700   0.947   2.486
  482    HA   LEU  64           HA       LEU  64   5.002   1.213  -0.346
  483   1HB   LEU  64          2HB       LEU  64   3.084   0.156   1.212
  484   2HB   LEU  64          1HB       LEU  64   2.332   1.716   0.881
  485    HG   LEU  64           HG       LEU  64   3.371  -0.223  -1.207
  486   1HD1  LEU  64          1HD1      LEU  64   0.628   0.455  -0.149
  487   2HD1  LEU  64          2HD1      LEU  64   1.363  -1.136  -0.352
  488   3HD1  LEU  64          3HD1      LEU  64   0.846  -0.214  -1.766
  489   1HD2  LEU  64          1HD2      LEU  64   3.583   1.864  -2.229
  490   2HD2  LEU  64          2HD2      LEU  64   2.265   2.569  -1.293
  491   3HD2  LEU  64          3HD2      LEU  64   1.911   1.467  -2.625
  492    H    MET  65           H        MET  65   4.122   3.494   2.188
  493    HA   MET  65           HA       MET  65   3.057   5.581   0.614
  494   1HB   MET  65          2HB       MET  65   3.124   5.553   3.113
  495   2HB   MET  65          1HB       MET  65   4.857   5.876   3.037
  496   1HG   MET  65          2HG       MET  65   3.993   7.855   1.433
  497   2HG   MET  65          1HG       MET  65   2.565   7.685   2.455
  498   1HE   MET  65          1HE       MET  65   6.851   8.137   3.648
  499   2HE   MET  65          2HE       MET  65   6.327   9.492   2.651
  500   3HE   MET  65          3HE       MET  65   6.115   7.844   2.066
  501    H    GLU  66           H        GLU  66   6.441   4.767   1.338
  502    HA   GLU  66           HA       GLU  66   7.554   7.043  -0.012
  503   1HB   GLU  66          2HB       GLU  66   8.698   5.464   1.673
  504   2HB   GLU  66          1HB       GLU  66   8.944   4.384   0.301
  505   1HG   GLU  66          2HG       GLU  66  10.865   5.585   0.028
  506   2HG   GLU  66          1HG       GLU  66   9.793   6.738  -0.767
  507    H    TYR  67           H        TYR  67   7.311   3.610  -1.030
  508    HA   TYR  67           HA       TYR  67   8.303   3.863  -3.628
  509   1HB   TYR  67          2HB       TYR  67   7.660   1.694  -2.708
  510   2HB   TYR  67          1HB       TYR  67   5.963   2.176  -2.691
  511    HD1  TYR  67           HD1      TYR  67   4.626   2.098  -4.674
  512    HD2  TYR  67           HD2      TYR  67   8.864   1.476  -4.896
  513    HE1  TYR  67           HE1      TYR  67   4.391   1.358  -7.028
  514    HE2  TYR  67           HE2      TYR  67   8.634   0.734  -7.252
  515    HH   TYR  67           HH       TYR  67   6.375   1.366  -9.161
  516    H    LEU  68           H        LEU  68   5.132   4.791  -2.394
  517    HA   LEU  68           HA       LEU  68   4.039   5.377  -5.026
  518   1HB   LEU  68          2HB       LEU  68   3.079   5.263  -2.332
  519   2HB   LEU  68          1HB       LEU  68   2.680   6.847  -2.994
  520    HG   LEU  68           HG       LEU  68   1.731   5.707  -5.011
  521   1HD1  LEU  68          1HD1      LEU  68   1.558   3.129  -3.554
  522   2HD1  LEU  68          2HD1      LEU  68   3.153   3.534  -4.188
  523   3HD1  LEU  68          3HD1      LEU  68   1.770   3.435  -5.277
  524   1HD2  LEU  68          1HD2      LEU  68   0.360   4.526  -2.621
  525   2HD2  LEU  68          2HD2      LEU  68  -0.332   5.397  -3.989
  526   3HD2  LEU  68          3HD2      LEU  68   0.515   6.281  -2.720
  527    H    GLU  69           H        GLU  69   5.618   7.231  -2.461
  528    HA   GLU  69           HA       GLU  69   5.167   9.838  -3.501
  529   1HB   GLU  69          2HB       GLU  69   6.342   8.946  -1.291
  530   2HB   GLU  69          1HB       GLU  69   7.794   9.099  -2.269
  531   1HG   GLU  69          2HG       GLU  69   7.491  11.427  -2.573
  532   2HG   GLU  69          1HG       GLU  69   5.804  11.359  -2.059
  533    H    ASN  70           H        ASN  70   7.152   7.210  -4.470
  534    HA   ASN  70           HA       ASN  70   7.824   8.421  -6.999
  535   1HB   ASN  70          2HB       ASN  70  10.426   7.972  -6.233
  536   2HB   ASN  70          1HB       ASN  70   9.669   9.563  -6.298
  537   1HD2  ASN  70          1HD2      ASN  70  10.144  10.687  -4.408
  538   2HD2  ASN  70          2HD2      ASN  70  10.187  10.010  -2.851
  539    HA   PRO  71           HA       PRO  71   7.918   3.880  -6.945
  540   1HB   PRO  71          2HB       PRO  71   6.534   3.634  -9.311
  541   2HB   PRO  71          1HB       PRO  71   5.744   3.803  -7.734
  542   1HG   PRO  71          2HG       PRO  71   6.027   5.811  -9.916
  543   2HG   PRO  71          1HG       PRO  71   4.802   5.706  -8.640
  544   1HD   PRO  71          2HD       PRO  71   7.037   7.459  -8.679
  545   2HD   PRO  71          1HD       PRO  71   5.971   7.147  -7.293
  546    H    LYS  72           H        LYS  72   8.363   6.007  -9.772
  547    HA   LYS  72           HA       LYS  72  10.146   4.150 -11.114
  548   1HB   LYS  72          2HB       LYS  72   8.597   5.880 -12.209
  549   2HB   LYS  72          1HB       LYS  72   9.801   7.080 -11.748
  550   1HG   LYS  72          2HG       LYS  72  11.532   5.769 -12.971
  551   2HG   LYS  72          1HG       LYS  72  10.272   4.652 -13.499
  552   1HD   LYS  72          2HD       LYS  72   9.111   6.429 -14.677
  553   2HD   LYS  72          1HD       LYS  72  10.232   7.633 -14.042
  554   1HE   LYS  72          2HE       LYS  72  12.068   6.690 -15.287
  555   2HE   LYS  72          1HE       LYS  72  11.097   5.298 -15.768
  556   1HZ   LYS  72          1HZ       LYS  72  11.107   8.004 -16.815
  557   2HZ   LYS  72          2HZ       LYS  72   9.572   7.299 -16.633
  558   3HZ   LYS  72          3HZ       LYS  72  10.751   6.539 -17.593
  559    H    LYS  73           H        LYS  73  10.488   6.725  -8.813
  560    HA   LYS  73           HA       LYS  73  13.381   7.009  -9.377
  561   1HB   LYS  73          2HB       LYS  73  12.552   9.113  -8.858
  562   2HB   LYS  73          1HB       LYS  73  11.365   8.481  -7.723
  563   1HG   LYS  73          2HG       LYS  73  13.119   9.675  -6.503
  564   2HG   LYS  73          1HG       LYS  73  13.208   7.952  -6.132
  565   1HD   LYS  73          2HD       LYS  73  15.455   8.683  -6.561
  566   2HD   LYS  73          1HD       LYS  73  14.945   7.756  -7.972
  567   1HE   LYS  73          2HE       LYS  73  14.096  10.308  -8.594
  568   2HE   LYS  73          1HE       LYS  73  15.620  10.604  -7.757
  569   1HZ   LYS  73          1HZ       LYS  73  15.993  10.275 -10.107
  570   2HZ   LYS  73          2HZ       LYS  73  15.212   8.767 -10.056
  571   3HZ   LYS  73          3HZ       LYS  73  16.680   8.994  -9.233
  572    H    TYR  74           H        TYR  74  11.201   5.692  -6.925
  573    HA   TYR  74           HA       TYR  74  13.323   4.977  -5.075
  574   1HB   TYR  74          2HB       TYR  74  10.979   5.277  -4.330
  575   2HB   TYR  74          1HB       TYR  74  10.489   3.911  -5.332
  576    HD1  TYR  74           HD1      TYR  74   9.667   2.553  -3.494
  577    HD2  TYR  74           HD2      TYR  74  13.711   4.005  -3.521
  578    HE1  TYR  74           HE1      TYR  74  10.238   0.996  -1.649
  579    HE2  TYR  74           HE2      TYR  74  14.280   2.445  -1.677
  580    HH   TYR  74           HH       TYR  74  12.094   1.000   0.249
  581    H    ILE  75           H        ILE  75  11.119   2.864  -6.945
  582    HA   ILE  75           HA       ILE  75  13.227   0.811  -7.039
  583    HB   ILE  75           HB       ILE  75  10.380   0.664  -8.035
  584   1HG1  ILE  75          2HG1      ILE  75  10.539   1.475  -5.655
  585   2HG1  ILE  75          1HG1      ILE  75   9.724  -0.077  -5.832
  586   1HG2  ILE  75          1HG2      ILE  75  12.369  -1.381  -7.037
  587   2HG2  ILE  75          2HG2      ILE  75  11.859  -1.145  -8.710
  588   3HG2  ILE  75          3HG2      ILE  75  10.706  -1.725  -7.510
  589   1HD1  ILE  75          1HD1      ILE  75  12.156  -1.045  -5.471
  590   2HD1  ILE  75          2HD1      ILE  75  11.188  -0.543  -4.088
  591   3HD1  ILE  75          3HD1      ILE  75  12.441   0.524  -4.720
  592    HA   PRO  76           HA       PRO  76  13.883   2.365 -11.222
  593   1HB   PRO  76          2HB       PRO  76  16.255   1.019 -11.579
  594   2HB   PRO  76          1HB       PRO  76  16.130   2.569 -10.729
  595   1HG   PRO  76          2HG       PRO  76  16.538  -0.163  -9.600
  596   2HG   PRO  76          1HG       PRO  76  17.018   1.409  -8.938
  597   1HD   PRO  76          2HD       PRO  76  14.788  -0.122  -8.109
  598   2HD   PRO  76          1HD       PRO  76  15.090   1.583  -7.711
  599    H    GLY  77           H        GLY  77  11.934   0.761 -11.492
  600   1HA   GLY  77          2HA       GLY  77  12.634  -1.153 -13.540
  601   2HA   GLY  77          1HA       GLY  77  12.157  -1.956 -12.043
  602    H    THR  78           H        THR  78  10.124  -0.276 -11.115
  603    HA   THR  78           HA       THR  78   7.898  -1.128 -12.670
  604    HB   THR  78           HB       THR  78   7.841  -0.294 -10.249
  605    HG1  THR  78           HG1      THR  78   5.778  -0.203 -10.603
  606   1HG2  THR  78          1HG2      THR  78   8.883   2.008 -11.334
  607   2HG2  THR  78          2HG2      THR  78   8.078   1.916  -9.768
  608   3HG2  THR  78          3HG2      THR  78   7.172   2.415 -11.198
  609    H    LYS  79           H        LYS  79   6.335   0.311 -13.799
  610    HA   LYS  79           HA       LYS  79   7.697   2.585 -15.168
  611   1HB   LYS  79          2HB       LYS  79   6.174   0.276 -16.375
  612   2HB   LYS  79          1HB       LYS  79   6.286   1.825 -17.213
  613   1HG   LYS  79          2HG       LYS  79   8.901   1.257 -16.339
  614   2HG   LYS  79          1HG       LYS  79   8.278  -0.264 -16.981
  615   1HD   LYS  79          2HD       LYS  79   8.931   0.619 -18.984
  616   2HD   LYS  79          1HD       LYS  79   7.386   1.465 -18.880
  617   1HE   LYS  79          2HE       LYS  79   8.375   3.464 -18.177
  618   2HE   LYS  79          1HE       LYS  79   9.826   2.654 -17.588
  619   1HZ   LYS  79          1HZ       LYS  79   9.327   3.752 -20.137
  620   2HZ   LYS  79          2HZ       LYS  79   9.629   2.088 -20.295
  621   3HZ   LYS  79          3HZ       LYS  79  10.766   3.092 -19.529
  622    H    MET  80           H        MET  80   5.369   1.867 -13.055
  623    HA   MET  80           HA       MET  80   3.092   3.165 -14.315
  624   1HB   MET  80          2HB       MET  80   2.024   3.054 -12.115
  625   2HB   MET  80          1HB       MET  80   2.808   1.529 -12.491
  626   1HG   MET  80          2HG       MET  80   4.597   1.957 -11.041
  627   2HG   MET  80          1HG       MET  80   4.182   3.636 -10.864
  628   1HE   MET  80          1HE       MET  80   2.983   4.622  -9.613
  629   2HE   MET  80          2HE       MET  80   2.922   4.033  -7.954
  630   3HE   MET  80          3HE       MET  80   1.439   4.135  -8.898
  631    H    ILE  81           H        ILE  81   3.032   5.232 -14.750
  632    HA   ILE  81           HA       ILE  81   4.706   7.155 -13.235
  633    HB   ILE  81           HB       ILE  81   2.974   7.632 -15.682
  634   1HG1  ILE  81          2HG1      ILE  81   4.686   5.970 -16.205
  635   2HG1  ILE  81          1HG1      ILE  81   5.142   7.514 -16.926
  636   1HG2  ILE  81          1HG2      ILE  81   5.380   9.262 -15.074
  637   2HG2  ILE  81          2HG2      ILE  81   4.006   9.484 -13.991
  638   3HG2  ILE  81          3HG2      ILE  81   3.818   9.760 -15.722
  639   1HD1  ILE  81          1HD1      ILE  81   6.389   6.038 -14.663
  640   2HD1  ILE  81          2HD1      ILE  81   6.338   7.796 -14.531
  641   3HD1  ILE  81          3HD1      ILE  81   7.142   7.038 -15.906
  642    H    PHE  82           H        PHE  82   2.430   5.920 -11.998
  643    HA   PHE  82           HA       PHE  82   0.069   7.475 -12.020
  644   1HB   PHE  82          2HB       PHE  82  -0.142   5.455 -10.892
  645   2HB   PHE  82          1HB       PHE  82   1.411   5.629 -10.081
  646    HD1  PHE  82           HD1      PHE  82   1.589   6.666  -7.941
  647    HD2  PHE  82           HD2      PHE  82  -2.067   6.877 -10.177
  648    HE1  PHE  82           HE1      PHE  82   0.425   7.609  -5.955
  649    HE2  PHE  82           HE2      PHE  82  -3.233   7.817  -8.199
  650    HZ   PHE  82           HZ       PHE  82  -1.989   8.180  -6.089
  651    H    VAL  83           H        VAL  83   3.107   7.917 -10.294
  652    HA   VAL  83           HA       VAL  83   2.755   9.630  -8.275
  653    HB   VAL  83           HB       VAL  83   4.648  11.083  -9.385
  654   1HG1  VAL  83          1HG1      VAL  83   6.226   9.102  -8.962
  655   2HG1  VAL  83          2HG1      VAL  83   4.773   8.160  -8.623
  656   3HG1  VAL  83          3HG1      VAL  83   5.169   9.561  -7.627
  657   1HG2  VAL  83          1HG2      VAL  83   3.931  10.032 -11.663
  658   2HG2  VAL  83          2HG2      VAL  83   4.825   8.616 -11.110
  659   3HG2  VAL  83          3HG2      VAL  83   5.654  10.159 -11.309
  660    H    GLY  84           H        GLY  84   1.045  11.006  -8.069
  661   1HA   GLY  84          2HA       GLY  84   1.064  13.500  -9.564
  662   2HA   GLY  84          1HA       GLY  84  -0.319  12.483  -9.974
  663    H    ILE  85           H        ILE  85   1.053  12.339  -6.774
  664    HA   ILE  85           HA       ILE  85  -1.444  13.575  -5.715
  665    HB   ILE  85           HB       ILE  85   0.580  12.011  -4.109
  666   1HG1  ILE  85          2HG1      ILE  85  -1.726  10.957  -5.775
  667   2HG1  ILE  85          1HG1      ILE  85  -0.015  10.577  -5.985
  668   1HG2  ILE  85          1HG2      ILE  85  -1.211  13.327  -2.958
  669   2HG2  ILE  85          2HG2      ILE  85  -1.341  11.592  -2.671
  670   3HG2  ILE  85          3HG2      ILE  85  -2.418  12.377  -3.826
  671   1HD1  ILE  85          1HD1      ILE  85  -0.822  10.075  -3.253
  672   2HD1  ILE  85          2HD1      ILE  85  -0.127   8.958  -4.426
  673   3HD1  ILE  85          3HD1      ILE  85  -1.872   9.203  -4.369
  674    H    LYS  86           H        LYS  86  -1.204  14.995  -3.801
  675    HA   LYS  86           HA       LYS  86   1.473  16.161  -3.361
  676   1HB   LYS  86          2HB       LYS  86   0.046  17.312  -5.323
  677   2HB   LYS  86          1HB       LYS  86  -0.681  18.139  -3.945
  678   1HG   LYS  86          2HG       LYS  86   1.194  19.352  -3.533
  679   2HG   LYS  86          1HG       LYS  86   2.255  17.971  -3.819
  680   1HD   LYS  86          2HD       LYS  86   0.990  18.760  -6.292
  681   2HD   LYS  86          1HD       LYS  86   1.786  20.152  -5.555
  682   1HE   LYS  86          2HE       LYS  86   3.787  18.526  -5.193
  683   2HE   LYS  86          1HE       LYS  86   2.993  17.528  -6.410
  684   1HZ   LYS  86          1HZ       LYS  86   4.636  19.110  -7.328
  685   2HZ   LYS  86          2HZ       LYS  86   3.665  20.394  -6.787
  686   3HZ   LYS  86          3HZ       LYS  86   3.077  19.318  -7.964
  687    H    LYS  87           H        LYS  87  -0.145  14.670  -1.608
  688    HA   LYS  87           HA       LYS  87  -0.427  16.583   0.578
  689   1HB   LYS  87          2HB       LYS  87  -2.611  16.769  -0.694
  690   2HB   LYS  87          1HB       LYS  87  -2.907  15.077  -0.295
  691   1HG   LYS  87          2HG       LYS  87  -2.603  15.689   2.138
  692   2HG   LYS  87          1HG       LYS  87  -2.572  17.381   1.641
  693   1HD   LYS  87          2HD       LYS  87  -4.824  15.862   0.515
  694   2HD   LYS  87          1HD       LYS  87  -4.853  15.975   2.275
  695   1HE   LYS  87          2HE       LYS  87  -4.352  18.406   0.560
  696   2HE   LYS  87          1HE       LYS  87  -5.990  17.878   0.944
  697   1HZ   LYS  87          1HZ       LYS  87  -5.792  18.531   3.061
  698   2HZ   LYS  87          2HZ       LYS  87  -4.512  19.494   2.492
  699   3HZ   LYS  87          3HZ       LYS  87  -4.193  17.983   3.203
  700    H    LYS  88           H        LYS  88   0.560  15.451   2.172
  701    HA   LYS  88           HA       LYS  88   1.042  12.683   2.217
  702   1HB   LYS  88          2HB       LYS  88   2.264  14.095   3.723
  703   2HB   LYS  88          1HB       LYS  88   0.781  14.680   4.477
  704   1HG   LYS  88          2HG       LYS  88   1.785  13.024   5.942
  705   2HG   LYS  88          1HG       LYS  88   0.316  12.337   5.246
  706   1HD   LYS  88          2HD       LYS  88   2.044  11.531   3.369
  707   2HD   LYS  88          1HD       LYS  88   3.169  11.637   4.724
  708   1HE   LYS  88          2HE       LYS  88   0.545  10.120   4.788
  709   2HE   LYS  88          1HE       LYS  88   2.124   9.379   4.520
  710   1HZ   LYS  88          1HZ       LYS  88   1.818   9.155   6.783
  711   2HZ   LYS  88          2HZ       LYS  88   1.074  10.673   6.950
  712   3HZ   LYS  88          3HZ       LYS  88   2.750  10.570   6.691
  713    H    GLU  89           H        GLU  89  -1.743  14.492   3.456
  714    HA   GLU  89           HA       GLU  89  -2.994  12.368   4.867
  715   1HB   GLU  89          2HB       GLU  89  -3.933  14.908   3.595
  716   2HB   GLU  89          1HB       GLU  89  -5.144  13.726   4.097
  717   1HG   GLU  89          2HG       GLU  89  -3.007  14.248   6.077
  718   2HG   GLU  89          1HG       GLU  89  -4.085  15.608   5.761
  719    H    GLU  90           H        GLU  90  -3.099  13.269   1.434
  720    HA   GLU  90           HA       GLU  90  -5.154  11.439   0.659
  721   1HB   GLU  90          2HB       GLU  90  -2.831  12.655  -0.850
  722   2HB   GLU  90          1HB       GLU  90  -4.011  11.598  -1.626
  723   1HG   GLU  90          2HG       GLU  90  -5.016  13.894   0.014
  724   2HG   GLU  90          1HG       GLU  90  -4.368  14.226  -1.593
  725    H    ARG  91           H        ARG  91  -1.596  11.088   0.618
  726    HA   ARG  91           HA       ARG  91  -1.450   8.461  -0.379
  727   1HB   ARG  91          2HB       ARG  91   0.282   9.671   1.799
  728   2HB   ARG  91          1HB       ARG  91   0.714   8.317   0.756
  729   1HG   ARG  91          2HG       ARG  91   0.639   9.743  -1.214
  730   2HG   ARG  91          1HG       ARG  91   0.052  11.099  -0.250
  731   1HD   ARG  91          2HD       ARG  91   2.179  10.903   1.122
  732   2HD   ARG  91          1HD       ARG  91   2.766   9.767  -0.094
  733    HE   ARG  91           HE       ARG  91   2.066  11.910  -1.633
  734   1HH1  ARG  91          1HH1      ARG  91   4.371  11.159   0.753
  735   2HH1  ARG  91          2HH1      ARG  91   5.159  12.700   0.697
  736   1HH2  ARG  91          1HH2      ARG  91   2.850  14.096  -1.482
  737   2HH2  ARG  91          2HH2      ARG  91   4.297  14.365  -0.569
  738    H    ALA  92           H        ALA  92  -1.912   9.567   2.968
  739    HA   ALA  92           HA       ALA  92  -1.900   7.031   4.228
  740   1HB   ALA  92          1HB       ALA  92  -3.877   8.872   5.339
  741   2HB   ALA  92          2HB       ALA  92  -2.335   9.662   5.011
  742   3HB   ALA  92          3HB       ALA  92  -2.396   8.249   6.065
  743    H    ASP  93           H        ASP  93  -4.451   8.740   2.496
  744    HA   ASP  93           HA       ASP  93  -6.584   6.984   3.277
  745   1HB   ASP  93          2HB       ASP  93  -6.188   9.014   1.106
  746   2HB   ASP  93          1HB       ASP  93  -7.577   7.928   1.026
  747    H    LEU  94           H        LEU  94  -4.132   6.816   0.762
  748    HA   LEU  94           HA       LEU  94  -5.446   4.768  -0.799
  749   1HB   LEU  94          2HB       LEU  94  -2.481   5.368  -0.591
  750   2HB   LEU  94          1HB       LEU  94  -3.292   4.511  -1.901
  751    HG   LEU  94           HG       LEU  94  -3.899   7.375  -1.119
  752   1HD1  LEU  94          1HD1      LEU  94  -2.613   8.027  -3.076
  753   2HD1  LEU  94          2HD1      LEU  94  -2.301   6.339  -3.479
  754   3HD1  LEU  94          3HD1      LEU  94  -1.584   7.048  -2.032
  755   1HD2  LEU  94          1HD2      LEU  94  -4.602   5.820  -3.625
  756   2HD2  LEU  94          2HD2      LEU  94  -5.180   7.423  -3.168
  757   3HD2  LEU  94          3HD2      LEU  94  -5.699   6.005  -2.256
  758    H    ILE  95           H        ILE  95  -2.553   4.526   1.295
  759    HA   ILE  95           HA       ILE  95  -2.575   1.682   1.461
  760    HB   ILE  95           HB       ILE  95  -1.435   3.878   3.185
  761   1HG1  ILE  95          2HG1      ILE  95   0.642   3.185   2.280
  762   2HG1  ILE  95          1HG1      ILE  95   0.004   1.616   1.790
  763   1HG2  ILE  95          1HG2      ILE  95  -0.312   2.160   4.553
  764   2HG2  ILE  95          2HG2      ILE  95  -1.192   0.896   3.697
  765   3HG2  ILE  95          3HG2      ILE  95  -2.063   2.041   4.716
  766   1HD1  ILE  95          1HD1      ILE  95   0.294   3.141  -0.147
  767   2HD1  ILE  95          2HD1      ILE  95  -0.828   4.280   0.599
  768   3HD1  ILE  95          3HD1      ILE  95  -1.394   2.690   0.087
  769    H    ALA  96           H        ALA  96  -4.276   4.155   3.264
  770    HA   ALA  96           HA       ALA  96  -5.175   2.597   5.457
  771   1HB   ALA  96          1HB       ALA  96  -5.556   4.906   5.659
  772   2HB   ALA  96          2HB       ALA  96  -7.172   4.267   5.357
  773   3HB   ALA  96          3HB       ALA  96  -6.264   5.024   4.048
  774    H    TYR  97           H        TYR  97  -6.567   3.033   2.203
  775    HA   TYR  97           HA       TYR  97  -8.925   1.486   2.757
  776   1HB   TYR  97          2HB       TYR  97  -8.992   2.958   0.864
  777   2HB   TYR  97          1HB       TYR  97  -7.546   2.226   0.166
  778    HD1  TYR  97           HD1      TYR  97  -7.937   0.796  -1.627
  779    HD2  TYR  97           HD2      TYR  97 -10.840   1.034   1.527
  780    HE1  TYR  97           HE1      TYR  97  -9.341  -0.884  -2.792
  781    HE2  TYR  97           HE2      TYR  97 -12.248  -0.639   0.359
  782    HH   TYR  97           HH       TYR  97 -11.892  -1.452  -2.805
  783    H    LEU  98           H        LEU  98  -5.837   0.678   1.142
  784    HA   LEU  98           HA       LEU  98  -6.516  -2.090   0.748
  785   1HB   LEU  98          2HB       LEU  98  -4.068  -0.419   0.559
  786   2HB   LEU  98          1HB       LEU  98  -3.801  -2.137   0.850
  787    HG   LEU  98           HG       LEU  98  -3.836  -1.799  -1.541
  788   1HD1  LEU  98          1HD1      LEU  98  -5.052  -3.672  -1.817
  789   2HD1  LEU  98          2HD1      LEU  98  -6.551  -2.794  -1.516
  790   3HD1  LEU  98          3HD1      LEU  98  -5.642  -3.472  -0.167
  791   1HD2  LEU  98          1HD2      LEU  98  -6.503  -0.953  -2.041
  792   2HD2  LEU  98          2HD2      LEU  98  -5.012  -0.082  -2.400
  793   3HD2  LEU  98          3HD2      LEU  98  -5.826   0.162  -0.855
  794    H    LYS  99           H        LYS  99  -5.618  -0.293   3.514
  795    HA   LYS  99           HA       LYS  99  -4.356  -2.418   4.999
  796   1HB   LYS  99          2HB       LYS  99  -4.640   0.286   5.361
  797   2HB   LYS  99          1HB       LYS  99  -5.773  -0.355   6.550
  798   1HG   LYS  99          2HG       LYS  99  -3.614  -2.009   6.904
  799   2HG   LYS  99          1HG       LYS  99  -2.829  -0.480   6.507
  800   1HD   LYS  99          2HD       LYS  99  -3.092  -0.164   8.776
  801   2HD   LYS  99          1HD       LYS  99  -4.649   0.458   8.229
  802   1HE   LYS  99          2HE       LYS  99  -5.641  -1.091   9.530
  803   2HE   LYS  99          1HE       LYS  99  -5.003  -2.323   8.441
  804   1HZ   LYS  99          1HZ       LYS  99  -3.219  -1.228  10.489
  805   2HZ   LYS  99          2HZ       LYS  99  -3.277  -2.791   9.822
  806   3HZ   LYS  99          3HZ       LYS  99  -4.421  -2.316  10.985
  807    H    LYS 100           H        LYS 100  -7.652  -1.036   5.048
  808    HA   LYS 100           HA       LYS 100  -8.604  -3.097   6.888
  809   1HB   LYS 100          2HB       LYS 100  -9.548  -0.789   6.817
  810   2HB   LYS 100          1HB       LYS 100 -10.183  -1.133   5.207
  811   1HG   LYS 100          2HG       LYS 100 -11.380  -3.129   6.232
  812   2HG   LYS 100          1HG       LYS 100 -10.935  -2.478   7.811
  813   1HD   LYS 100          2HD       LYS 100 -12.479  -0.819   7.691
  814   2HD   LYS 100          1HD       LYS 100 -12.117  -0.487   5.997
  815   1HE   LYS 100          2HE       LYS 100 -13.305  -2.960   5.841
  816   2HE   LYS 100          1HE       LYS 100 -14.196  -2.213   7.166
  817   1HZ   LYS 100          1HZ       LYS 100 -13.693  -0.652   4.734
  818   2HZ   LYS 100          2HZ       LYS 100 -14.984  -0.553   5.834
  819   3HZ   LYS 100          3HZ       LYS 100 -14.917  -1.825   4.710
  820    H    ALA 101           H        ALA 101  -8.498  -2.629   3.433
  821    HA   ALA 101           HA       ALA 101 -10.519  -4.541   2.741
  822   1HB   ALA 101          1HB       ALA 101  -9.719  -2.822   1.162
  823   2HB   ALA 101          2HB       ALA 101  -9.541  -4.440   0.483
  824   3HB   ALA 101          3HB       ALA 101  -8.135  -3.593   1.129
  825    H    THR 102           H        THR 102  -6.949  -4.822   2.506
  826    HA   THR 102           HA       THR 102  -7.326  -7.781   2.736
  827    HB   THR 102           HB       THR 102  -4.691  -7.222   1.889
  828    HG1  THR 102           HG1      THR 102  -5.252  -5.983  -0.016
  829   1HG2  THR 102          1HG2      THR 102  -5.844  -8.025  -0.365
  830   2HG2  THR 102          2HG2      THR 102  -7.199  -8.347   0.716
  831   3HG2  THR 102          3HG2      THR 102  -5.642  -9.129   0.995
  832    H    ASN 103           H        ASN 103  -5.612  -5.009   4.077
  833    HA   ASN 103           HA       ASN 103  -3.915  -6.675   5.757
  834   1HB   ASN 103          2HB       ASN 103  -3.664  -4.135   4.852
  835   2HB   ASN 103          1HB       ASN 103  -4.289  -3.828   6.472
  836   1HD2  ASN 103          1HD2      ASN 103  -2.400  -3.239   7.613
  837   2HD2  ASN 103          2HD2      ASN 103  -1.013  -4.211   7.712
  838    H    GLU 104           HN       GLU 104  -7.089  -6.388   5.899
  839    HA   GLU 104           HA       GLU 104  -7.099  -6.512   8.873
  840   1HB   GLU 104          2HB       GLU 104  -7.833  -4.232   8.219
  841   2HB   GLU 104          1HB       GLU 104  -9.106  -4.943   7.226
  842   1HG   GLU 104          2HG       GLU 104 -10.438  -5.072   9.033
  843   2HG   GLU 104          1HG       GLU 104  -9.267  -6.139   9.809
  844    HHA  HEC 105           HHA      HEC 105   4.199  -2.633  -9.155
  845    HHB  HEC 105           HHB      HEC 105   0.946   0.832  -4.997
  846    HHC  HEC 105           HHC      HEC 105  -2.090   3.697  -9.749
  847    HHD  HEC 105           HHD      HEC 105   1.077   0.140 -13.898
  848   1HMA  HEC 105          1HMA      HEC 105   2.288  -1.947  -4.031
  849   2HMA  HEC 105          2HMA      HEC 105   2.377  -0.188  -3.952
  850   3HMA  HEC 105          3HMA      HEC 105   3.854  -1.139  -4.096
  851   1HAA  HEC 105          1HAA      HEC 105   4.924  -2.567  -5.565
  852   2HAA  HEC 105          2HAA      HEC 105   5.095  -2.879  -7.283
  853   1HBA  HEC 105          1HBA      HEC 105   2.668  -4.104  -6.519
  854   2HBA  HEC 105          2HBA      HEC 105   3.837  -4.508  -5.261
  855   1HMB  HEC 105          1HMB      HEC 105  -2.034   3.031  -4.563
  856   2HMB  HEC 105          2HMB      HEC 105  -0.343   3.490  -4.375
  857   3HMB  HEC 105          3HMB      HEC 105  -0.819   1.803  -4.199
  858    HAB  HEC 105           HAB      HEC 105  -2.670   4.653  -8.008
  859   1HBB  HEC 105          1HBB      HEC 105  -2.888   6.063  -6.219
  860   2HBB  HEC 105          2HBB      HEC 105  -1.210   5.526  -6.120
  861   3HBB  HEC 105          3HBB      HEC 105  -2.425   4.826  -5.051
  862   1HMC  HEC 105          1HMC      HEC 105  -3.206   3.281 -12.992
  863   2HMC  HEC 105          2HMC      HEC 105  -2.750   4.201 -11.557
  864   3HMC  HEC 105          3HMC      HEC 105  -1.962   4.527 -13.101
  865    HAC  HEC 105           HAC      HEC 105  -0.004   1.555 -14.993
  866   1HBC  HEC 105          1HBC      HEC 105  -2.244   3.513 -14.927
  867   2HBC  HEC 105          2HBC      HEC 105  -1.072   3.189 -16.205
  868   3HBC  HEC 105          3HBC      HEC 105  -0.561   4.003 -14.725
  869   1HMD  HEC 105          1HMD      HEC 105   3.941  -2.315 -14.313
  870   2HMD  HEC 105          2HMD      HEC 105   2.196  -2.243 -14.558
  871   3HMD  HEC 105          3HMD      HEC 105   3.163  -0.771 -14.663
  872   1HAD  HEC 105          1HAD      HEC 105   5.489  -2.739 -12.082
  873   2HAD  HEC 105          2HAD      HEC 105   4.639  -3.656 -10.851
  874   1HBD  HEC 105          1HBD      HEC 105   3.328  -3.886 -13.435
  875   2HBD  HEC 105          2HBD      HEC 105   3.910  -5.154 -12.359
  Start of MODEL   20
    1   1H    GLY   1          1HT       GLY   1 -10.173   7.797   8.747
    2   2H    GLY   1          2HT       GLY   1  -9.681   9.313   9.334
    3   3H    GLY   1          3HT       GLY   1  -8.761   8.519   8.146
    4   1HA   GLY   1          1HA       GLY   1 -10.747  10.383   7.733
    5   2HA   GLY   1          2HA       GLY   1  -9.954   9.389   6.510
    6    H    ASP   2           H        ASP   2 -12.098   9.436   5.426
    7    HA   ASP   2           HA       ASP   2 -14.287   7.971   6.734
    8   1HB   ASP   2          2HB       ASP   2 -13.926   9.490   4.188
    9   2HB   ASP   2          1HB       ASP   2 -15.182   8.252   4.229
   10    H    VAL   3           H        VAL   3 -15.310   6.112   5.486
   11    HA   VAL   3           HA       VAL   3 -13.155   4.252   4.650
   12    HB   VAL   3           HB       VAL   3 -16.081   3.758   5.283
   13   1HG1  VAL   3          1HG1      VAL   3 -13.801   1.973   4.453
   14   2HG1  VAL   3          2HG1      VAL   3 -15.457   2.001   3.849
   15   3HG1  VAL   3          3HG1      VAL   3 -15.114   1.344   5.449
   16   1HG2  VAL   3          1HG2      VAL   3 -13.528   3.644   6.860
   17   2HG2  VAL   3          2HG2      VAL   3 -14.815   2.497   7.233
   18   3HG2  VAL   3          3HG2      VAL   3 -15.117   4.230   7.353
   19    H    GLU   4           H        GLU   4 -16.495   4.973   3.554
   20    HA   GLU   4           HA       GLU   4 -16.139   3.829   0.960
   21   1HB   GLU   4          2HB       GLU   4 -18.239   5.030   2.381
   22   2HB   GLU   4          1HB       GLU   4 -18.013   6.053   0.962
   23   1HG   GLU   4          2HG       GLU   4 -17.793   3.425   0.000
   24   2HG   GLU   4          1HG       GLU   4 -19.148   3.385   1.130
   25    H    LYS   5           H        LYS   5 -14.906   6.694   2.319
   26    HA   LYS   5           HA       LYS   5 -14.784   8.250  -0.143
   27   1HB   LYS   5          2HB       LYS   5 -14.589   8.950   2.446
   28   2HB   LYS   5          1HB       LYS   5 -12.872   8.779   2.081
   29   1HG   LYS   5          2HG       LYS   5 -12.879  10.517   0.555
   30   2HG   LYS   5          1HG       LYS   5 -14.579  10.288   0.142
   31   1HD   LYS   5          2HD       LYS   5 -13.905  11.132   2.933
   32   2HD   LYS   5          1HD       LYS   5 -13.810  12.338   1.649
   33   1HE   LYS   5          2HE       LYS   5 -16.129  11.805   0.980
   34   2HE   LYS   5          1HE       LYS   5 -16.224  10.613   2.276
   35   1HZ   LYS   5          1HZ       LYS   5 -15.326  13.191   3.166
   36   2HZ   LYS   5          2HZ       LYS   5 -16.547  12.191   3.794
   37   3HZ   LYS   5          3HZ       LYS   5 -16.884  13.232   2.494
   38    H    GLY   6           H        GLY   6 -12.176   6.823   1.866
   39   1HA   GLY   6          1HA       GLY   6 -10.141   7.041  -0.086
   40   2HA   GLY   6          2HA       GLY   6 -10.138   5.855   1.218
   41    H    LYS   7           H        LYS   7 -12.645   4.595   0.339
   42    HA   LYS   7           HA       LYS   7 -11.552   2.644  -1.451
   43   1HB   LYS   7          2HB       LYS   7 -13.555   2.454   0.210
   44   2HB   LYS   7          1HB       LYS   7 -14.513   3.092  -1.127
   45   1HG   LYS   7          2HG       LYS   7 -13.445   1.253  -2.563
   46   2HG   LYS   7          1HG       LYS   7 -12.902   0.538  -1.045
   47   1HD   LYS   7          2HD       LYS   7 -15.169   0.295  -0.263
   48   2HD   LYS   7          1HD       LYS   7 -15.792   1.233  -1.621
   49   1HE   LYS   7          2HE       LYS   7 -14.577  -0.613  -3.062
   50   2HE   LYS   7          1HE       LYS   7 -14.722  -1.570  -1.589
   51   1HZ   LYS   7          1HZ       LYS   7 -16.931  -1.733  -1.813
   52   2HZ   LYS   7          2HZ       LYS   7 -16.636  -1.357  -3.443
   53   3HZ   LYS   7          3HZ       LYS   7 -17.112  -0.138  -2.360
   54    H    LYS   8           H        LYS   8 -13.502   5.540  -1.968
   55    HA   LYS   8           HA       LYS   8 -14.003   4.947  -4.775
   56   1HB   LYS   8          2HB       LYS   8 -15.321   6.528  -3.129
   57   2HB   LYS   8          1HB       LYS   8 -14.131   7.724  -3.641
   58   1HG   LYS   8          2HG       LYS   8 -15.045   7.914  -5.710
   59   2HG   LYS   8          1HG       LYS   8 -15.262   6.171  -5.865
   60   1HD   LYS   8          2HD       LYS   8 -17.245   6.315  -4.365
   61   2HD   LYS   8          1HD       LYS   8 -17.054   8.067  -4.321
   62   1HE   LYS   8          2HE       LYS   8 -18.128   8.278  -6.286
   63   2HE   LYS   8          1HE       LYS   8 -17.003   7.159  -7.057
   64   1HZ   LYS   8          1HZ       LYS   8 -19.430   6.496  -7.010
   65   2HZ   LYS   8          2HZ       LYS   8 -19.226   6.217  -5.347
   66   3HZ   LYS   8          3HZ       LYS   8 -18.317   5.333  -6.479
   67    H    ILE   9           H        ILE   9 -11.456   6.458  -2.942
   68    HA   ILE   9           HA       ILE   9 -10.315   7.977  -5.122
   69    HB   ILE   9           HB       ILE   9  -8.778   6.822  -2.785
   70   1HG1  ILE   9          2HG1      ILE   9 -10.466   9.345  -2.867
   71   2HG1  ILE   9          1HG1      ILE   9 -10.835   7.896  -1.934
   72   1HG2  ILE   9          1HG2      ILE   9  -7.631   9.111  -3.088
   73   2HG2  ILE   9          2HG2      ILE   9  -8.483   9.196  -4.631
   74   3HG2  ILE   9          3HG2      ILE   9  -7.329   7.896  -4.332
   75   1HD1  ILE   9          1HD1      ILE   9  -8.809  10.004  -1.426
   76   2HD1  ILE   9          2HD1      ILE   9  -8.300   8.348  -1.093
   77   3HD1  ILE   9          3HD1      ILE   9  -9.717   9.016  -0.281
   78    H    PHE  10           H        PHE  10  -9.345   4.865  -3.632
   79    HA   PHE  10           HA       PHE  10  -7.430   4.213  -5.656
   80   1HB   PHE  10          2HB       PHE  10  -7.553   3.085  -3.432
   81   2HB   PHE  10          1HB       PHE  10  -9.055   2.309  -3.939
   82    HD1  PHE  10           HD1      PHE  10  -8.956   1.020  -6.229
   83    HD2  PHE  10           HD2      PHE  10  -5.520   2.012  -3.851
   84    HE1  PHE  10           HE1      PHE  10  -7.657  -0.763  -7.363
   85    HE2  PHE  10           HE2      PHE  10  -4.221   0.230  -4.984
   86    HZ   PHE  10           HZ       PHE  10  -5.290  -1.157  -6.738
   87    H    ILE  11           H        ILE  11 -10.891   3.509  -5.313
   88    HA   ILE  11           HA       ILE  11 -11.170   1.775  -7.542
   89    HB   ILE  11           HB       ILE  11 -13.030   3.669  -6.118
   90   1HG1  ILE  11          2HG1      ILE  11 -13.156   0.681  -6.612
   91   2HG1  ILE  11          1HG1      ILE  11 -12.370   1.403  -5.207
   92   1HG2  ILE  11          1HG2      ILE  11 -13.752   1.986  -8.539
   93   2HG2  ILE  11          2HG2      ILE  11 -13.663   3.747  -8.520
   94   3HG2  ILE  11          3HG2      ILE  11 -14.878   2.914  -7.550
   95   1HD1  ILE  11          1HD1      ILE  11 -14.942   0.654  -5.154
   96   2HD1  ILE  11          2HD1      ILE  11 -15.159   2.276  -5.812
   97   3HD1  ILE  11          3HD1      ILE  11 -14.363   2.054  -4.254
   98    H    MET  12           H        MET  12 -10.773   5.255  -7.356
   99    HA   MET  12           HA       MET  12 -11.089   5.368 -10.330
  100   1HB   MET  12          2HB       MET  12 -12.425   6.882  -8.484
  101   2HB   MET  12          1HB       MET  12 -11.047   7.922  -8.853
  102   1HG   MET  12          2HG       MET  12 -11.633   8.136 -11.094
  103   2HG   MET  12          1HG       MET  12 -12.526   6.616 -11.112
  104   1HE   MET  12          1HE       MET  12 -14.749   9.522 -12.129
  105   2HE   MET  12          2HE       MET  12 -13.053   9.106 -12.362
  106   3HE   MET  12          3HE       MET  12 -13.483  10.481 -11.349
  107    H    LYS  13           H        LYS  13  -8.720   5.035  -8.150
  108    HA   LYS  13           HA       LYS  13  -6.904   6.946  -9.560
  109   1HB   LYS  13          2HB       LYS  13  -7.214   7.135  -7.011
  110   2HB   LYS  13          1HB       LYS  13  -6.303   5.627  -6.912
  111   1HG   LYS  13          2HG       LYS  13  -4.363   6.725  -7.221
  112   2HG   LYS  13          1HG       LYS  13  -4.972   7.447  -8.711
  113   1HD   LYS  13          2HD       LYS  13  -6.193   8.660  -6.362
  114   2HD   LYS  13          1HD       LYS  13  -4.435   8.799  -6.326
  115   1HE   LYS  13          2HE       LYS  13  -4.647   9.554  -8.795
  116   2HE   LYS  13          1HE       LYS  13  -6.353   9.805  -8.424
  117   1HZ   LYS  13          1HZ       LYS  13  -4.312  10.913  -6.626
  118   2HZ   LYS  13          2HZ       LYS  13  -5.885  11.470  -6.943
  119   3HZ   LYS  13          3HZ       LYS  13  -4.647  11.716  -8.082
  120    H    CYS  14           H        CYS  14  -6.515   3.833  -7.794
  121    HA   CYS  14           HA       CYS  14  -4.826   2.956 -10.103
  122   1HB   CYS  14          2HB       CYS  14  -4.432   1.372  -7.690
  123   2HB   CYS  14          1HB       CYS  14  -3.238   2.219  -8.669
  124    H    SER  15           H        SER  15  -7.747   2.670  -9.843
  125    HA   SER  15           HA       SER  15  -8.129  -0.216  -9.316
  126   1HB   SER  15          2HB       SER  15  -9.791   1.775  -8.796
  127   2HB   SER  15          1HB       SER  15 -10.251   1.559 -10.480
  128    HG   SER  15           HG       SER  15 -10.427  -0.755  -9.868
  129    H    GLN  16           H        GLN  16  -6.756   1.349 -11.751
  130    HA   GLN  16           HA       GLN  16  -8.182  -0.092 -13.931
  131   1HB   GLN  16          2HB       GLN  16  -6.752   2.430 -13.741
  132   2HB   GLN  16          1HB       GLN  16  -6.074   1.422 -15.021
  133   1HG   GLN  16          2HG       GLN  16  -8.203   1.211 -16.105
  134   2HG   GLN  16          1HG       GLN  16  -9.047   1.912 -14.723
  135   1HE2  GLN  16          1HE2      GLN  16  -8.989   4.236 -14.466
  136   2HE2  GLN  16          2HE2      GLN  16  -8.373   5.262 -15.669
  137    H    CYS  17           H        CYS  17  -4.901   0.447 -12.633
  138    HA   CYS  17           HA       CYS  17  -3.928  -1.897 -14.155
  139   1HB   CYS  17          2HB       CYS  17  -2.529   0.181 -12.445
  140   2HB   CYS  17          1HB       CYS  17  -1.700  -1.190 -13.182
  141    H    HIS  18           H        HIS  18  -4.841  -0.958 -10.909
  142    HA   HIS  18           HA       HIS  18  -3.883  -3.620  -9.924
  143   1HB   HIS  18          2HB       HIS  18  -4.446  -1.068  -8.393
  144   2HB   HIS  18          1HB       HIS  18  -4.054  -2.611  -7.640
  145    HD1  HIS  18           HD1      HIS  18  -1.603  -3.361  -7.677
  146    HD2  HIS  18           HD2      HIS  18  -2.290   0.119  -9.852
  147    HE1  HIS  18           HE1      HIS  18   0.677  -2.386  -8.208
  148    H    THR  19           H        THR  19  -5.883  -4.600 -10.766
  149    HA   THR  19           HA       THR  19  -8.443  -3.717  -9.663
  150    HB   THR  19           HB       THR  19  -9.410  -5.428 -10.964
  151    HG1  THR  19           HG1      THR  19  -6.897  -6.693 -10.686
  152   1HG2  THR  19          1HG2      THR  19  -7.755  -3.725 -12.176
  153   2HG2  THR  19          2HG2      THR  19  -8.578  -5.000 -13.074
  154   3HG2  THR  19          3HG2      THR  19  -6.902  -5.217 -12.572
  155    H    VAL  20           H        VAL  20  -8.039  -3.826  -7.379
  156    HA   VAL  20           HA       VAL  20  -7.150  -6.321  -6.157
  157    HB   VAL  20           HB       VAL  20  -7.386  -5.164  -4.063
  158   1HG1  VAL  20          1HG1      VAL  20  -6.648  -2.941  -5.953
  159   2HG1  VAL  20          2HG1      VAL  20  -5.634  -4.379  -5.821
  160   3HG1  VAL  20          3HG1      VAL  20  -5.916  -3.367  -4.405
  161   1HG2  VAL  20          1HG2      VAL  20  -9.271  -3.459  -5.657
  162   2HG2  VAL  20          2HG2      VAL  20  -8.434  -2.741  -4.281
  163   3HG2  VAL  20          3HG2      VAL  20  -9.477  -4.142  -4.044
  164    H    GLU  21           H        GLU  21  -9.934  -5.767  -7.672
  165    HA   GLU  21           HA       GLU  21 -11.442  -7.498  -5.774
  166   1HB   GLU  21          2HB       GLU  21 -12.170  -4.790  -6.719
  167   2HB   GLU  21          1HB       GLU  21 -13.455  -5.993  -6.838
  168   1HG   GLU  21          2HG       GLU  21 -13.089  -6.593  -4.456
  169   2HG   GLU  21          1HG       GLU  21 -11.861  -5.333  -4.344
  170    H    LYS  22           H        LYS  22 -10.004  -7.639  -8.528
  171    HA   LYS  22           HA       LYS  22 -12.246  -8.424 -10.281
  172   1HB   LYS  22          2HB       LYS  22 -10.152  -7.227 -11.104
  173   2HB   LYS  22          1HB       LYS  22  -9.284  -8.736 -10.821
  174   1HG   LYS  22          2HG       LYS  22  -9.914  -8.853 -13.100
  175   2HG   LYS  22          1HG       LYS  22 -11.115  -9.843 -12.268
  176   1HD   LYS  22          2HD       LYS  22 -12.769  -8.507 -13.001
  177   2HD   LYS  22          1HD       LYS  22 -11.994  -7.105 -12.263
  178   1HE   LYS  22          2HE       LYS  22 -10.436  -7.101 -14.311
  179   2HE   LYS  22          1HE       LYS  22 -11.595  -8.208 -15.047
  180   1HZ   LYS  22          1HZ       LYS  22 -13.283  -6.402 -14.255
  181   2HZ   LYS  22          2HZ       LYS  22 -12.431  -6.209 -15.713
  182   3HZ   LYS  22          3HZ       LYS  22 -11.922  -5.390 -14.313
  183    H    GLY  23           H        GLY  23  -9.275 -10.026  -9.057
  184   1HA   GLY  23          2HA       GLY  23  -9.970 -12.242  -7.841
  185   2HA   GLY  23          1HA       GLY  23 -10.664 -12.637  -9.413
  186    H    GLY  24           H        GLY  24  -7.561 -11.385  -8.118
  187   1HA   GLY  24          1HA       GLY  24  -5.355 -11.947  -8.683
  188   2HA   GLY  24          2HA       GLY  24  -5.982 -13.558  -9.036
  189    H    LYS  25           H        LYS  25  -7.443 -10.979 -10.782
  190    HA   LYS  25           HA       LYS  25  -6.050 -11.909 -13.243
  191   1HB   LYS  25          2HB       LYS  25  -8.656 -11.752 -12.923
  192   2HB   LYS  25          1HB       LYS  25  -8.401 -10.035 -13.240
  193   1HG   LYS  25          2HG       LYS  25  -8.436 -10.546 -15.437
  194   2HG   LYS  25          1HG       LYS  25  -6.874 -11.329 -15.192
  195   1HD   LYS  25          2HD       LYS  25  -9.069 -13.029 -14.312
  196   2HD   LYS  25          1HD       LYS  25  -9.239 -12.578 -16.009
  197   1HE   LYS  25          2HE       LYS  25  -6.483 -13.253 -15.336
  198   2HE   LYS  25          1HE       LYS  25  -7.586 -14.588 -15.004
  199   1HZ   LYS  25          1HZ       LYS  25  -6.944 -13.293 -17.548
  200   2HZ   LYS  25          2HZ       LYS  25  -8.518 -13.895 -17.338
  201   3HZ   LYS  25          3HZ       LYS  25  -7.182 -14.936 -17.201
  202    H    HIS  26           H        HIS  26  -4.139 -10.579 -12.434
  203    HA   HIS  26           HA       HIS  26  -4.435  -7.677 -12.485
  204   1HB   HIS  26          2HB       HIS  26  -1.792  -7.893 -12.604
  205   2HB   HIS  26          1HB       HIS  26  -2.660  -8.204 -11.105
  206    HD1  HIS  26           HD1      HIS  26  -2.662 -10.718 -13.928
  207    HD2  HIS  26           HD2      HIS  26  -0.805 -10.166 -10.234
  208    HE1  HIS  26           HE1      HIS  26  -1.477 -12.886 -13.391
  209    H    LYS  27           H        LYS  27  -4.294  -6.385 -14.245
  210    HA   LYS  27           HA       LYS  27  -3.535  -7.637 -16.813
  211   1HB   LYS  27          2HB       LYS  27  -5.374  -5.443 -16.017
  212   2HB   LYS  27          1HB       LYS  27  -4.538  -5.249 -17.558
  213   1HG   LYS  27          2HG       LYS  27  -6.155  -6.562 -18.434
  214   2HG   LYS  27          1HG       LYS  27  -5.353  -7.900 -17.611
  215   1HD   LYS  27          2HD       LYS  27  -7.618  -8.006 -16.893
  216   2HD   LYS  27          1HD       LYS  27  -6.750  -7.256 -15.551
  217   1HE   LYS  27          2HE       LYS  27  -7.473  -5.144 -17.277
  218   2HE   LYS  27          1HE       LYS  27  -8.900  -6.170 -17.148
  219   1HZ   LYS  27          1HZ       LYS  27  -8.678  -6.090 -14.733
  220   2HZ   LYS  27          2HZ       LYS  27  -8.867  -4.535 -15.390
  221   3HZ   LYS  27          3HZ       LYS  27  -7.336  -5.064 -14.878
  222    H    THR  28           H        THR  28  -3.396  -4.213 -15.885
  223    HA   THR  28           HA       THR  28  -0.648  -4.098 -16.982
  224    HB   THR  28           HB       THR  28  -2.473  -1.889 -15.981
  225    HG1  THR  28           HG1      THR  28  -2.042  -3.136 -18.437
  226   1HG2  THR  28          1HG2      THR  28  -0.112  -1.478 -17.778
  227   2HG2  THR  28          2HG2      THR  28   0.162  -1.657 -16.045
  228   3HG2  THR  28          3HG2      THR  28  -0.863  -0.354 -16.645
  229    H    GLY  29           H        GLY  29  -2.370  -3.748 -13.926
  230   1HA   GLY  29          2HA       GLY  29   0.237  -3.252 -12.560
  231   2HA   GLY  29          1HA       GLY  29  -1.330  -2.843 -11.884
  232    HA   PRO  30           HA       PRO  30   0.142  -7.254 -10.753
  233   1HB   PRO  30          2HB       PRO  30   1.198  -6.699  -8.268
  234   2HB   PRO  30          1HB       PRO  30   2.159  -6.782  -9.756
  235   1HG   PRO  30          2HG       PRO  30   1.192  -4.358  -8.276
  236   2HG   PRO  30          1HG       PRO  30   2.709  -4.602  -9.162
  237   1HD   PRO  30          2HD       PRO  30   0.556  -3.207 -10.200
  238   2HD   PRO  30          1HD       PRO  30   1.766  -4.042 -11.192
  239    H    ASN  31           H        ASN  31  -1.389  -8.466  -9.696
  240    HA   ASN  31           HA       ASN  31  -3.784  -7.392  -8.726
  241   1HB   ASN  31          2HB       ASN  31  -3.714  -9.725  -9.254
  242   2HB   ASN  31          1HB       ASN  31  -2.414 -10.017  -8.097
  243   1HD2  ASN  31          1HD2      ASN  31  -5.610  -8.336  -7.858
  244   2HD2  ASN  31          2HD2      ASN  31  -6.114  -9.189  -6.479
  245    H    LEU  32           H        LEU  32  -3.672  -5.788  -7.192
  246    HA   LEU  32           HA       LEU  32  -1.955  -6.016  -4.850
  247   1HB   LEU  32          2HB       LEU  32  -3.583  -3.967  -6.132
  248   2HB   LEU  32          1HB       LEU  32  -3.826  -3.982  -4.389
  249    HG   LEU  32           HG       LEU  32  -1.599  -3.444  -3.938
  250   1HD1  LEU  32          1HD1      LEU  32  -1.055  -4.768  -6.575
  251   2HD1  LEU  32          2HD1      LEU  32  -0.295  -5.048  -5.008
  252   3HD1  LEU  32          3HD1      LEU  32   0.111  -3.607  -5.942
  253   1HD2  LEU  32          1HD2      LEU  32  -2.129  -1.412  -4.837
  254   2HD2  LEU  32          2HD2      LEU  32  -2.697  -2.121  -6.349
  255   3HD2  LEU  32          3HD2      LEU  32  -0.971  -1.883  -6.081
  256    H    HIS  33           H        HIS  33  -3.073  -8.195  -4.320
  257    HA   HIS  33           HA       HIS  33  -5.675  -7.799  -2.931
  258   1HB   HIS  33          2HB       HIS  33  -5.275  -9.728  -4.578
  259   2HB   HIS  33          1HB       HIS  33  -4.217 -10.417  -3.348
  260    HD1  HIS  33           HD1      HIS  33  -5.330 -11.768  -1.556
  261    HD2  HIS  33           HD2      HIS  33  -8.041  -9.295  -3.536
  262    HE1  HIS  33           HE1      HIS  33  -7.624 -12.358  -0.659
  263    H    GLY  34           H        GLY  34  -2.444  -9.220  -2.367
  264   1HA   GLY  34          2HA       GLY  34  -2.840  -8.657   0.545
  265   2HA   GLY  34          1HA       GLY  34  -1.997 -10.098  -0.027
  266    H    LEU  35           H        LEU  35  -1.752  -6.845  -1.389
  267    HA   LEU  35           HA       LEU  35   1.012  -6.815  -1.733
  268   1HB   LEU  35          2HB       LEU  35  -0.800  -5.099  -2.455
  269   2HB   LEU  35          1HB       LEU  35  -0.483  -4.337  -0.899
  270    HG   LEU  35           HG       LEU  35   1.597  -4.919  -3.029
  271   1HD1  LEU  35          1HD1      LEU  35   1.617  -2.245  -2.746
  272   2HD1  LEU  35          2HD1      LEU  35  -0.073  -2.546  -2.345
  273   3HD1  LEU  35          3HD1      LEU  35   0.567  -3.058  -3.907
  274   1HD2  LEU  35          1HD2      LEU  35   2.816  -4.968  -1.047
  275   2HD2  LEU  35          2HD2      LEU  35   1.702  -3.881  -0.216
  276   3HD2  LEU  35          3HD2      LEU  35   2.841  -3.240  -1.399
  277    H    PHE  36           H        PHE  36  -0.792  -5.536   1.082
  278    HA   PHE  36           HA       PHE  36   1.490  -4.757   2.591
  279   1HB   PHE  36          2HB       PHE  36  -1.258  -5.672   3.478
  280   2HB   PHE  36          1HB       PHE  36  -0.055  -4.986   4.570
  281    HD1  PHE  36           HD1      PHE  36   1.191  -2.908   2.878
  282    HD2  PHE  36           HD2      PHE  36  -2.934  -4.024   3.310
  283    HE1  PHE  36           HE1      PHE  36   0.502  -0.623   2.204
  284    HE2  PHE  36           HE2      PHE  36  -3.622  -1.740   2.636
  285    HZ   PHE  36           HZ       PHE  36  -1.907  -0.041   2.084
  286    H    GLY  37           H        GLY  37   2.864  -5.895   3.926
  287   1HA   GLY  37          2HA       GLY  37   3.842  -7.732   5.015
  288   2HA   GLY  37          1HA       GLY  37   2.266  -8.520   4.965
  289    H    ARG  38           H        ARG  38   3.688  -7.381   1.989
  290    HA   ARG  38           HA       ARG  38   4.745 -10.081   1.372
  291   1HB   ARG  38          2HB       ARG  38   2.311 -10.019   0.707
  292   2HB   ARG  38          1HB       ARG  38   2.715  -8.725  -0.423
  293   1HG   ARG  38          2HG       ARG  38   4.549 -10.376  -1.277
  294   2HG   ARG  38          1HG       ARG  38   3.577 -11.608  -0.473
  295   1HD   ARG  38          2HD       ARG  38   3.054 -11.164  -2.949
  296   2HD   ARG  38          1HD       ARG  38   1.686 -11.162  -1.838
  297    HE   ARG  38           HE       ARG  38   1.556  -8.762  -2.061
  298   1HH1  ARG  38          1HH2      ARG  38   4.538  -9.866  -3.287
  299   2HH1  ARG  38          2HH2      ARG  38   4.649  -8.660  -4.524
  300   1HH2  ARG  38          1HH1      ARG  38   1.501  -7.348  -3.895
  301   2HH2  ARG  38          2HH1      ARG  38   2.928  -7.234  -4.869
  302    H    LYS  39           H        LYS  39   6.733  -9.707   0.542
  303    HA   LYS  39           HA       LYS  39   7.532  -7.115  -0.462
  304   1HB   LYS  39          2HB       LYS  39   9.675  -8.149  -0.895
  305   2HB   LYS  39          1HB       LYS  39   9.073  -8.787   0.636
  306   1HG   LYS  39          2HG       LYS  39   8.150 -10.757  -0.622
  307   2HG   LYS  39          1HG       LYS  39   8.951 -10.146  -2.070
  308   1HD   LYS  39          2HD       LYS  39  11.113 -10.445  -1.137
  309   2HD   LYS  39          1HD       LYS  39  10.469 -10.625   0.495
  310   1HE   LYS  39          2HE       LYS  39   9.208 -12.689  -0.505
  311   2HE   LYS  39          1HE       LYS  39  10.425 -12.592  -1.779
  312   1HZ   LYS  39          1HZ       LYS  39  10.990 -14.048   0.167
  313   2HZ   LYS  39          2HZ       LYS  39  11.117 -12.635   1.101
  314   3HZ   LYS  39          3HZ       LYS  39  12.151 -12.874  -0.226
  315    H    THR  40           H        THR  40   8.454  -6.839  -2.708
  316    HA   THR  40           HA       THR  40   6.489  -7.487  -4.684
  317    HB   THR  40           HB       THR  40   9.175  -6.898  -5.725
  318    HG1  THR  40           HG1      THR  40   7.913  -5.097  -3.934
  319   1HG2  THR  40          1HG2      THR  40   6.952  -4.953  -5.896
  320   2HG2  THR  40          2HG2      THR  40   6.610  -6.553  -6.555
  321   3HG2  THR  40          3HG2      THR  40   7.970  -5.616  -7.174
  322    H    GLY  41           H        GLY  41   7.100  -8.669  -6.782
  323   1HA   GLY  41          1HA       GLY  41   7.876 -10.593  -7.899
  324   2HA   GLY  41          2HA       GLY  41   9.118 -10.748  -6.656
  325    H    GLN  42           H        GLN  42   5.724 -11.462  -7.403
  326    HA   GLN  42           HA       GLN  42   5.909 -13.827  -5.631
  327   1HB   GLN  42          2HB       GLN  42   4.565 -11.431  -4.855
  328   2HB   GLN  42          1HB       GLN  42   3.336 -12.649  -5.193
  329   1HG   GLN  42          2HG       GLN  42   4.178 -12.659  -2.812
  330   2HG   GLN  42          1HG       GLN  42   4.344 -14.204  -3.647
  331   1HE2  GLN  42          1HE2      GLN  42   6.230 -11.227  -2.886
  332   2HE2  GLN  42          2HE2      GLN  42   7.731 -12.018  -2.828
  333    H    ALA  43           H        ALA  43   3.990 -11.957  -7.977
  334    HA   ALA  43           HA       ALA  43   2.312 -14.254  -8.640
  335   1HB   ALA  43          1HB       ALA  43   1.494 -12.756 -10.486
  336   2HB   ALA  43          2HB       ALA  43   2.677 -11.554  -9.971
  337   3HB   ALA  43          3HB       ALA  43   1.371 -12.030  -8.884
  338    HA   PRO  44           HA       PRO  44   5.191 -15.948 -11.555
  339   1HB   PRO  44          2HB       PRO  44   3.498 -17.852 -12.580
  340   2HB   PRO  44          1HB       PRO  44   4.303 -18.004 -11.008
  341   1HG   PRO  44          2HG       PRO  44   1.449 -17.384 -11.599
  342   2HG   PRO  44          1HG       PRO  44   2.159 -18.135 -10.161
  343   1HD   PRO  44          2HD       PRO  44   1.317 -15.437 -10.390
  344   2HD   PRO  44          1HD       PRO  44   2.300 -16.120  -9.077
  345    H    GLY  45           H        GLY  45   2.018 -16.326 -13.122
  346   1HA   GLY  45          2HA       GLY  45   2.696 -15.793 -15.728
  347   2HA   GLY  45          1HA       GLY  45   1.144 -15.284 -15.062
  348    H    TYR  46           H        TYR  46   2.189 -13.383 -13.188
  349    HA   TYR  46           HA       TYR  46   2.629 -11.124 -14.999
  350   1HB   TYR  46          2HB       TYR  46   1.314 -11.223 -12.712
  351   2HB   TYR  46          1HB       TYR  46   2.911 -10.965 -12.013
  352    HD1  TYR  46           HD1      TYR  46   0.190  -9.183 -12.453
  353    HD2  TYR  46           HD2      TYR  46   4.181  -9.151 -13.985
  354    HE1  TYR  46           HE1      TYR  46  -0.032  -6.776 -12.950
  355    HE2  TYR  46           HE2      TYR  46   3.971  -6.732 -14.476
  356    HH   TYR  46           HH       TYR  46   1.767  -4.788 -13.181
  357    H    SER  47           H        SER  47   4.640 -10.433 -15.603
  358    HA   SER  47           HA       SER  47   7.005 -11.573 -14.254
  359   1HB   SER  47          2HB       SER  47   8.279 -10.476 -16.040
  360   2HB   SER  47          1HB       SER  47   6.937 -11.370 -16.745
  361    HG   SER  47           HG       SER  47   6.101  -9.554 -17.395
  362    H    TYR  48           H        TYR  48   5.811 -10.194 -12.375
  363    HA   TYR  48           HA       TYR  48   5.757  -7.547 -11.937
  364   1HB   TYR  48          2HB       TYR  48   6.904  -9.746 -10.257
  365   2HB   TYR  48          1HB       TYR  48   7.047  -8.085  -9.696
  366    HD1  TYR  48           HD1      TYR  48   4.198  -9.273 -11.743
  367    HD2  TYR  48           HD2      TYR  48   5.578  -8.328  -7.820
  368    HE1  TYR  48           HE1      TYR  48   1.863  -9.361 -10.893
  369    HE2  TYR  48           HE2      TYR  48   3.263  -8.413  -6.971
  370    HH   TYR  48           HH       TYR  48   0.671  -9.674  -8.838
  371    H    THR  49           H        THR  49   7.190  -5.808 -11.650
  372    HA   THR  49           HA       THR  49   9.627  -5.891 -13.135
  373    HB   THR  49           HB       THR  49  10.038  -3.642 -12.073
  374    HG1  THR  49           HG1      THR  49   8.315  -2.872 -10.774
  375   1HG2  THR  49          1HG2      THR  49   7.198  -3.592 -12.915
  376   2HG2  THR  49          2HG2      THR  49   8.313  -4.386 -14.027
  377   3HG2  THR  49          3HG2      THR  49   8.579  -2.708 -13.561
  378    H    ALA  50           H        ALA  50  10.938  -7.507 -12.365
  379    HA   ALA  50           HA       ALA  50  11.655  -8.382  -9.899
  380   1HB   ALA  50          1HB       ALA  50  13.006  -8.182 -12.461
  381   2HB   ALA  50          2HB       ALA  50  13.116  -9.451 -11.242
  382   3HB   ALA  50          3HB       ALA  50  14.151  -8.029 -11.129
  383    H    ALA  51           H        ALA  51  12.704  -5.315 -11.344
  384    HA   ALA  51           HA       ALA  51  14.655  -4.428  -9.609
  385   1HB   ALA  51          1HB       ALA  51  12.256  -2.728 -10.345
  386   2HB   ALA  51          2HB       ALA  51  13.566  -3.092 -11.468
  387   3HB   ALA  51          3HB       ALA  51  13.894  -2.172 -10.000
  388    H    ASN  52           H        ASN  52  11.225  -3.625  -8.963
  389    HA   ASN  52           HA       ASN  52  11.431  -2.914  -6.286
  390   1HB   ASN  52          2HB       ASN  52   9.302  -4.257  -7.902
  391   2HB   ASN  52          1HB       ASN  52   9.093  -4.212  -6.155
  392   1HD2  ASN  52          1HD2      ASN  52   7.293  -2.766  -7.762
  393   2HD2  ASN  52          2HD2      ASN  52   7.577  -1.104  -7.579
  394    H    LYS  53           H        LYS  53  11.097  -6.226  -7.557
  395    HA   LYS  53           HA       LYS  53  10.950  -7.596  -5.106
  396   1HB   LYS  53          2HB       LYS  53  10.617  -8.663  -7.309
  397   2HB   LYS  53          1HB       LYS  53  12.343  -8.506  -7.638
  398   1HG   LYS  53          2HG       LYS  53  12.036  -9.724  -5.068
  399   2HG   LYS  53          1HG       LYS  53  11.011 -10.589  -6.214
  400   1HD   LYS  53          2HD       LYS  53  12.787 -11.458  -7.316
  401   2HD   LYS  53          1HD       LYS  53  13.648  -9.919  -7.309
  402   1HE   LYS  53          2HE       LYS  53  14.467 -10.289  -5.084
  403   2HE   LYS  53          1HE       LYS  53  13.400 -11.674  -4.855
  404   1HZ   LYS  53          1HZ       LYS  53  15.640 -11.495  -6.796
  405   2HZ   LYS  53          2HZ       LYS  53  14.586 -12.817  -6.638
  406   3HZ   LYS  53          3HZ       LYS  53  15.630 -12.404  -5.364
  407    H    ASN  54           H        ASN  54  13.955  -7.653  -7.029
  408    HA   ASN  54           HA       ASN  54  15.614  -8.369  -4.876
  409   1HB   ASN  54          2HB       ASN  54  17.428  -8.024  -6.318
  410   2HB   ASN  54          1HB       ASN  54  16.095  -8.316  -7.434
  411   1HD2  ASN  54          1HD2      ASN  54  15.422  -6.568  -8.801
  412   2HD2  ASN  54          2HD2      ASN  54  16.214  -5.067  -8.829
  413    H    LYS  55           H        LYS  55  14.137  -5.315  -5.441
  414    HA   LYS  55           HA       LYS  55  16.118  -3.569  -4.398
  415   1HB   LYS  55          2HB       LYS  55  13.929  -2.897  -5.452
  416   2HB   LYS  55          1HB       LYS  55  13.139  -3.319  -3.932
  417   1HG   LYS  55          2HG       LYS  55  13.743  -0.869  -4.153
  418   2HG   LYS  55          1HG       LYS  55  14.407  -1.662  -2.725
  419   1HD   LYS  55          2HD       LYS  55  16.555  -1.479  -3.462
  420   2HD   LYS  55          1HD       LYS  55  16.111  -1.807  -5.137
  421   1HE   LYS  55          2HE       LYS  55  16.514   0.408  -5.450
  422   2HE   LYS  55          1HE       LYS  55  14.919   0.626  -4.732
  423   1HZ   LYS  55          1HZ       LYS  55  17.010   1.829  -3.760
  424   2HZ   LYS  55          2HZ       LYS  55  17.226   0.352  -2.948
  425   3HZ   LYS  55          3HZ       LYS  55  15.792   1.239  -2.736
  426    H    GLY  56           H        GLY  56  14.417  -6.088  -2.842
  427   1HA   GLY  56          1HA       GLY  56  14.368  -6.777  -0.600
  428   2HA   GLY  56          2HA       GLY  56  15.788  -5.754  -0.371
  429    H    ILE  57           H        ILE  57  12.308  -5.219  -1.050
  430    HA   ILE  57           HA       ILE  57  12.273  -3.324   1.258
  431    HB   ILE  57           HB       ILE  57  12.450  -2.178  -1.019
  432   1HG1  ILE  57          2HG1      ILE  57  11.522  -1.092   1.045
  433   2HG1  ILE  57          1HG1      ILE  57  10.807  -0.478  -0.444
  434   1HG2  ILE  57          1HG2      ILE  57   9.541  -2.777  -1.375
  435   2HG2  ILE  57          2HG2      ILE  57  10.709  -3.991  -1.895
  436   3HG2  ILE  57          3HG2      ILE  57  10.759  -2.367  -2.582
  437   1HD1  ILE  57          1HD1      ILE  57   9.022  -2.371  -0.022
  438   2HD1  ILE  57          2HD1      ILE  57   8.905  -0.843   0.851
  439   3HD1  ILE  57          3HD1      ILE  57   9.592  -2.260   1.644
  440    H    ILE  58           H        ILE  58  10.729  -4.002   2.669
  441    HA   ILE  58           HA       ILE  58   8.623  -5.842   1.746
  442    HB   ILE  58           HB       ILE  58   9.535  -6.418   3.875
  443   1HG1  ILE  58          2HG1      ILE  58   7.615  -6.385   5.294
  444   2HG1  ILE  58          1HG1      ILE  58   7.039  -4.870   4.601
  445   1HG2  ILE  58          1HG2      ILE  58  10.657  -4.683   4.839
  446   2HG2  ILE  58          2HG2      ILE  58   9.133  -4.422   5.686
  447   3HG2  ILE  58          3HG2      ILE  58   9.512  -3.482   4.244
  448   1HD1  ILE  58          1HD1      ILE  58   5.808  -6.916   3.779
  449   2HD1  ILE  58          2HD1      ILE  58   7.310  -7.435   3.013
  450   3HD1  ILE  58          3HD1      ILE  58   6.529  -5.941   2.499
  451    H    TRP  59           H        TRP  59   7.090  -4.727   0.577
  452    HA   TRP  59           HA       TRP  59   6.312  -2.105   0.674
  453   1HB   TRP  59          2HB       TRP  59   4.606  -4.568   0.300
  454   2HB   TRP  59          1HB       TRP  59   3.964  -2.938   0.097
  455    HD1  TRP  59           HD1      TRP  59   4.912  -5.452  -2.075
  456    HE1  TRP  59           HE1      TRP  59   6.124  -4.624  -4.194
  457    HE3  TRP  59           HE3      TRP  59   6.256  -0.761  -0.555
  458    HZ2  TRP  59           HZ2      TRP  59   7.487  -2.287  -5.120
  459    HZ3  TRP  59           HZ3      TRP  59   7.510   0.737  -2.072
  460    HH2  TRP  59           HH2      TRP  59   8.126  -0.018  -4.352
  461    H    GLY  60           H        GLY  60   6.069  -0.944   2.512
  462   1HA   GLY  60          1HA       GLY  60   4.119  -1.976   4.533
  463   2HA   GLY  60          2HA       GLY  60   5.584  -1.114   5.006
  464    H    GLU  61           H        GLU  61   4.089   0.440   6.048
  465    HA   GLU  61           HA       GLU  61   2.299   2.018   4.376
  466   1HB   GLU  61          2HB       GLU  61   3.336   2.645   7.155
  467   2HB   GLU  61          1HB       GLU  61   1.903   3.325   6.380
  468   1HG   GLU  61          2HG       GLU  61   0.663   1.588   7.092
  469   2HG   GLU  61          1HG       GLU  61   1.741   0.460   6.272
  470    H    ASP  62           H        ASP  62   5.255   2.900   6.212
  471    HA   ASP  62           HA       ASP  62   5.549   5.377   4.756
  472   1HB   ASP  62          2HB       ASP  62   7.837   4.109   6.215
  473   2HB   ASP  62          1HB       ASP  62   7.348   5.803   6.160
  474    H    THR  63           H        THR  63   7.028   2.166   4.536
  475    HA   THR  63           HA       THR  63   9.055   2.816   2.649
  476    HB   THR  63           HB       THR  63   7.981   0.193   2.122
  477    HG1  THR  63           HG1      THR  63   8.505  -0.350   4.490
  478   1HG2  THR  63          1HG2      THR  63  10.385   1.181   2.088
  479   2HG2  THR  63          2HG2      THR  63  10.167  -0.478   2.645
  480   3HG2  THR  63          3HG2      THR  63  10.384   0.824   3.815
  481    H    LEU  64           H        LEU  64   5.775   1.509   2.102
  482    HA   LEU  64           HA       LEU  64   5.895   1.629  -0.752
  483   1HB   LEU  64          2HB       LEU  64   4.128   0.574   0.960
  484   2HB   LEU  64          1HB       LEU  64   3.289   2.089   0.629
  485    HG   LEU  64           HG       LEU  64   4.265   0.123  -1.462
  486   1HD1  LEU  64          1HD1      LEU  64   2.360  -0.801  -0.323
  487   2HD1  LEU  64          2HD1      LEU  64   1.771  -0.131  -1.842
  488   3HD1  LEU  64          3HD1      LEU  64   1.525   0.750  -0.336
  489   1HD2  LEU  64          1HD2      LEU  64   2.775   1.625  -2.925
  490   2HD2  LEU  64          2HD2      LEU  64   4.324   2.305  -2.424
  491   3HD2  LEU  64          3HD2      LEU  64   2.840   2.789  -1.603
  492    H    MET  65           H        MET  65   4.913   4.005   1.687
  493    HA   MET  65           HA       MET  65   3.746   5.953   0.030
  494   1HB   MET  65          2HB       MET  65   3.693   6.312   2.388
  495   2HB   MET  65          1HB       MET  65   5.447   6.200   2.517
  496   1HG   MET  65          2HG       MET  65   4.325   8.309   0.723
  497   2HG   MET  65          1HG       MET  65   4.203   8.565   2.463
  498   1HE   MET  65          1HE       MET  65   5.387  10.225   3.032
  499   2HE   MET  65          2HE       MET  65   6.062  10.886   1.544
  500   3HE   MET  65          3HE       MET  65   7.124  10.528   2.904
  501    H    GLU  66           H        GLU  66   7.171   5.266   0.625
  502    HA   GLU  66           HA       GLU  66   8.168   7.537  -0.830
  503   1HB   GLU  66          2HB       GLU  66   9.447   6.122   0.857
  504   2HB   GLU  66          1HB       GLU  66   9.599   4.906  -0.413
  505   1HG   GLU  66          2HG       GLU  66  10.365   7.728  -1.051
  506   2HG   GLU  66          1HG       GLU  66  11.472   6.756  -0.080
  507    H    TYR  67           H        TYR  67   8.064   4.060  -1.735
  508    HA   TYR  67           HA       TYR  67   8.835   4.487  -4.446
  509   1HB   TYR  67          2HB       TYR  67   8.952   2.256  -3.614
  510   2HB   TYR  67          1HB       TYR  67   7.265   2.279  -3.102
  511    HD1  TYR  67           HD1      TYR  67   9.563   1.745  -5.896
  512    HD2  TYR  67           HD2      TYR  67   5.444   2.287  -4.803
  513    HE1  TYR  67           HE1      TYR  67   8.855   0.866  -8.104
  514    HE2  TYR  67           HE2      TYR  67   4.738   1.409  -7.008
  515    HH   TYR  67           HH       TYR  67   5.825  -0.194  -8.774
  516    H    LEU  68           H        LEU  68   5.926   5.286  -2.841
  517    HA   LEU  68           HA       LEU  68   4.263   5.118  -5.260
  518   1HB   LEU  68          2HB       LEU  68   3.656   5.067  -2.584
  519   2HB   LEU  68          1HB       LEU  68   3.277   6.739  -2.999
  520    HG   LEU  68           HG       LEU  68   1.888   5.921  -4.899
  521   1HD1  LEU  68          1HD1      LEU  68   1.807   3.732  -5.504
  522   2HD1  LEU  68          2HD1      LEU  68   1.747   3.179  -3.830
  523   3HD1  LEU  68          3HD1      LEU  68   3.297   3.577  -4.572
  524   1HD2  LEU  68          1HD2      LEU  68   1.078   6.272  -2.443
  525   2HD2  LEU  68          2HD2      LEU  68   0.985   4.512  -2.390
  526   3HD2  LEU  68          3HD2      LEU  68   0.017   5.412  -3.560
  527    H    GLU  69           H        GLU  69   5.570   7.706  -3.184
  528    HA   GLU  69           HA       GLU  69   4.710   9.887  -4.788
  529   1HB   GLU  69          2HB       GLU  69   5.929   9.726  -2.430
  530   2HB   GLU  69          1HB       GLU  69   7.369   9.942  -3.415
  531   1HG   GLU  69          2HG       GLU  69   6.067  11.925  -4.488
  532   2HG   GLU  69          1HG       GLU  69   5.038  11.818  -3.060
  533    H    ASN  70           H        ASN  70   7.136   7.494  -5.157
  534    HA   ASN  70           HA       ASN  70   7.770   8.383  -7.865
  535   1HB   ASN  70          2HB       ASN  70  10.169   8.119  -6.077
  536   2HB   ASN  70          1HB       ASN  70  10.010   8.982  -7.605
  537   1HD2  ASN  70          1HD2      ASN  70   9.550   9.236  -4.125
  538   2HD2  ASN  70          2HD2      ASN  70   9.141  10.883  -4.109
  539    HA   PRO  71           HA       PRO  71   7.932   3.891  -7.203
  540   1HB   PRO  71          2HB       PRO  71   6.737   3.300  -9.613
  541   2HB   PRO  71          1HB       PRO  71   5.841   3.645  -8.123
  542   1HG   PRO  71          2HG       PRO  71   6.241   5.379 -10.516
  543   2HG   PRO  71          1HG       PRO  71   4.920   5.381  -9.337
  544   1HD   PRO  71          2HD       PRO  71   7.071   7.216  -9.407
  545   2HD   PRO  71          1HD       PRO  71   5.943   6.985  -8.056
  546    H    LYS  72           H        LYS  72   8.493   5.392 -10.427
  547    HA   LYS  72           HA       LYS  72  10.440   3.418 -11.188
  548   1HB   LYS  72          2HB       LYS  72   9.033   5.111 -12.640
  549   2HB   LYS  72          1HB       LYS  72  10.413   6.173 -12.365
  550   1HG   LYS  72          2HG       LYS  72  11.084   3.398 -13.155
  551   2HG   LYS  72          1HG       LYS  72  10.292   4.368 -14.397
  552   1HD   LYS  72          2HD       LYS  72  12.087   6.174 -13.477
  553   2HD   LYS  72          1HD       LYS  72  12.980   4.682 -13.179
  554   1HE   LYS  72          2HE       LYS  72  11.701   5.404 -15.832
  555   2HE   LYS  72          1HE       LYS  72  13.407   5.638 -15.454
  556   1HZ   LYS  72          1HZ       LYS  72  11.910   3.130 -15.798
  557   2HZ   LYS  72          2HZ       LYS  72  13.292   3.150 -14.811
  558   3HZ   LYS  72          3HZ       LYS  72  13.408   3.583 -16.450
  559    H    LYS  73           H        LYS  73  10.580   6.401  -9.383
  560    HA   LYS  73           HA       LYS  73  13.464   6.742  -9.662
  561   1HB   LYS  73          2HB       LYS  73  11.647   7.891  -7.526
  562   2HB   LYS  73          1HB       LYS  73  13.226   8.500  -8.022
  563   1HG   LYS  73          2HG       LYS  73  12.032   8.568 -10.412
  564   2HG   LYS  73          1HG       LYS  73  10.591   8.723  -9.405
  565   1HD   LYS  73          2HD       LYS  73  11.299  10.956  -9.757
  566   2HD   LYS  73          1HD       LYS  73  11.892  10.558  -8.143
  567   1HE   LYS  73          2HE       LYS  73  14.108  10.316  -8.877
  568   2HE   LYS  73          1HE       LYS  73  13.625  10.082 -10.558
  569   1HZ   LYS  73          1HZ       LYS  73  14.430  12.432  -9.414
  570   2HZ   LYS  73          2HZ       LYS  73  12.743  12.593  -9.532
  571   3HZ   LYS  73          3HZ       LYS  73  13.666  12.258 -10.918
  572    H    TYR  74           H        TYR  74  11.284   5.327  -7.234
  573    HA   TYR  74           HA       TYR  74  13.362   4.741  -5.322
  574   1HB   TYR  74          2HB       TYR  74  10.866   4.785  -4.853
  575   2HB   TYR  74          1HB       TYR  74  10.753   3.243  -5.700
  576    HD1  TYR  74           HD1      TYR  74  10.537   1.471  -4.211
  577    HD2  TYR  74           HD2      TYR  74  13.200   4.699  -3.244
  578    HE1  TYR  74           HE1      TYR  74  11.225   0.283  -2.146
  579    HE2  TYR  74           HE2      TYR  74  13.890   3.509  -1.178
  580    HH   TYR  74           HH       TYR  74  13.928   1.292  -0.259
  581    H    ILE  75           H        ILE  75  11.529   2.493  -7.435
  582    HA   ILE  75           HA       ILE  75  13.979   0.816  -7.554
  583    HB   ILE  75           HB       ILE  75  11.065   0.257  -7.277
  584   1HG1  ILE  75          2HG1      ILE  75  12.857  -1.776  -6.359
  585   2HG1  ILE  75          1HG1      ILE  75  13.493  -0.204  -5.887
  586   1HG2  ILE  75          1HG2      ILE  75  11.910  -0.784  -9.517
  587   2HG2  ILE  75          2HG2      ILE  75  11.068  -1.812  -8.369
  588   3HG2  ILE  75          3HG2      ILE  75  12.825  -1.864  -8.469
  589   1HD1  ILE  75          1HD1      ILE  75  10.730  -0.047  -5.416
  590   2HD1  ILE  75          2HD1      ILE  75  12.001  -0.193  -4.203
  591   3HD1  ILE  75          3HD1      ILE  75  11.209  -1.638  -4.828
  592    HA   PRO  76           HA       PRO  76  13.772   2.020 -11.854
  593   1HB   PRO  76          2HB       PRO  76  16.058   0.688 -12.603
  594   2HB   PRO  76          1HB       PRO  76  16.067   2.258 -11.781
  595   1HG   PRO  76          2HG       PRO  76  16.716  -0.438 -10.685
  596   2HG   PRO  76          1HG       PRO  76  17.280   1.155 -10.154
  597   1HD   PRO  76          2HD       PRO  76  15.257  -0.387  -8.910
  598   2HD   PRO  76          1HD       PRO  76  15.605   1.327  -8.597
  599    H    GLY  77           H        GLY  77  11.821   0.393 -11.759
  600   1HA   GLY  77          2HA       GLY  77  12.301  -1.653 -13.790
  601   2HA   GLY  77          1HA       GLY  77  11.873  -2.313 -12.211
  602    H    THR  78           H        THR  78   9.891  -0.859 -11.227
  603    HA   THR  78           HA       THR  78   7.558  -1.579 -12.503
  604    HB   THR  78           HB       THR  78   7.767  -0.380 -10.260
  605    HG1  THR  78           HG1      THR  78   5.726  -0.695 -10.791
  606   1HG2  THR  78          1HG2      THR  78   7.093   2.196 -11.421
  607   2HG2  THR  78          2HG2      THR  78   8.710   1.684 -11.904
  608   3HG2  THR  78          3HG2      THR  78   8.299   1.811 -10.194
  609    H    LYS  79           H        LYS  79   6.084  -0.559 -13.940
  610    HA   LYS  79           HA       LYS  79   7.362   1.484 -15.708
  611   1HB   LYS  79          2HB       LYS  79   5.581  -0.870 -16.316
  612   2HB   LYS  79          1HB       LYS  79   5.631   0.515 -17.407
  613   1HG   LYS  79          2HG       LYS  79   7.439  -0.469 -18.339
  614   2HG   LYS  79          1HG       LYS  79   8.310   0.025 -16.887
  615   1HD   LYS  79          2HD       LYS  79   8.726  -2.219 -16.719
  616   2HD   LYS  79          1HD       LYS  79   7.130  -2.230 -15.966
  617   1HE   LYS  79          2HE       LYS  79   6.392  -3.584 -17.602
  618   2HE   LYS  79          1HE       LYS  79   6.718  -2.309 -18.777
  619   1HZ   LYS  79          1HZ       LYS  79   9.130  -3.558 -17.998
  620   2HZ   LYS  79          2HZ       LYS  79   8.438  -3.442 -19.546
  621   3HZ   LYS  79          3HZ       LYS  79   8.026  -4.734 -18.522
  622    H    MET  80           H        MET  80   5.185   1.234 -13.293
  623    HA   MET  80           HA       MET  80   2.954   2.640 -14.536
  624   1HB   MET  80          2HB       MET  80   1.980   2.723 -12.313
  625   2HB   MET  80          1HB       MET  80   2.688   1.137 -12.567
  626   1HG   MET  80          2HG       MET  80   4.562   1.627 -11.233
  627   2HG   MET  80          1HG       MET  80   4.180   3.332 -11.181
  628   1HE   MET  80          1HE       MET  80   3.003   3.975  -8.235
  629   2HE   MET  80          2HE       MET  80   1.537   4.080  -9.207
  630   3HE   MET  80          3HE       MET  80   3.099   4.443  -9.939
  631    H    ILE  81           H        ILE  81   2.995   4.702 -15.043
  632    HA   ILE  81           HA       ILE  81   5.067   6.485 -13.930
  633    HB   ILE  81           HB       ILE  81   2.946   7.161 -15.986
  634   1HG1  ILE  81          2HG1      ILE  81   5.727   6.423 -16.784
  635   2HG1  ILE  81          1HG1      ILE  81   4.632   5.105 -16.361
  636   1HG2  ILE  81          1HG2      ILE  81   5.056   8.608 -14.700
  637   2HG2  ILE  81          2HG2      ILE  81   3.950   9.172 -15.952
  638   3HG2  ILE  81          3HG2      ILE  81   5.476   8.412 -16.401
  639   1HD1  ILE  81          1HD1      ILE  81   4.767   6.313 -18.838
  640   2HD1  ILE  81          2HD1      ILE  81   3.399   7.135 -18.089
  641   3HD1  ILE  81          3HD1      ILE  81   3.396   5.379 -18.242
  642    H    PHE  82           H        PHE  82   3.506   5.908 -11.889
  643    HA   PHE  82           HA       PHE  82   1.175   7.647 -11.665
  644   1HB   PHE  82          2HB       PHE  82   1.457   5.438 -10.487
  645   2HB   PHE  82          1HB       PHE  82   2.682   6.200  -9.473
  646    HD1  PHE  82           HD1      PHE  82  -0.802   6.862 -10.697
  647    HD2  PHE  82           HD2      PHE  82   1.997   7.092  -7.449
  648    HE1  PHE  82           HE1      PHE  82  -2.585   7.754  -9.225
  649    HE2  PHE  82           HE2      PHE  82   0.215   7.987  -5.976
  650    HZ   PHE  82           HZ       PHE  82  -2.072   8.310  -6.866
  651    H    VAL  83           H        VAL  83   1.030   9.534 -10.373
  652    HA   VAL  83           HA       VAL  83   3.565  11.011 -10.105
  653    HB   VAL  83           HB       VAL  83   2.100  12.922  -9.563
  654   1HG1  VAL  83          1HG1      VAL  83   0.582  11.782 -11.809
  655   2HG1  VAL  83          2HG1      VAL  83   2.331  11.640 -11.986
  656   3HG1  VAL  83          3HG1      VAL  83   1.594  13.225 -11.753
  657   1HG2  VAL  83          1HG2      VAL  83  -0.468  12.128 -10.034
  658   2HG2  VAL  83          2HG2      VAL  83   0.225  12.293  -8.421
  659   3HG2  VAL  83          3HG2      VAL  83   0.166  10.711  -9.198
  660    H    GLY  84           H        GLY  84   2.795  12.637  -7.865
  661   1HA   GLY  84          2HA       GLY  84   2.706  10.649  -5.641
  662   2HA   GLY  84          1HA       GLY  84   3.963  11.887  -5.668
  663    H    ILE  85           H        ILE  85   1.091  11.197  -4.256
  664    HA   ILE  85           HA       ILE  85  -0.243  13.776  -4.461
  665    HB   ILE  85           HB       ILE  85  -0.601  11.720  -2.266
  666   1HG1  ILE  85          2HG1      ILE  85  -2.220  11.778  -4.806
  667   2HG1  ILE  85          1HG1      ILE  85  -0.704  10.879  -4.747
  668   1HG2  ILE  85          1HG2      ILE  85  -2.416  13.801  -3.526
  669   2HG2  ILE  85          2HG2      ILE  85  -1.733  13.852  -1.899
  670   3HG2  ILE  85          3HG2      ILE  85  -2.929  12.624  -2.316
  671   1HD1  ILE  85          1HD1      ILE  85  -3.161   9.905  -3.937
  672   2HD1  ILE  85          2HD1      ILE  85  -2.419  10.397  -2.416
  673   3HD1  ILE  85          3HD1      ILE  85  -1.598   9.241  -3.463
  674    H    LYS  86           H        LYS  86   0.082  15.562  -3.186
  675    HA   LYS  86           HA       LYS  86   2.386  15.529  -1.360
  676   1HB   LYS  86          2HB       LYS  86   1.219  17.447  -3.015
  677   2HB   LYS  86          1HB       LYS  86   0.810  17.983  -1.385
  678   1HG   LYS  86          2HG       LYS  86   3.163  17.864  -0.722
  679   2HG   LYS  86          1HG       LYS  86   3.599  17.250  -2.318
  680   1HD   LYS  86          2HD       LYS  86   4.016  19.479  -2.696
  681   2HD   LYS  86          1HD       LYS  86   2.294  19.471  -3.075
  682   1HE   LYS  86          2HE       LYS  86   2.080  19.855  -0.447
  683   2HE   LYS  86          1HE       LYS  86   3.696  20.527  -0.656
  684   1HZ   LYS  86          1HZ       LYS  86   2.855  22.331  -1.602
  685   2HZ   LYS  86          2HZ       LYS  86   1.305  21.784  -1.174
  686   3HZ   LYS  86          3HZ       LYS  86   1.944  21.421  -2.706
  687    H    LYS  87           H        LYS  87  -1.129  15.785  -1.166
  688    HA   LYS  87           HA       LYS  87  -1.207  16.507   1.627
  689   1HB   LYS  87          2HB       LYS  87  -3.070  16.327  -0.397
  690   2HB   LYS  87          1HB       LYS  87  -3.490  14.953   0.627
  691   1HG   LYS  87          2HG       LYS  87  -4.537  16.400   2.000
  692   2HG   LYS  87          1HG       LYS  87  -2.950  17.051   2.411
  693   1HD   LYS  87          2HD       LYS  87  -3.960  18.979   1.631
  694   2HD   LYS  87          1HD       LYS  87  -3.291  18.366   0.119
  695   1HE   LYS  87          2HE       LYS  87  -5.375  17.525  -0.602
  696   2HE   LYS  87          1HE       LYS  87  -6.057  17.574   1.023
  697   1HZ   LYS  87          1HZ       LYS  87  -6.122  19.562  -0.951
  698   2HZ   LYS  87          2HZ       LYS  87  -5.220  20.153   0.360
  699   3HZ   LYS  87          3HZ       LYS  87  -6.807  19.597   0.599
  700    H    LYS  88           H        LYS  88  -0.196  15.153   3.060
  701    HA   LYS  88           HA       LYS  88   0.076  12.327   2.742
  702   1HB   LYS  88          2HB       LYS  88   1.373  13.883   4.327
  703   2HB   LYS  88          1HB       LYS  88  -0.014  13.750   5.410
  704   1HG   LYS  88          2HG       LYS  88   0.715  11.129   4.470
  705   2HG   LYS  88          1HG       LYS  88   2.137  11.928   5.143
  706   1HD   LYS  88          2HD       LYS  88   0.129  12.587   6.942
  707   2HD   LYS  88          1HD       LYS  88  -0.244  10.917   6.512
  708   1HE   LYS  88          2HE       LYS  88   1.274  10.849   8.382
  709   2HE   LYS  88          1HE       LYS  88   2.184  10.359   6.953
  710   1HZ   LYS  88          1HZ       LYS  88   3.167  12.122   8.541
  711   2HZ   LYS  88          2HZ       LYS  88   2.109  13.191   7.751
  712   3HZ   LYS  88          3HZ       LYS  88   3.295  12.356   6.866
  713    H    GLU  89           H        GLU  89  -2.495  14.321   4.010
  714    HA   GLU  89           HA       GLU  89  -3.898  12.402   5.554
  715   1HB   GLU  89          2HB       GLU  89  -4.494  14.977   4.273
  716   2HB   GLU  89          1HB       GLU  89  -5.893  13.910   4.382
  717   1HG   GLU  89          2HG       GLU  89  -5.843  15.181   6.417
  718   2HG   GLU  89          1HG       GLU  89  -5.296  13.555   6.825
  719    H    GLU  90           H        GLU  90  -4.377  13.282   2.111
  720    HA   GLU  90           HA       GLU  90  -6.281  11.215   1.583
  721   1HB   GLU  90          2HB       GLU  90  -4.317  12.451  -0.371
  722   2HB   GLU  90          1HB       GLU  90  -5.838  11.651  -0.771
  723   1HG   GLU  90          2HG       GLU  90  -7.130  13.380   0.259
  724   2HG   GLU  90          1HG       GLU  90  -5.703  14.082   1.025
  725    H    ARG  91           H        ARG  91  -2.755  11.262   1.586
  726    HA   ARG  91           HA       ARG  91  -2.290   8.811   0.221
  727   1HB   ARG  91          2HB       ARG  91  -0.679  10.683   1.350
  728   2HB   ARG  91          1HB       ARG  91  -0.561   9.406   2.560
  729   1HG   ARG  91          2HG       ARG  91  -0.301   8.671  -0.333
  730   2HG   ARG  91          1HG       ARG  91   1.071   9.427   0.477
  731   1HD   ARG  91          2HD       ARG  91  -0.370   6.919   1.388
  732   2HD   ARG  91          1HD       ARG  91   1.232   6.986   0.654
  733    HE   ARG  91           HE       ARG  91   1.811   8.454   2.725
  734   1HH1  ARG  91          1HH2      ARG  91  -0.865   8.185   4.013
  735   2HH1  ARG  91          2HH2      ARG  91  -0.627   6.848   5.088
  736   1HH2  ARG  91          1HH1      ARG  91   2.266   5.761   3.512
  737   2HH2  ARG  91          2HH1      ARG  91   1.149   5.474   4.804
  738    H    ALA  92           H        ALA  92  -2.903   9.470   3.670
  739    HA   ALA  92           HA       ALA  92  -2.634   6.793   4.588
  740   1HB   ALA  92          1HB       ALA  92  -4.673   8.673   5.752
  741   2HB   ALA  92          2HB       ALA  92  -2.952   9.028   5.916
  742   3HB   ALA  92          3HB       ALA  92  -3.612   7.535   6.585
  743    H    ASP  93           H        ASP  93  -5.465   8.565   3.354
  744    HA   ASP  93           HA       ASP  93  -7.438   6.606   3.779
  745   1HB   ASP  93          2HB       ASP  93  -7.082   8.917   2.007
  746   2HB   ASP  93          1HB       ASP  93  -8.099   7.658   1.304
  747    H    LEU  94           H        LEU  94  -5.016   6.843   1.199
  748    HA   LEU  94           HA       LEU  94  -6.037   4.683  -0.397
  749   1HB   LEU  94          2HB       LEU  94  -3.147   5.561  -0.128
  750   2HB   LEU  94          1HB       LEU  94  -3.876   4.714  -1.491
  751    HG   LEU  94           HG       LEU  94  -4.742   7.464  -0.557
  752   1HD1  LEU  94          1HD1      LEU  94  -2.327   6.988  -1.641
  753   2HD1  LEU  94          2HD1      LEU  94  -3.265   8.430  -2.032
  754   3HD1  LEU  94          3HD1      LEU  94  -3.284   7.043  -3.122
  755   1HD2  LEU  94          1HD2      LEU  94  -6.158   5.688  -2.018
  756   2HD2  LEU  94          2HD2      LEU  94  -5.206   6.422  -3.308
  757   3HD2  LEU  94          3HD2      LEU  94  -6.244   7.426  -2.296
  758    H    ILE  95           H        ILE  95  -3.365   4.782   1.980
  759    HA   ILE  95           HA       ILE  95  -2.856   1.974   1.964
  760    HB   ILE  95           HB       ILE  95  -2.413   4.098   4.078
  761   1HG1  ILE  95          2HG1      ILE  95  -1.098   4.327   2.012
  762   2HG1  ILE  95          1HG1      ILE  95  -0.053   3.831   3.347
  763   1HG2  ILE  95          1HG2      ILE  95  -2.192   1.177   4.228
  764   2HG2  ILE  95          2HG2      ILE  95  -2.148   2.373   5.524
  765   3HG2  ILE  95          3HG2      ILE  95  -0.682   2.001   4.616
  766   1HD1  ILE  95          1HD1      ILE  95   0.514   2.425   1.495
  767   2HD1  ILE  95          2HD1      ILE  95  -1.183   2.097   1.143
  768   3HD1  ILE  95          3HD1      ILE  95  -0.440   1.434   2.599
  769    H    ALA  96           H        ALA  96  -4.122   3.602   4.819
  770    HA   ALA  96           HA       ALA  96  -5.288   1.592   6.198
  771   1HB   ALA  96          1HB       ALA  96  -7.329   3.557   6.154
  772   2HB   ALA  96          2HB       ALA  96  -5.798   4.408   5.948
  773   3HB   ALA  96          3HB       ALA  96  -6.046   3.364   7.348
  774    H    TYR  97           H        TYR  97  -6.710   3.002   3.263
  775    HA   TYR  97           HA       TYR  97  -9.205   1.684   3.328
  776   1HB   TYR  97          2HB       TYR  97  -9.026   3.281   1.633
  777   2HB   TYR  97          1HB       TYR  97  -7.435   2.720   1.130
  778    HD1  TYR  97           HD1      TYR  97  -7.625   2.060  -1.122
  779    HD2  TYR  97           HD2      TYR  97 -10.615   0.829   1.705
  780    HE1  TYR  97           HE1      TYR  97  -8.667   0.620  -2.848
  781    HE2  TYR  97           HE2      TYR  97 -11.652  -0.608  -0.024
  782    HH   TYR  97           HH       TYR  97 -11.239  -0.319  -3.149
  783    H    LEU  98           H        LEU  98  -6.236   0.653   1.623
  784    HA   LEU  98           HA       LEU  98  -7.329  -1.993   1.119
  785   1HB   LEU  98          2HB       LEU  98  -4.562  -0.808   0.829
  786   2HB   LEU  98          1HB       LEU  98  -4.935  -2.481   0.408
  787    HG   LEU  98           HG       LEU  98  -6.795  -0.447  -0.675
  788   1HD1  LEU  98          1HD1      LEU  98  -4.332  -0.768  -2.273
  789   2HD1  LEU  98          2HD1      LEU  98  -4.168   0.230  -0.828
  790   3HD1  LEU  98          3HD1      LEU  98  -5.361   0.649  -2.057
  791   1HD2  LEU  98          1HD2      LEU  98  -6.981  -2.841  -1.214
  792   2HD2  LEU  98          2HD2      LEU  98  -5.334  -2.835  -1.845
  793   3HD2  LEU  98          3HD2      LEU  98  -6.595  -1.913  -2.663
  794    H    LYS  99           H        LYS  99  -5.872  -0.520   3.815
  795    HA   LYS  99           HA       LYS  99  -4.646  -2.904   4.920
  796   1HB   LYS  99          2HB       LYS  99  -4.270  -0.328   5.488
  797   2HB   LYS  99          1HB       LYS  99  -5.555  -0.641   6.657
  798   1HG   LYS  99          2HG       LYS  99  -3.688  -2.814   6.752
  799   2HG   LYS  99          1HG       LYS  99  -2.794  -1.300   6.881
  800   1HD   LYS  99          2HD       LYS  99  -5.253  -1.928   8.532
  801   2HD   LYS  99          1HD       LYS  99  -3.606  -2.219   9.093
  802   1HE   LYS  99          2HE       LYS  99  -4.367   0.493   8.038
  803   2HE   LYS  99          1HE       LYS  99  -4.777   0.049   9.696
  804   1HZ   LYS  99          1HZ       LYS  99  -2.547   1.172   9.294
  805   2HZ   LYS  99          2HZ       LYS  99  -2.042  -0.307   8.630
  806   3HZ   LYS  99          3HZ       LYS  99  -2.547  -0.229  10.250
  807    H    LYS 100           H        LYS 100  -7.806  -1.679   4.583
  808    HA   LYS 100           HA       LYS 100  -8.816  -3.515   6.718
  809   1HB   LYS 100          2HB       LYS 100  -9.618  -0.832   5.813
  810   2HB   LYS 100          1HB       LYS 100 -10.966  -1.961   5.950
  811   1HG   LYS 100          2HG       LYS 100 -10.252  -2.519   8.255
  812   2HG   LYS 100          1HG       LYS 100  -8.934  -1.355   8.117
  813   1HD   LYS 100          2HD       LYS 100 -11.907  -0.790   8.073
  814   2HD   LYS 100          1HD       LYS 100 -10.722  -0.222   9.249
  815   1HE   LYS 100          2HE       LYS 100  -9.630   0.707   6.924
  816   2HE   LYS 100          1HE       LYS 100 -11.351   0.820   6.556
  817   1HZ   LYS 100          1HZ       LYS 100 -10.826   1.718   9.192
  818   2HZ   LYS 100          2HZ       LYS 100 -11.548   2.552   7.900
  819   3HZ   LYS 100          3HZ       LYS 100  -9.859   2.563   8.085
  820    H    ALA 101           H        ALA 101  -8.833  -2.764   3.313
  821    HA   ALA 101           HA       ALA 101 -11.042  -4.641   2.803
  822   1HB   ALA 101          1HB       ALA 101  -9.773  -2.440   1.356
  823   2HB   ALA 101          2HB       ALA 101 -11.396  -3.106   1.180
  824   3HB   ALA 101          3HB       ALA 101 -10.039  -3.858   0.341
  825    H    THR 102           H        THR 102  -7.610  -4.246   1.880
  826    HA   THR 102           HA       THR 102  -7.605  -7.141   1.138
  827    HB   THR 102           HB       THR 102  -5.262  -6.240   0.150
  828    HG1  THR 102           HG1      THR 102  -5.676  -4.123   0.880
  829   1HG2  THR 102          1HG2      THR 102  -6.731  -7.341  -1.308
  830   2HG2  THR 102          2HG2      THR 102  -6.678  -5.710  -1.974
  831   3HG2  THR 102          3HG2      THR 102  -8.048  -6.214  -0.984
  832    H    ASN 103           H        ASN 103  -7.366  -6.115   3.894
  833    HA   ASN 103           HA       ASN 103  -4.922  -7.554   4.591
  834   1HB   ASN 103          2HB       ASN 103  -3.977  -5.351   4.345
  835   2HB   ASN 103          1HB       ASN 103  -5.305  -4.625   5.252
  836   1HD2  ASN 103          1HD2      ASN 103  -3.100  -7.432   5.842
  837   2HD2  ASN 103          2HD2      ASN 103  -2.673  -6.948   7.412
  838    H    GLU 104           HN       GLU 104  -7.598  -5.535   5.811
  839    HA   GLU 104           HA       GLU 104  -7.900  -7.525   8.024
  840   1HB   GLU 104          2HB       GLU 104  -7.371  -4.755   8.228
  841   2HB   GLU 104          1HB       GLU 104  -9.066  -4.962   8.671
  842   1HG   GLU 104          2HG       GLU 104  -7.795  -7.095   9.929
  843   2HG   GLU 104          1HG       GLU 104  -6.661  -5.758  10.128
  844    HHA  HEC 105           HHA      HEC 105   4.067  -2.791  -8.916
  845    HHB  HEC 105           HHB      HEC 105   1.078   1.144  -5.002
  846    HHC  HEC 105           HHC      HEC 105  -2.076   3.636  -9.887
  847    HHD  HEC 105           HHD      HEC 105   0.908  -0.308 -13.820
  848   1HMA  HEC 105          1HMA      HEC 105   3.541   0.118  -4.020
  849   2HMA  HEC 105          2HMA      HEC 105   3.413  -1.639  -3.930
  850   3HMA  HEC 105          3HMA      HEC 105   1.962  -0.643  -3.821
  851   1HAA  HEC 105          1HAA      HEC 105   4.575  -2.666  -5.202
  852   2HAA  HEC 105          2HAA      HEC 105   5.372  -2.396  -6.738
  853   1HBA  HEC 105          1HBA      HEC 105   4.884  -4.556  -7.162
  854   2HBA  HEC 105          2HBA      HEC 105   3.238  -3.989  -7.450
  855   1HMB  HEC 105          1HMB      HEC 105  -0.671   2.164  -4.247
  856   2HMB  HEC 105          2HMB      HEC 105  -1.882   3.374  -4.672
  857   3HMB  HEC 105          3HMB      HEC 105  -0.182   3.831  -4.552
  858    HAB  HEC 105           HAB      HEC 105  -2.568   4.762  -8.208
  859   1HBB  HEC 105          1HBB      HEC 105  -1.014   5.722  -6.435
  860   2HBB  HEC 105          2HBB      HEC 105  -2.225   5.161  -5.284
  861   3HBB  HEC 105          3HBB      HEC 105  -2.670   6.317  -6.538
  862   1HMC  HEC 105          1HMC      HEC 105  -2.094   4.076 -13.433
  863   2HMC  HEC 105          2HMC      HEC 105  -3.355   2.973 -12.883
  864   3HMC  HEC 105          3HMC      HEC 105  -2.643   4.127 -11.757
  865    HAC  HEC 105           HAC      HEC 105  -0.180   0.941 -14.972
  866   1HBC  HEC 105          1HBC      HEC 105  -0.519   2.729 -16.202
  867   2HBC  HEC 105          2HBC      HEC 105  -0.614   3.586 -14.663
  868   3HBC  HEC 105          3HBC      HEC 105  -2.091   3.064 -15.475
  869   1HMD  HEC 105          1HMD      HEC 105   2.138  -1.654 -14.562
  870   2HMD  HEC 105          2HMD      HEC 105   3.827  -2.078 -14.286
  871   3HMD  HEC 105          3HMD      HEC 105   2.571  -3.301 -14.106
  872   1HAD  HEC 105          1HAD      HEC 105   3.818  -4.467 -11.268
  873   2HAD  HEC 105          2HAD      HEC 105   4.663  -3.660 -12.579
  874   1HBD  HEC 105          1HBD      HEC 105   5.398  -2.419 -10.094
  875   2HBD  HEC 105          2HBD      HEC 105   6.418  -3.274 -11.246